A0A093HU06_STRCA Loading...

Metalloendopeptidase

AlphaFold DB , UniProt , Accession A0A093HU06, Species STRCA (Struthio camelus australis), Gene n/a, Length 1,009 aa.

						>A0A093HU06_STRCA|A0A093HU06
MKMLCWRMALWLAGWTFCGKPSSCSGLDYDYTYDFTEEDKAEAIDYKDPCKAAVFWGDIALDDEDLKIFQIDRTIDLTQHSNERLGHNTGGFGDHRISKKRGALYQLIDRIRRFGSGFEQNNTSKGRTTVKFSGKNEKNRFPRAATSRTERIWPGGVIPYVIGGNFTGSQRAMFKQAMRHWEKYTCVTFIERSDEESYIVFTYRPCGCCSYVGRRGNGPQAISIGKNCDKFGIVVHELGHVIGFWHEHTRPDRDDHVTIIRENIQPGQEYNFLKMEPGEVNSLGEPYDFDSIMHYARNTFSRGMFLDTILPSRDDNGIRPAIGQRTRLSKGDIAQARKLYRCPACGETLQESTGNFSSPGFPNGYPSYTHCIWRISVTPGEKIVLNFTTMDLYKSSLCWYDYIEVRDGYWRKSPLLGRFCGDKLPEVLASTDSRMWIEFRSSSNWVGKGFAAIYEAICGGEIHKNEGQIQSPNYPDDYRPMKECVWKITVSENYNVGLTFQAFEIERHDNCAYDYLEIRDGTNENSPLIGHFCGYDKPEDIRSTSNTLWMKFVSDGTVNKAGFAANFFKEEDECAKPDNGGCEQRCVNTLGSYQCACDPGYELGPDKKSCEAACGGLLTKLNGTITTPGWPKEYPPNKNCVWQVVAPTQYRISMKFEFFELEGNEVCKYDYVEIRSGLSSDSKLHGKFCGTEVPEVVTSQYNNMRIEFRSDNTVSKKGFKAHFFSDKDECSKDNGGCQHECINTVGSYVCQCRNGFVLHENKHDCKEAECEQKIHSPNGFITSPNWPDKYPSRKECTWEISATPGQRVKLTFNEFEIEQHQECAYDHLEVFDGETEKSPILGRLCGNKLPDPLIATGNKMFLRFISDASVQRKGFQATHSTECGGRLKAETKPKDLYSHAQFGDNNYPVQADCDWLLVAERGCRVELSFQTFEVEEEADCGYDYVELFDGHDKSAMRLGRFCGSGPPEEIYSAGEAVLLHFHTDDTINKKGFHIRYRSIKYPDSMHTKK
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.7	Very low	28.3	Very low	243 Å²	243	160 Å²	160	100%	1.197	76%	0.764	S	S	*	*				0	144.1	0	-164.9	155.4	158.1	0	0	107.5
2	K	29.9	Very low	28.2	Very low	178 Å²	178	158.2 Å²	158.2	77%	0.774	76%	0.76	S	S	*	*			trans	-17.9	148.4	176.6	-67.3	175.5	178.3	178.5	0	117.2
3	M	27.1	Very low	28.2	Very low	146 Å²	146	153.5 Å²	153.5	72%	0.719	76%	0.764	S	S	*	*			cis	-168.1	141.1	14.2	-121.5	162.9	169.7	0	0	112.8
4	L	31.2	Very low	28	Very low	150 Å²	150	147.4 Å²	147.4	79%	0.785	76%	0.759	S	S	*	*			trans	58.1	120.3	130.1	-107.4	87.1	0	0	0	125.5
5	C	26.8	Very low	27.9	Very low	91 Å²	91	153.7 Å²	153.7	62%	0.615	77%	0.77	S	S	*	*				113.2	128.1	112.6	-127.9	0	0	0	0	123.3
6	W	25.5	Very low	27.8	Very low	196 Å²	196	151.1 Å²	151.1	74%	0.742	76%	0.764	S	S	*	*			trans	70	115	147.3	-83.1	-1.7	0	0	0	121.5
7	R	28.7	Very low	27.6	Very low	188 Å²	188	154.4 Å²	154.4	71%	0.709	77%	0.773	S	S	*	*				83.5	142.6	75.4	-85.6	-169.1	-177.3	175.7	-3.8	111.3
8	M	28.1	Very low	27.5	Very low	146 Å²	146	152.7 Å²	152.7	72%	0.719	78%	0.776	S	S	*	*			cis	-154.6	179	5.8	-117	-180	-38.3	0	0	108	L10	M8-L10 HydrophobicContact CG-CD1 4.26Å; M8-L10 HydrophobicContact SD-CD1 4.31Å
9	A	29.9	Very low	27.3	Very low	78 Å²	78	148.6 Å²	148.6	65%	0.645	78%	0.776	S	S	*	*			cis	-149.8	154.5	7.5	0	0	0	0	0	109.1
10	L	29.5	Very low	27.1	Very low	132 Å²	132	151.2 Å²	151.2	69%	0.691	78%	0.781	S	S	*	*				60.8	131.1	83.8	-74.4	121	0	0	0	116.4	M8	M8-L10 HydrophobicContact CG-CD1 4.26Å; M8-L10 HydrophobicContact SD-CD1 4.31Å
11	W	27.5	Very low	27.5	Very low	212 Å²	212	149.8 Å²	149.8	80%	0.803	78%	0.781	S	S	*	*			cis	-176.5	-177.9	-10.7	-134.6	45	0	0	0	112.9
12	L	26.1	Very low	27.3	Very low	138 Å²	138	143.6 Å²	143.6	72%	0.723	76%	0.762	S	S	*	*			trans	74.1	115.3	165.1	-61.8	160	0	0	0	116.9
13	A	28.5	Very low	27	Very low	98 Å²	98	140.9 Å²	140.9	81%	0.81	77%	0.765	S	S	*	*			cis	84.2	134.4	23.3	0	0	0	0	0	116.5
14	G	26	Very low	26.8	Very low	67 Å²	67	139.6 Å²	139.6	69%	0.691	77%	0.769	S	S	*	*			trans	165.9	87.4	168.4	0	0	0	0	0	118.7
15	W	26.1	Very low	26.4	Very low	243 Å²	243	137.9 Å²	137.9	92%	0.92	77%	0.77	S	S	*	*			trans	81.1	94.9	130.9	-70.4	19.1	0	0	0	122.9
16	T	26.8	Very low	26.2	Very low	112 Å²	112	136.8 Å²	136.8	69%	0.687	77%	0.774	S	S	*	*				54.2	142.2	110.1	59.4	0	0	0	0	125.2
17	F	24.9	Very low	26.1	Very low	207 Å²	207	134.8 Å²	134.8	91%	0.908	78%	0.777	S	S	*	*			trans	103.5	143.6	142.3	-98.7	-73	0	0	0	119.8
18	C	24.8	Very low	25.9	Very low	124 Å²	124	131.9 Å²	131.9	84%	0.838	78%	0.776	S	S	*	*			trans	-104.8	148.9	-159.4	-174.6	0	0	0	0	111.8
19	G	23.1	Very low	25.6	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	79%	0.786	S	S	*	*			trans	-172.7	100.6	174.8	0	0	0	0	0	114.8
20	K	24.6	Very low	25.3	Very low	201 Å²	201	138.5 Å²	138.5	87%	0.874	79%	0.787	S	S	*	*			trans	-99.3	168.5	150.6	-75	-174.9	175.8	-177.6	0	107.4
21	P	34.4	Very low	25	Very low	122 Å²	122	143 Å²	143	79%	0.792	80%	0.796	S	S	*	*			cis	-136.4	-172.1	12.5	36.2	-13.5	0	0	0	116.5
22	S	24.8	Very low	24.8	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	79%	0.79	S	S	*	*			trans	-57.4	151.9	-179.5	49.3	0	0	0	0	120.2
23	S	22.9	Very low	24.7	Very low	120 Å²	120	142.2 Å²	142.2	84%	0.839	80%	0.797	S	S	*	*				-171.3	166.9	118.4	-160.5	0	0	0	0	113.2
24	C	22	Very low	24.4	Very low	120 Å²	120	143.3 Å²	143.3	81%	0.811	79%	0.79	S	S	*	*			trans	-74.6	178.3	-175	-47.1	0	0	0	0	113.2
25	S	24	Very low	24.6	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	80%	0.798	S	S	*	*			cis	-173.2	150.5	25.9	43.7	0	0	0	0	113.1
26	G	23.1	Very low	24.5	Very low	68 Å²	68	144.2 Å²	144.2	70%	0.701	79%	0.793	S	S	*	*			trans	70.9	154.7	160.2	0	0	0	0	0	116.7
27	L	23.4	Very low	24.3	Very low	153 Å²	153	146.8 Å²	146.8	80%	0.801	80%	0.797	S	S	*	*			cis	-158.6	159.8	3.8	-67.6	-179.5	0	0	0	106.1
28	D	22.9	Very low	24.5	Very low	128 Å²	128	144.2 Å²	144.2	68%	0.684	79%	0.788	S	S	*	*			cis	-165.5	155.9	-10.7	-94.7	-17.6	0	0	0	108.1
29	Y	23.3	Very low	24.6	Very low	237 Å²	237	146.7 Å²	146.7	93%	0.929	79%	0.793	S	S	*	*			trans	-174.5	121.5	143.5	-114	-76.8	0	0	0	111
30	D	22.4	Very low	24.7	Very low	125 Å²	125	152 Å²	152	67%	0.668	80%	0.795	S	S	*	*			trans	-102.8	141.4	177.7	-179.7	21.9	0	0	0	110.5
31	Y	23.3	Very low	24.8	Very low	227 Å²	227	147 Å²	147	89%	0.89	79%	0.792	S	S	*	*			trans	-165.5	127.9	142.4	-117.8	-76.2	0	0	0	110.9
32	T	23.2	Very low	24.4	Very low	111 Å²	111	150.5 Å²	150.5	68%	0.681	80%	0.797	S	S	*	*			trans	-97.6	141.6	173.4	24.5	0	0	0	0	111
33	Y	23.6	Very low	24.9	Very low	222 Å²	222	149.8 Å²	149.8	87%	0.871	80%	0.798	S	S	*	*			trans	171.7	158.8	157	-121	-111.2	0	0	0	107.9
34	D	22.5	Very low	25.1	Very low	121 Å²	121	151.8 Å²	151.8	65%	0.647	80%	0.798	S	S	*	*			cis	-160.2	166.7	-42.8	-169.2	5.8	0	0	0	105.8	T36	D34-T36 PolarHBondContact O-N 2.83Å
35	F	29.9	Very low	25.4	Very low	195 Å²	195	151.3 Å²	151.3	86%	0.855	79%	0.787	S	S	*	*			trans	-73.8	116.6	176.2	-104.7	-103.1	0	0	0	111.2
36	T	25	Very low	26	Very low	134 Å²	134	154.6 Å²	154.6	82%	0.822	78%	0.783	S	S	*	*			trans	178.8	165.9	142.5	20.3	0	0	0	0	114.2	D34	D34-T36 PolarHBondContact O-N 2.83Å
37	E	23	Very low	26.7	Very low	167 Å²	167	155.5 Å²	155.5	78%	0.78	77%	0.768	S	S	*	*			trans	72.2	107.5	167.6	-66.5	-165.4	174.2	0	0	117.6
38	E	28.2	Very low	27.4	Very low	152 Å²	152	150.8 Å²	150.8	71%	0.71	74%	0.743	S	S	*	*				88.2	76.2	86.4	-76.4	-159.2	164.4	0	0	113.1	K40	E38-K40 PolarHBondContact O-N 2.93Å
39	D	27.1	Very low	28.5	Very low	177 Å²	177	147.2 Å²	147.2	95%	0.947	73%	0.727	S	S	*	*			trans	-76.4	116.2	159.1	-94.1	-37.1	0	0	0	110.3	A41	D39-A41 PolarHBondContact O-N 3.48Å
40	K	24.3	Very low	29.1	Very low	184 Å²	184	137.2 Å²	137.2	80%	0.8	69%	0.692	S	S	*	*			trans	-64.6	129.1	-171.5	-73	157.8	-177.8	156.2	0	111.8	E38 E42	E38-K40 PolarHBondContact O-N 2.93Å; K40-E42 PolarHBondContact O-N 2.93Å; K40-E42 VanDerWaalsContact O-N 3.14Å
41	A	27.3	Very low	29.7	Very low	98 Å²	98	139.6 Å²	139.6	81%	0.81	70%	0.696	S	S	*	*			trans	-66.6	108.8	169.8	0	0	0	0	0	111.2	D39 A43	D39-A41 PolarHBondContact O-N 3.48Å; A41-A43 PolarHBondContact O-N 3.24Å
42	E	25.8	Very low	30.2	Very low	195 Å²	195	131.3 Å²	131.3	91%	0.911	68%	0.675	S	S	*	*			trans	-70.4	109.4	157.1	-73.1	-164	144.2	0	0	109.1	K40 I44	K40-E42 PolarHBondContact O-N 2.93Å; K40-E42 VanDerWaalsContact O-N 3.14Å; E42-I44 PolarHBondContact O-N 3.37Å
43	A	35.8	Very low	30.4	Very low	97 Å²	97	129.5 Å²	129.5	80%	0.802	67%	0.671	S	S	*	*			trans	-87	93.7	-175.5	0	0	0	0	0	112.3	A41	A41-A43 PolarHBondContact O-N 3.24Å
44	I	26.9	Very low	30.9	Very low	163 Å²	163	123.5 Å²	123.5	84%	0.836	66%	0.658	S	S	*	*			trans	-135	124.3	166	-62.3	-174	0	0	0	113.5	E42	E42-I44 PolarHBondContact O-N 3.37Å
45	D	28.7	Very low	31.6	Very low	109 Å²	109	123.9 Å²	123.9	58%	0.583	65%	0.654	S	S	*	*			trans	50.8	107.6	155.7	-151.8	21.7	0	0	0	121.7	K47	D45-K47 PolarHBondContact O-N 3.39Å; D45-K47 IonicContact OD1-NZ 2.66Å; D45-K47 PolarHBondContact OD1-NZ 3.17Å; D45-K47 IonicContact OD2-NZ 3.43Å; D45-K47 PolarHBondContact OD2-NZ 3.09Å
46	Y	36.2	Very low	31.9	Very low	183 Å²	183	123.2 Å²	123.2	72%	0.718	65%	0.646	S	S	*	*			trans	-61.4	112.3	168.5	-171.6	-84.9	0	0	0	112.7	Y270	Y46-Y270 WeakPolarHBondContact OH-CD2 3.37Å; Y46-Y270 WeakPolarHBondContact OH-CE2 3.31Å
47	K	38.5	Very low	32.5	Very low	88 Å²	88	117.7 Å²	117.7	38%	0.383	62%	0.615	S	S	.	*			trans	-163.9	61.1	166.3	-92.5	122.2	-158.5	153.7	0	114.2	D45	D45-K47 PolarHBondContact O-N 3.39Å; D45-K47 IonicContact OD1-NZ 2.66Å; D45-K47 PolarHBondContact OD1-NZ 3.17Å; D45-K47 IonicContact OD2-NZ 3.43Å; D45-K47 PolarHBondContact OD2-NZ 3.09Å
48	D	37.9	Very low	33.5	Very low	53 Å²	53	111.7 Å²	111.7	28%	0.283	59%	0.588	S	S	.	*			trans	-141.6	97	157.7	-161.7	0.5	0	0	0	112.6	C50 K51 Y211	D48-C50 PolarHBondContact O-N 2.03Å; D48-C50 VanDerWaalsContact O-N 3.14Å; D48-C50 WeakPolarHBondContact OD1-CB 3.34Å; D48-C50 PolarHBondContact OD1-N 3.37Å; D48-C50 VanDerWaalsContact OD1-N 3.13Å; D48-K51 HydrophobicContact CB-CB 4.23Å; D48-K51 HydrophobicContact CB-CD 4.07Å; D48-K51 HydrophobicContact CB-CG 4.1Å; D48-K51 PolarHBondContact O-N 3.24Å; D48-K51 VanDerWaalsContact O-N 3.11Å; D48-K51 WeakPolarHBondContact OD2-CG 3.37Å; D48-Y211 PolarHBondContact OD1-OH 3.49Å
49	P	45.5	Very low	34.3	Very low	53 Å²	53	106.6 Å²	106.6	34%	0.344	57%	0.565	S	S	.	*	G	3₁₀ helix	trans	-64.6	-15	176.5	29.6	-33.3	0	0	0	112.4	Y211	P49-Y211 HydrophobicContact CG-CD1 3.96Å; P49-Y211 HydrophobicContact CG-CE1 3.82Å; P49-Y211 HydrophobicContact CG-CG 4.48Å
50	C	36.7	Very low	34.9	Very low	28 Å²	28	99.4 Å²	99.4	19%	0.189	53%	0.53	C	S	.	.	G	3₁₀ helix	trans	-83.7	-3.1	175.4	-65.5	0	0	0	0	114.4	D48 R204	D48-C50 PolarHBondContact O-N 2.03Å; D48-C50 VanDerWaalsContact O-N 3.14Å; D48-C50 WeakPolarHBondContact OD1-CB 3.34Å; D48-C50 PolarHBondContact OD1-N 3.37Å; D48-C50 VanDerWaalsContact OD1-N 3.13Å; C50-R204 WeakPolarHBondContact SG-CD 3.23Å; C50-R204 PolarHBondContact SG-NH1 3.25Å
51	K	34.6	Very low	35.6	Very low	174 Å²	174	94.1 Å²	94.1	76%	0.757	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-99.5	-4.3	178.2	-80.1	-177	-177	-174	0	114.6	D48	D48-K51 HydrophobicContact CB-CB 4.23Å; D48-K51 HydrophobicContact CB-CD 4.07Å; D48-K51 HydrophobicContact CB-CG 4.1Å; D48-K51 PolarHBondContact O-N 3.24Å; D48-K51 VanDerWaalsContact O-N 3.11Å; D48-K51 WeakPolarHBondContact OD2-CG 3.37Å
52	A	34.3	Very low	36.2	Very low	54 Å²	54	93.3 Å²	93.3	45%	0.446	49%	0.493	S	S	.	.	S	Bend	trans	-69.6	139.5	167.3	0	0	0	0	0	109.5
53	A	27.5	Very low	36.9	Very low	73 Å²	73	88.2 Å²	88.2	60%	0.603	47%	0.472	S	S	*	.			trans	-64.6	165.2	177	0	0	0	0	0	111.9	F55	A53-F55 HydrophobicContact CB-CE2 4.1Å; A53-F55 WeakPolarHBondContact O-CD2 3.25Å; A53-F55 PolarHBondContact O-N 2.88Å; A53-F55 VanDerWaalsContact O-N 3.08Å
54	V	33.2	Very low	37.3	Very low	96 Å²	96	90 Å²	90	58%	0.582	46%	0.464	S	S	*	.	S	Bend	trans	-52.1	105.4	-172.6	-177.2	0	0	0	0	113.2	P205	V54-P205 HydrophobicContact CG2-CB 4.24Å
55	F	37.9	Very low	38.1	Very low	129 Å²	129	83.9 Å²	83.9	57%	0.566	43%	0.432	S	S	*	.			trans	-144.1	147.7	174.3	-68.8	-65	0	0	0	114	A53 G57	A53-F55 HydrophobicContact CB-CE2 4.1Å; A53-F55 WeakPolarHBondContact O-CD2 3.25Å; A53-F55 PolarHBondContact O-N 2.88Å; A53-F55 VanDerWaalsContact O-N 3.08Å; F55-G57 PolarHBondContact O-N 2.7Å
56	W	35.8	Very low	38.8	Very low	181 Å²	181	80.8 Å²	80.8	69%	0.686	42%	0.416	S	S	*	.			trans	-100.6	52.2	-176	-69.4	23.1	0	0	0	111.2
57	G	37.2	Very low	39.1	Very low	17 Å²	17	77.6 Å²	77.6	18%	0.175	41%	0.405	C	S	.	.			trans	-71.1	-37.1	-167.3	0	0	0	0	0	116.1	F55	F55-G57 PolarHBondContact O-N 2.7Å
58	D	44.1	Very low	39.1	Very low	41 Å²	41	78.8 Å²	78.8	22%	0.219	42%	0.415	C	S	.	.	S	Bend	trans	-100.3	1.6	-160.9	-57.4	-71.5	0	0	0	114.9	A60 Y295	D58-A60 PolarHBondContact O-N 3.37Å; D58-Y295 PolarHBondContact OD1-OH 2.99Å
59	I	44.9	Very low	38.9	Very low	45 Å²	45	82.9 Å²	82.9	23%	0.231	43%	0.43	C	S	.	.			trans	-92.1	87.4	172.6	-53.2	178	0	0	0	109.2	N227 I233	I59-N227 HydrophobicContact CD1-CB 3.68Å; I59-I233 HydrophobicContact CG1-CD1 4.48Å
60	A	39.1	Very low	38.4	Very low	26 Å²	26	87.6 Å²	87.6	22%	0.215	45%	0.448	C	S	.	.			trans	-80.9	122.5	164.4	0	0	0	0	0	109.8	D58 A296	D58-A60 PolarHBondContact O-N 3.37Å; A60-A296 HydrophobicContact CB-CB 3.43Å; A60-A296 VanDerWaalsContact CB-CB 3.43Å
61	L	39.3	Very low	38.4	Very low	73 Å²	73	92.8 Å²	92.8	38%	0.382	47%	0.472	S	S	.	.			trans	-71.4	135.8	171.2	-60	176.9	0	0	0	109.6	D65 F69	L61-D65 HydrophobicContact CB-CB 3.76Å; L61-D65 HydrophobicContact CD2-CB 3.93Å; L61-D65 HydrophobicContact CG-CB 4.34Å; L61-F69 HydrophobicContact CD1-CE2 4.1Å
62	D	41.2	Very low	38.2	Very low	81 Å²	81	91.6 Å²	91.6	43%	0.433	47%	0.474	S	S	.	.			trans	-88.1	179.8	177.8	68.8	26.7	0	0	0	113.5	E64 D65 L66	D62-E64 PolarHBondContact O-N 3.28Å; D62-E64 VanDerWaalsContact O-N 3.13Å; D62-E64 WeakPolarHBondContact OD1-CA 3.41Å; D62-E64 WeakPolarHBondContact OD1-CB 3.05Å; D62-E64 PolarHBondContact OD1-N 3.46Å; D62-D65 PolarHBondContact N-OD2 3.27Å; D62-D65 PolarHBondContact O-N 2.81Å; D62-D65 PolarHBondContact OD1-N 2.78Å; D62-L66 WeakPolarHBondContact O-CB 3.43Å; D62-L66 WeakPolarHBondContact O-CG 3.29Å; D62-L66 PolarHBondContact O-N 2.8Å
63	D	38.9	Very low	38	Very low	88 Å²	88	99.9 Å²	99.9	47%	0.471	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-0.1	179.8	-70.8	-33.6	0	0	0	113.3	K67 R297	D63-K67 WeakPolarHBondContact O-CD 3.44Å; D63-K67 WeakPolarHBondContact O-CE 3.36Å; D63-K67 WeakPolarHBondContact O-CG 3Å; D63-K67 PolarHBondContact O-NZ 2.9Å; D63-K67 VanDerWaalsContact O-NZ 3.09Å; D63-R297 IonicContact OD1-NH2 3.83Å; D63-R297 PolarHBondContact OD1-NH2 3.25Å; D63-R297 IonicContact OD2-CZ 2.6Å; D63-R297 IonicContact OD2-NH2 3.42Å; D63-R297 PolarHBondContact OD2-NH2 2.84Å
64	E	44.6	Very low	38.3	Very low	136 Å²	136	102.1 Å²	102.1	64%	0.636	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-44.5	169	-58.3	-158.1	148.3	0	0	111.7	D62 L66 K67 I68	D62-E64 PolarHBondContact O-N 3.28Å; D62-E64 VanDerWaalsContact O-N 3.13Å; D62-E64 WeakPolarHBondContact OD1-CA 3.41Å; D62-E64 WeakPolarHBondContact OD1-CB 3.05Å; D62-E64 PolarHBondContact OD1-N 3.46Å; E64-L66 PolarHBondContact O-N 2.71Å; E64-K67 WeakPolarHBondContact O-CB 3.44Å; E64-K67 PolarHBondContact O-N 3.31Å; E64-I68 PolarHBondContact O-N 2.69Å
65	D	44.1	Very low	38.1	Very low	33 Å²	33	105.3 Å²	105.3	18%	0.176	51%	0.512	C	S	.	.	H	α-helix	trans	-51.9	-39.4	168.8	-77	-39.1	0	0	0	110.3	L61 D62 K67 I68 F69 K230	L61-D65 HydrophobicContact CB-CB 3.76Å; L61-D65 HydrophobicContact CD2-CB 3.93Å; L61-D65 HydrophobicContact CG-CB 4.34Å; D62-D65 PolarHBondContact N-OD2 3.27Å; D62-D65 PolarHBondContact O-N 2.81Å; D62-D65 PolarHBondContact OD1-N 2.78Å; D65-K67 PolarHBondContact O-N 3.03Å; D65-I68 PolarHBondContact O-N 3.16Å; D65-F69 WeakPolarHBondContact O-CD2 3.34Å; D65-K230 IonicContact OD1-NZ 3.09Å; D65-K230 PolarHBondContact OD1-NZ 3.47Å; D65-K230 IonicContact OD2-NZ 3.27Å; D65-K230 PolarHBondContact OD2-NZ 3.23Å
66	L	42.5	Very low	37.6	Very low	45 Å²	45	106.1 Å²	106.1	24%	0.236	52%	0.522	C	S	.	.	H	α-helix	trans	-68.5	-23.8	176.3	-74.7	171.5	0	0	0	115	D62 E64	D62-L66 WeakPolarHBondContact O-CB 3.43Å; D62-L66 WeakPolarHBondContact O-CG 3.29Å; D62-L66 PolarHBondContact O-N 2.8Å; E64-L66 PolarHBondContact O-N 2.71Å
67	K	42.9	Very low	37.2	Very low	115 Å²	115	105.2 Å²	105.2	50%	0.5	53%	0.53	S	S	.	.	H	α-helix	trans	-78.2	-31.4	178	-70.9	168.3	-169.8	139.8	0	111.9	D63 E64 D65 F69 Q70	D63-K67 WeakPolarHBondContact O-CD 3.44Å; D63-K67 WeakPolarHBondContact O-CE 3.36Å; D63-K67 WeakPolarHBondContact O-CG 3Å; D63-K67 PolarHBondContact O-NZ 2.9Å; D63-K67 VanDerWaalsContact O-NZ 3.09Å; E64-K67 WeakPolarHBondContact O-CB 3.44Å; E64-K67 PolarHBondContact O-N 3.31Å; D65-K67 PolarHBondContact O-N 3.03Å; K67-F69 VanDerWaalsContact C-N 3.26Å; K67-F69 PolarHBondContact O-N 3.43Å; K67-Q70 WeakPolarHBondContact O-CB 3.3Å; K67-Q70 PolarHBondContact O-N 2.82Å
68	I	39.8	Very low	36.7	Very low	113 Å²	113	110 Å²	110	58%	0.579	56%	0.557	S	S	*	*	H	α-helix	trans	-59.7	-40.6	176.9	-63.4	172.1	0	0	0	109.9	E64 D65 Q70 I71	E64-I68 PolarHBondContact O-N 2.69Å; D65-I68 PolarHBondContact O-N 3.16Å; I68-Q70 PolarHBondContact O-N 2.81Å; I68-I71 PolarHBondContact O-N 2.88Å
69	F	33.7	Very low	36	Very low	140 Å²	140	117.2 Å²	117.2	61%	0.614	59%	0.589	S	S	*	*	H	α-helix	trans	-67.2	-11.6	175.1	-78.2	-75.9	0	0	0	115.8	L61 D65 K67	L61-F69 HydrophobicContact CD1-CE2 4.1Å; D65-F69 WeakPolarHBondContact O-CD2 3.34Å; K67-F69 VanDerWaalsContact C-N 3.26Å; K67-F69 PolarHBondContact O-N 3.43Å
70	Q	34.9	Very low	35.2	Very low	151 Å²	151	124.1 Å²	124.1	71%	0.706	62%	0.62	S	S	*	*	H	α-helix	trans	-84.7	-18.7	175.4	-66.5	-172.1	-7.2	0	0	113.1	K67 I68	K67-Q70 WeakPolarHBondContact O-CB 3.3Å; K67-Q70 PolarHBondContact O-N 2.82Å; I68-Q70 PolarHBondContact O-N 2.81Å
71	I	35.2	Very low	34.6	Very low	137 Å²	137	128 Å²	128	70%	0.703	65%	0.645	S	S	*	*	H	α-helix	trans	-82.7	-34.3	-178.7	-61.4	177.1	0	0	0	110.9	I68 R73	I68-I71 PolarHBondContact O-N 2.88Å; I71-R73 VanDerWaalsContact C-N 3.31Å; I71-R73 PolarHBondContact O-N 2.76Å
72	D	32	Very low	33.9	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	14.4	-175.3	-107.6	-4.5	0	0	0	115
73	R	30.2	Very low	33.2	Very low	228 Å²	228	133.8 Å²	133.8	86%	0.86	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	15.7	-177.1	-124.6	178.8	-173.7	-178.1	2.7	116.1	I71	I71-R73 VanDerWaalsContact C-N 3.31Å; I71-R73 PolarHBondContact O-N 2.76Å
74	T	32.8	Very low	32.6	Very low	121 Å²	121	139.4 Å²	139.4	74%	0.742	69%	0.687	S	S	*	*			trans	-130	63.6	170.6	53.7	0	0	0	0	112.6
75	I	29.7	Very low	31.7	Very low	163 Å²	163	141 Å²	141	84%	0.836	70%	0.699	S	S	*	*			trans	-126.3	93.3	150.3	-58.7	-178.3	0	0	0	106.2
76	D	26.8	Very low	30.8	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	73%	0.73	S	S	*	*			trans	-86.8	138.6	178.1	-166.4	3.1	0	0	0	110.4
77	L	27.3	Very low	30	Very low	163 Å²	163	149.4 Å²	149.4	85%	0.853	76%	0.757	S	S	*	*			trans	-100.1	83.3	-173.7	-93	163.3	0	0	0	110.3
78	T	26.8	Very low	29.2	Very low	118 Å²	118	149.9 Å²	149.9	72%	0.724	77%	0.765	S	S	*	*			trans	-138.5	132.1	163.5	48.6	0	0	0	0	114.6
79	Q	29.7	Very low	28.5	Very low	191 Å²	191	151.2 Å²	151.2	89%	0.893	78%	0.779	S	S	*	*			trans	98.9	100.9	164.1	-55.9	-167.1	-8.1	0	0	119.1
80	H	28.6	Very low	28.1	Very low	191 Å²	191	148.5 Å²	148.5	88%	0.884	79%	0.79	S	S	*	*			trans	-65.8	134.6	149.1	-87.4	-90.4	0	0	0	110.6
81	S	25.2	Very low	27.6	Very low	108 Å²	108	145.1 Å²	145.1	76%	0.755	80%	0.796	S	S	*	*				174.3	149.1	113.3	46.1	0	0	0	0	114.1
82	N	26.2	Very low	27.1	Very low	137 Å²	137	149.4 Å²	149.4	73%	0.733	81%	0.81	S	S	*	*			trans	69.4	116.7	155.6	-75.9	13.1	0	0	0	123.6
83	E	24.9	Very low	26.7	Very low	138 Å²	138	145.3 Å²	145.3	65%	0.645	80%	0.803	S	S	*	*				82.3	108	125.6	-67.1	-161.7	120.2	0	0	123.1
84	R	26.5	Very low	26.5	Very low	205 Å²	205	141.4 Å²	141.4	77%	0.774	80%	0.799	S	S	*	*				72.9	125.2	120.1	-73.8	-178.7	164.9	173.8	-4.9	122.3
85	L	25.4	Very low	26.2	Very low	171 Å²	171	142.4 Å²	142.4	90%	0.895	80%	0.795	S	S	*	*			trans	62.1	138	146.2	-81.7	90.1	0	0	0	120
86	G	25.5	Very low	25.8	Very low	81 Å²	81	143.9 Å²	143.9	84%	0.835	79%	0.79	S	S	*	*			trans	162.9	88.8	157.7	0	0	0	0	0	117.2
87	H	26.5	Very low	25.7	Very low	172 Å²	172	143.7 Å²	143.7	80%	0.796	79%	0.788	S	S	*	*			trans	-60.9	146.9	173.9	-103.5	-86.9	0	0	0	116.5
88	N	25	Very low	25.5	Very low	126 Å²	126	141.6 Å²	141.6	67%	0.674	79%	0.787	S	S	*	*			trans	64.2	151.1	132.9	-75.3	6.3	0	0	0	125.3
89	T	26.6	Very low	25.5	Very low	141 Å²	141	145.2 Å²	145.2	87%	0.865	79%	0.792	S	S	*	*			trans	81.5	137.2	146.9	37.6	0	0	0	0	119.5
90	G	24.1	Very low	25.3	Very low	82 Å²	82	145.8 Å²	145.8	85%	0.845	79%	0.792	S	S	*	*			trans	-102.4	-175.5	172.8	0	0	0	0	0	112.6
91	G	24.5	Very low	25.1	Very low	80 Å²	80	148.6 Å²	148.6	83%	0.825	80%	0.795	S	S	*	*			trans	172.3	132.4	176.8	0	0	0	0	0	112.6
92	F	24.2	Very low	25.1	Very low	227 Å²	227	146.9 Å²	146.9	100%	0.996	79%	0.794	S	S	*	*			trans	-78.7	157.5	176.4	-95.7	-113.7	0	0	0	112.4
93	G	24.2	Very low	25	Very low	63 Å²	63	145 Å²	145	65%	0.649	80%	0.797	S	S	*	*			trans	138.1	93.4	141	0	0	0	0	0	118.5
94	D	25.5	Very low	25.2	Very low	146 Å²	146	145.9 Å²	145.9	78%	0.781	81%	0.805	S	S	*	*			trans	52.4	147.6	137.3	-78.3	-49.7	0	0	0	122.1
95	H	26.6	Very low	25.1	Very low	142 Å²	142	146.6 Å²	146.6	66%	0.657	81%	0.81	S	S	*	*			cis	-162.6	151.7	24.2	-135.6	17.7	0	0	0	113.8
96	R	22.7	Very low	25.1	Very low	195 Å²	195	147.7 Å²	147.7	74%	0.736	81%	0.81	S	S	*	*			trans	83.3	109.7	146	-73.7	-175.9	175	-143.2	-2.3	125.4
97	I	23.2	Very low	25.2	Very low	141 Å²	141	152 Å²	152	72%	0.723	81%	0.814	S	S	*	*				82.6	101.2	126.7	-56.3	164.6	0	0	0	119.7
98	S	24.4	Very low	25.2	Very low	119 Å²	119	152 Å²	152	83%	0.832	82%	0.817	S	S	*	*				-155.5	162.9	107.2	-164.3	0	0	0	0	111.8
99	K	26.5	Very low	25.2	Very low	193 Å²	193	153.1 Å²	153.1	84%	0.839	82%	0.824	S	S	*	*			trans	-75	158.7	-174.5	-68.6	165	177.2	170.6	0	110.8
100	K	24.7	Very low	25.1	Very low	204 Å²	204	157.6 Å²	157.6	89%	0.887	83%	0.825	S	S	*	*			cis	-166.4	148.1	44.3	-144.6	169	-172.8	-175.7	0	111.3
101	R	25.2	Very low	25.3	Very low	250 Å²	250	162 Å²	162	94%	0.943	83%	0.827	S	S	*	*			trans	-79	159.6	172.5	-78.2	177.2	167.8	172.6	-5.9	112.3
102	G	25.2	Very low	25.2	Very low	72 Å²	72	169 Å²	169	74%	0.742	83%	0.828	S	S	*	*				113.7	93.9	121	0	0	0	0	0	118.8
103	A	24.6	Very low	25.2	Very low	97 Å²	97	168.8 Å²	168.8	80%	0.802	82%	0.821	S	S	*	*			trans	20.2	138.5	133.4	0	0	0	0	0	122.4
104	L	28.2	Very low	25.3	Very low	156 Å²	156	175.6 Å²	175.6	82%	0.817	83%	0.833	S	S	*	*				50.4	92.6	127.4	-165	81.5	0	0	0	118.2
105	Y	25.1	Very low	25.2	Very low	220 Å²	220	172.1 Å²	172.1	86%	0.863	83%	0.832	S	S	*	*			trans	175.9	113.4	138	-104.2	-70.7	0	0	0	109.4
106	Q	25.3	Very low	25.1	Very low	194 Å²	194	171.7 Å²	171.7	91%	0.907	84%	0.844	S	S	*	*			trans	166.2	98.2	147.4	-95.9	169.1	33.4	0	0	110.7
107	L	27.2	Very low	25.1	Very low	173 Å²	173	165.7 Å²	165.7	91%	0.906	84%	0.843	S	S	*	*			trans	-144.5	53	165	-155	125.3	0	0	0	111.4
108	I	27	Very low	25	Very low	171 Å²	171	167.8 Å²	167.8	88%	0.877	85%	0.847	S	S	*	*			trans	-144.8	89.3	163.1	-54.4	-179.6	0	0	0	108.3
109	D	23.9	Very low	24.9	Very low	150 Å²	150	170 Å²	170	80%	0.802	85%	0.845	S	S	*	*			trans	-168.7	157.1	135.7	-140.2	-25.5	0	0	0	111.5
110	R	25.2	Very low	24.8	Very low	235 Å²	235	169.1 Å²	169.1	89%	0.887	84%	0.843	S	S	*	*	S	Bend	trans	65.6	113.2	-157.5	-56.3	179.2	175.1	-179.9	-1.2	111.7
111	I	27.2	Very low	24.7	Very low	173 Å²	173	167 Å²	167	89%	0.887	84%	0.842	S	S	*	*			cis	-131.5	121.7	26	-66.1	165.5	0	0	0	110.6
112	R	22.6	Very low	24.7	Very low	229 Å²	229	162.5 Å²	162.5	86%	0.864	84%	0.836	S	S	*	*			trans	-154.6	141.5	160.9	-136.6	176.2	-174.1	-176.3	2.4	111.2
113	R	25.9	Very low	24.7	Very low	221 Å²	221	165.9 Å²	165.9	83%	0.834	84%	0.843	S	S	*	*			trans	73.3	138.2	-176.5	-42.3	179.9	-153.3	-146.5	5.9	113.2
114	F	25	Very low	24.9	Very low	207 Å²	207	166.7 Å²	166.7	91%	0.908	84%	0.843	S	S	*	*			cis	-114.8	170.9	8.5	-77.9	-104.7	0	0	0	111
115	G	23.6	Very low	24.8	Very low	73 Å²	73	169.4 Å²	169.4	75%	0.753	85%	0.848	S	S	*	*			cis	162.1	150.8	2	0	0	0	0	0	109.2
116	S	24.3	Very low	24.8	Very low	132 Å²	132	162.1 Å²	162.1	92%	0.923	84%	0.839	S	S	*	*			trans	-91.5	153.4	-162.5	53	0	0	0	0	117
117	G	22.2	Very low	24.9	Very low	69 Å²	69	164.1 Å²	164.1	71%	0.711	84%	0.839	S	S	*	*			trans	140.3	150.2	159.8	0	0	0	0	0	112.8
118	F	21.9	Very low	24.7	Very low	185 Å²	185	162.2 Å²	162.2	81%	0.811	83%	0.834	S	S	*	*			cis	-162.9	157	-9.2	-148.5	-106.7	0	0	0	108.7
119	E	21.6	Very low	24.7	Very low	166 Å²	166	159.3 Å²	159.3	78%	0.776	83%	0.825	S	S	*	*			trans	68.3	167.1	156	-100.5	167	-160.4	0	0	124.2
120	Q	26	Very low	24.8	Very low	174 Å²	174	158.3 Å²	158.3	81%	0.813	82%	0.824	S	S	*	*			trans	-93.7	159	-161	-57	167.2	-22.1	0	0	112.6
121	N	22.5	Very low	25	Very low	161 Å²	161	156.7 Å²	156.7	86%	0.861	82%	0.823	S	S	*	*				-162.3	138.8	123.9	-108.4	-45.8	0	0	0	114.1
122	N	25.4	Very low	24.9	Very low	154 Å²	154	158.2 Å²	158.2	82%	0.824	82%	0.824	S	S	*	*			trans	-73.4	148.1	167.6	-84.5	-48	0	0	0	110.6
123	T	23.4	Very low	25	Very low	144 Å²	144	152.8 Å²	152.8	88%	0.883	82%	0.821	S	S	*	*			trans	-153.4	121.2	140.4	0.6	0	0	0	0	111.4
124	S	29.3	Very low	25.2	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	82%	0.815	S	S	*	*			trans	-94.6	134	171.1	50.3	0	0	0	0	110.6
125	K	26.9	Very low	25.3	Very low	214 Å²	214	145.4 Å²	145.4	93%	0.93	81%	0.814	S	S	*	*			trans	-177.6	145	162.2	-100.8	160.9	-172.4	179.8	0	105.6
126	G	24.9	Very low	25.8	Very low	66 Å²	66	149.9 Å²	149.9	68%	0.68	82%	0.821	S	S	*	*			cis	173.5	125.1	-0	0	0	0	0	0	106.4
127	R	27.8	Very low	26	Very low	236 Å²	236	152 Å²	152	89%	0.891	82%	0.816	S	S	*	*			trans	-58.5	135.2	-169.5	-172.6	-177.2	-168	170.5	3	112.6
128	T	23.2	Very low	26.5	Very low	133 Å²	133	158 Å²	158	82%	0.816	82%	0.822	S	S	*	*			trans	-142.1	121.7	154.5	-37.6	0	0	0	0	110.2
129	T	26.7	Very low	26.9	Very low	111 Å²	111	155.6 Å²	155.6	68%	0.681	82%	0.818	S	S	*	*			trans	-89.9	127.8	179.3	45.2	0	0	0	0	110.8
130	V	26.2	Very low	27.6	Very low	129 Å²	129	159.1 Å²	159.1	78%	0.782	82%	0.824	S	S	*	*			trans	-125.5	113.6	157.8	-178.1	0	0	0	0	108
131	K	27.5	Very low	28.2	Very low	201 Å²	201	158.3 Å²	158.3	87%	0.874	82%	0.818	S	S	*	*			trans	-76.4	130.4	164.4	-76.6	-179.2	174.4	-179.7	0	107.9
132	F	25	Very low	29.2	Very low	205 Å²	205	153 Å²	153	90%	0.899	79%	0.793	S	S	*	*			trans	-136.9	151.1	145.3	-114.6	-84.4	0	0	0	110.6
133	S	24.8	Very low	30.7	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	77%	0.768	S	S	*	*			trans	-91.6	129.6	-157.7	-170	0	0	0	0	113.6
134	G	30.5	Very low	32.3	Very low	68 Å²	68	142.6 Å²	142.6	70%	0.701	73%	0.726	S	S	*	*			trans	56.6	104.9	135.1	0	0	0	0	0	120.1
135	K	27.6	Very low	34.2	Very low	204 Å²	204	137.2 Å²	137.2	89%	0.887	69%	0.688	S	S	*	*				-132.6	133.7	128.2	-92.6	-176.4	177.9	177.3	0	109.3	E137	K135-E137 PolarHBondContact O-N 3.41Å
136	N	34.1	Very low	36.4	Very low	168 Å²	168	127.2 Å²	127.2	90%	0.898	65%	0.645	S	S	*	*			trans	-76.5	97.2	176.8	-83	-29	0	0	0	110
137	E	28.8	Very low	38.7	Very low	175 Å²	175	126 Å²	126	82%	0.818	63%	0.627	S	S	*	*			trans	-88.5	113.8	158.5	-72.2	-171.6	158.9	0	0	109.1	K135 N139	K135-E137 PolarHBondContact O-N 3.41Å; E137-N139 PolarHBondContact O-N 2.9Å; E137-N139 VanDerWaalsContact O-N 3.13Å
138	K	31.4	Very low	41.1	Very low	195 Å²	195	118.7 Å²	118.7	85%	0.848	60%	0.599	S	S	*	*			trans	-75.1	98	173.5	-70.6	-179.8	177	179	0	108.1	R140	K138-R140 PolarHBondContact O-N 2.81Å
139	N	31	Very low	43.9	Very low	135 Å²	135	117.7 Å²	117.7	72%	0.722	59%	0.593	S	S	*	*			trans	-49.6	114.3	169.1	-80.2	-5.3	0	0	0	109.8	E137	E137-N139 PolarHBondContact O-N 2.9Å; E137-N139 VanDerWaalsContact O-N 3.13Å
140	R	37.1	Very low	46.6	Very low	240 Å²	240	116.9 Å²	116.9	91%	0.906	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-82.4	123.5	173.2	-77.4	-179.4	168.8	177.5	-4	108.5	K138	K138-R140 PolarHBondContact O-N 2.81Å
141	F	38.8	Very low	49.5	Very low	157 Å²	157	112.1 Å²	112.1	69%	0.689	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-80.3	129.6	175.2	-59.5	-83.1	0	0	0	110.7	R143	F141-R143 WeakPolarHBondContact O-CG 3.35Å; F141-R143 PolarHBondContact O-NE 3.39Å; F141-R143 VanDerWaalsContact O-NE 3.13Å
142	P	43.5	Very low	52.5	Low	50 Å²	50	104.5 Å²	104.5	33%	0.325	52%	0.518	S	S	.	.	P	Polyproline II helix	trans	-73	154.4	-177.8	28.8	-35.1	0	0	0	113.9	D252 S282	P142-D252 HydrophobicContact CB-CB 4.24Å; P142-D252 VanDerWaalsContact CB-CG 3.46Å; P142-D252 WeakPolarHBondContact CB-OD2 3.33Å; P142-S282 WeakPolarHBondContact O-CB 3.35Å; P142-S282 PolarHBondContact O-N 3.19Å; P142-S282 PolarHBondContact O-OG 3.36Å
143	R	56.3	Low	55.7	Low	79 Å²	79	94.9 Å²	94.9	30%	0.298	48%	0.476	S	S	.	.			trans	-145.9	119.8	-160.7	-54	-171	-160.2	-160	-4.2	119.9	F141 R250 P251 D252 P277 V280 S282	F141-R143 WeakPolarHBondContact O-CG 3.35Å; F141-R143 PolarHBondContact O-NE 3.39Å; F141-R143 VanDerWaalsContact O-NE 3.13Å; R143-R250 WeakPolarHBondContact O-CB 3.15Å; R143-R250 VanDerWaalsContact O-CG 3.24Å; R143-R250 WeakPolarHBondContact O-CG 3.32Å; R143-P251 HydrophobicContact CB-CG 4.07Å; R143-P251 WeakPolarHBondContact O-CD 3.24Å; R143-D252 PolarHBondContact N-OD1 3.13Å; R143-P277 PolarHBondContact NH1-O 2.79Å; R143-V280 VanDerWaalsContact C-CG1 3.46Å; R143-V280 HydrophobicContact CB-CB 4.21Å; R143-V280 HydrophobicContact CB-CG1 4.14Å; R143-V280 WeakPolarHBondContact CD-O 3.02Å; R143-V280 VanDerWaalsContact O-CG1 3.28Å; R143-V280 WeakPolarHBondContact O-CG1 3.18Å; R143-S282 VanDerWaalsContact CA-N 3.29Å; R143-S282 WeakPolarHBondContact CA-OG 3.09Å; R143-S282 PolarHBondContact N-OG 3.15Å; R143-S282 VanDerWaalsContact N-OG 3.09Å
144	A	56.8	Low	58.7	Low	1 Å²	1	93.4 Å²	93.4	1%	0.008	46%	0.463	C	S	.	.			trans	-132.1	-38.4	-179.4	0	0	0	0	0	120.7	W245 E247 R250 V280 N281 S282	A144-W245 PolarHBondContact O-N 3.47Å; A144-E247 WeakPolarHBondContact CB-OE2 3.38Å; A144-R250 HydrophobicContact CB-CG 3.77Å; A144-V280 VanDerWaalsContact O-CG1 3.3Å; A144-V280 WeakPolarHBondContact O-CG1 3.43Å; A144-N281 VanDerWaalsContact N-C 3.35Å; A144-S282 WeakPolarHBondContact CB-OG 3.1Å; A144-S282 VanDerWaalsContact N-N 3.16Å; A144-S282 PolarHBondContact N-OG 2.88Å
145	A	68.8	Low	61.4	Low	0 Å²	0	92.4 Å²	92.4	0%	0	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	173.1	176.6	0	0	0	0	0	112.4	S147 F244 V280 N281 Q335 L339	A145-S147 PolarHBondContact O-N 3.17Å; A145-F244 HydrophobicContact CB-CD1 3.94Å; A145-F244 HydrophobicContact CB-CE1 4.12Å; A145-V280 CarbonylContact O-C 3.59Å; A145-V280 VanDerWaalsContact O-C 3.28Å; A145-V280 WeakPolarHBondContact O-CA 3.42Å; A145-V280 WeakPolarHBondContact O-CG1 3.49Å; A145-N281 WeakPolarHBondContact CA-O 3.43Å; A145-N281 VanDerWaalsContact CB-O 3.31Å; A145-N281 WeakPolarHBondContact CB-O 3.5Å; A145-N281 PolarHBondContact N-O 2.91Å; A145-N281 PolarHBondContact O-N 2.68Å; A145-Q335 HydrophobicContact CB-CG 4.03Å; A145-L339 HydrophobicContact CB-CD2 4.29Å
146	T	72.8	Confident	64.3	Low	3 Å²	3	82.7 Å²	82.7	2%	0.018	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	133.3	175.7	-168.3	0	0	0	0	113.2	R148 R151 I152 G243	T146-R148 PolarHBondContact OG1-N 2.87Å; T146-R151 HydrophobicContact CG2-CB 4Å; T146-I152 HydrophobicContact CG2-CG1 4.49Å; T146-G243 WeakPolarHBondContact CB-O 3.04Å; T146-G243 PolarHBondContact N-O 2.85Å
147	S	74.6	Confident	67.1	Low	42 Å²	42	75.5 Å²	75.5	29%	0.294	37%	0.373	S	S	.	.			trans	-80.3	-21	173.3	60.8	0	0	0	0	113.7	A145 G278 E279 V280	A145-S147 PolarHBondContact O-N 3.17Å; S147-G278 PolarHBondContact OG-O 3.49Å; S147-E279 PolarHBondContact N-O 3.05Å; S147-E279 VanDerWaalsContact N-O 3.09Å; S147-E279 VanDerWaalsContact OG-CA 3.25Å; S147-E279 WeakPolarHBondContact OG-CA 3.44Å; S147-E279 PolarHBondContact OG-O 3.09Å; S147-V280 PolarHBondContact OG-N 2.95Å
148	R	77.8	Confident	70.3	Confident	81 Å²	81	67.2 Å²	67.2	31%	0.306	33%	0.334	S	S	.	.			trans	-83.2	116.9	-168.5	-86	172	177.4	-109.9	12.2	111.1	T146 E150 R151 E279	T146-R148 PolarHBondContact OG1-N 2.87Å; R148-E150 WeakPolarHBondContact CB-OE1 3.29Å; R148-E150 WeakPolarHBondContact CB-OE2 3.41Å; R148-E150 WeakPolarHBondContact CD-OE1 3.17Å; R148-E150 VanDerWaalsContact CG-OE1 3.26Å; R148-E150 WeakPolarHBondContact CG-OE1 3.01Å; R148-E150 IonicContact CZ-OE1 2.75Å; R148-E150 IonicContact NE-OE1 2.68Å; R148-E150 IonicContact NH1-OE1 3.07Å; R148-E150 PolarHBondContact NH1-OE1 2.98Å; R148-E150 PolarHBondContact O-N 3.25Å; R148-R151 HydrophobicContact CB-CB 4.33Å; R148-R151 HydrophobicContact CB-CG 4.16Å; R148-R151 PolarHBondContact O-N 2.84Å; R148-R151 VanDerWaalsContact O-N 3.14Å; R148-E279 IonicContact CZ-OE1 2.71Å; R148-E279 IonicContact CZ-OE2 2.8Å; R148-E279 VanDerWaalsContact NE-CD 3.28Å; R148-E279 IonicContact NE-OE1 3.81Å; R148-E279 PolarHBondContact NE-OE1 2.9Å; R148-E279 IonicContact NE-OE2 2.68Å; R148-E279 PolarHBondContact NE-OE2 3.23Å; R148-E279 VanDerWaalsContact NE-OE2 3.13Å; R148-E279 IonicContact NH2-OE1 3.74Å; R148-E279 PolarHBondContact NH2-OE1 2.89Å; R148-E279 IonicContact NH2-OE2 3.11Å
149	T	81.2	Confident	73.3	Confident	113 Å²	113	58.1 Å²	58.1	69%	0.693	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-64.6	-28.4	-178.2	45.2	0	0	0	0	113.4	R151 I152	T149-R151 PolarHBondContact O-N 3.2Å; T149-I152 PolarHBondContact O-N 3.12Å
150	E	83.8	Confident	76.3	Confident	94 Å²	94	52.6 Å²	52.6	44%	0.439	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-67.5	-25.4	177	70.1	-82.4	-164.5	0	0	113.1	R148	R148-E150 WeakPolarHBondContact CB-OE1 3.29Å; R148-E150 WeakPolarHBondContact CB-OE2 3.41Å; R148-E150 WeakPolarHBondContact CD-OE1 3.17Å; R148-E150 VanDerWaalsContact CG-OE1 3.26Å; R148-E150 WeakPolarHBondContact CG-OE1 3.01Å; R148-E150 IonicContact CZ-OE1 2.75Å; R148-E150 IonicContact NE-OE1 2.68Å; R148-E150 IonicContact NH1-OE1 3.07Å; R148-E150 PolarHBondContact NH1-OE1 2.98Å; R148-E150 PolarHBondContact O-N 3.25Å
151	R	86.4	Confident	79	Confident	28 Å²	28	43.8 Å²	43.8	11%	0.106	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-84.6	-6.2	176.2	-68.3	-173.1	-173.1	145.3	10.3	114	T146 R148 T149 V212 G213 R214 E279	T146-R151 HydrophobicContact CG2-CB 4Å; R148-R151 HydrophobicContact CB-CB 4.33Å; R148-R151 HydrophobicContact CB-CG 4.16Å; R148-R151 PolarHBondContact O-N 2.84Å; R148-R151 VanDerWaalsContact O-N 3.14Å; T149-R151 PolarHBondContact O-N 3.2Å; R151-V212 WeakPolarHBondContact CD-O 3.22Å; R151-G213 CarbonylContact O-C 3.59Å; R151-G213 WeakPolarHBondContact O-CA 3.37Å; R151-R214 WeakPolarHBondContact CA-O 3.09Å; R151-R214 PolarHBondContact O-N 3.21Å; R151-E279 IonicContact CZ-OE2 3.21Å; R151-E279 VanDerWaalsContact CZ-OE2 3.25Å; R151-E279 IonicContact NH1-OE2 3.06Å; R151-E279 PolarHBondContact NH1-OE2 2.91Å; R151-E279 IonicContact NH2-OE2 2.68Å; R151-E279 PolarHBondContact NH2-OE2 3.48Å
152	I	90.7	Very high	81.4	Confident	42 Å²	42	37.3 Å²	37.3	22%	0.215	21%	0.209	C	C	.	.	S	Bend	trans	-83.7	127.1	176.2	-57.6	178.1	0	0	0	108.4	T146 T149 L339 Y340	T146-I152 HydrophobicContact CG2-CG1 4.49Å; T149-I152 PolarHBondContact O-N 3.12Å; I152-L339 HydrophobicContact CD1-CD1 3.78Å; I152-L339 HydrophobicContact CG1-CD1 4.11Å; I152-Y340 HydrophobicContact CG2-CD1 4.04Å; I152-Y340 HydrophobicContact CG2-CE1 3.59Å
153	W	92.1	Very high	83.4	Confident	3 Å²	3	36 Å²	36	1%	0.011	21%	0.205	C	C	.	.			trans	-62.3	127.5	174.7	-71.1	92.2	0	0	0	110	G155 G156 I158 S197 I199 R214 V241 Y340	W153-G155 PolarHBondContact O-N 3.37Å; W153-G156 PolarHBondContact O-N 2.78Å; W153-I158 HydrophobicContact CB-CG1 4.02Å; W153-I158 HydrophobicContact CD2-CB 4.37Å; W153-I158 HydrophobicContact CD2-CD1 4.49Å; W153-I158 HydrophobicContact CD2-CG1 3.94Å; W153-I158 HydrophobicContact CD2-CG2 4.16Å; W153-I158 HydrophobicContact CE3-CG1 4.49Å; W153-I158 HydrophobicContact CE3-CG2 4.41Å; W153-I158 HydrophobicContact CG-CD1 4.02Å; W153-I158 HydrophobicContact CG-CG1 3.69Å; W153-I158 HydrophobicContact CH2-CG2 4.38Å; W153-I158 HydrophobicContact CZ2-CG2 4.1Å; W153-S197 WeakPolarHBondContact CZ3-O 3.35Å; W153-I199 HydrophobicContact CH2-CG2 4.16Å; W153-I199 HydrophobicContact CZ2-CG2 3.84Å; W153-R214 HydrophobicContact CD2-CB 3.78Å; W153-R214 HydrophobicContact CD2-CG 4.13Å; W153-R214 HydrophobicContact CE3-CB 4.26Å; W153-R214 HydrophobicContact CE3-CG 4.09Å; W153-R214 HydrophobicContact CG-CB 4.08Å; W153-R214 HydrophobicContact CH2-CG 4.24Å; W153-R214 HydrophobicContact CZ2-CB 4.06Å; W153-R214 HydrophobicContact CZ2-CG 4.28Å; W153-R214 HydrophobicContact CZ3-CG 4.14Å; W153-V241 HydrophobicContact CZ2-CG1 4.35Å; W153-V241 PolarHBondContact NE1-O 2.78Å; W153-Y340 HydrophobicContact CB-CE1 4.03Å; W153-Y340 WeakPolarHBondContact O-CE1 3.35Å
154	P	89.6	Confident	84.3	Confident	83 Å²	83	35.4 Å²	35.4	54%	0.539	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-49.1	112	-176.7	-31.5	36.7	0	0	0	111.5	G156 V157 W410	P154-G156 PolarHBondContact O-N 3.37Å; P154-V157 PolarHBondContact O-N 2.91Å; P154-W410 VanDerWaalsContact O-CH2 3.24Å; P154-W410 WeakPolarHBondContact O-CH2 3.02Å
155	G	85.8	Confident	85.5	Confident	47 Å²	47	42.1 Å²	42.1	49%	0.485	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	46	22.3	-174.1	0	0	0	0	0	117.4	W153 W410	W153-G155 PolarHBondContact O-N 3.37Å; G155-W410 WeakPolarHBondContact O-CH2 3.36Å; G155-W410 WeakPolarHBondContact O-CZ3 3.37Å
156	G	90	Very high	86.1	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	90.2	13.6	173.5	0	0	0	0	0	116.7	W153 P154 V187 T188	W153-G156 PolarHBondContact O-N 2.78Å; P154-G156 PolarHBondContact O-N 3.37Å; G156-V187 CarbonylContact O-C 3.59Å; G156-V187 WeakPolarHBondContact O-CA 3.33Å; G156-T188 PolarHBondContact O-N 3.01Å
157	V	92.3	Very high	86.5	Confident	18 Å²	18	45.8 Å²	45.8	11%	0.109	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	129.7	169.6	149.7	0	0	0	0	111	P154 P159 T188 I190 Y409 W410	P154-V157 PolarHBondContact O-N 2.91Å; V157-P159 HydrophobicContact CG1-CG 4.41Å; V157-T188 WeakPolarHBondContact CA-O 3.45Å; V157-T188 HydrophobicContact CG2-CG2 4.5Å; V157-I190 HydrophobicContact CG1-CD1 3.48Å; V157-I190 VanDerWaalsContact CG1-CD1 3.48Å; V157-I190 HydrophobicContact CG1-CG1 4.01Å; V157-Y409 HydrophobicContact CG1-CE2 4.34Å; V157-Y409 HydrophobicContact CG2-CD2 3.81Å; V157-Y409 HydrophobicContact CG2-CE2 3.74Å; V157-W410 HydrophobicContact CB-CE3 4.17Å; V157-W410 HydrophobicContact CB-CH2 4.45Å; V157-W410 HydrophobicContact CB-CZ3 3.66Å; V157-W410 HydrophobicContact CG2-CE3 3.4Å; V157-W410 HydrophobicContact CG2-CZ3 3.36Å
158	I	95.1	Very high	86.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	97.8	-175.6	-50.3	-171.9	0	0	0	108.1	W153 V187 T188 F189 I190 I199 V241 I242	W153-I158 HydrophobicContact CB-CG1 4.02Å; W153-I158 HydrophobicContact CD2-CB 4.37Å; W153-I158 HydrophobicContact CD2-CD1 4.49Å; W153-I158 HydrophobicContact CD2-CG1 3.94Å; W153-I158 HydrophobicContact CD2-CG2 4.16Å; W153-I158 HydrophobicContact CE3-CG1 4.49Å; W153-I158 HydrophobicContact CE3-CG2 4.41Å; W153-I158 HydrophobicContact CG-CD1 4.02Å; W153-I158 HydrophobicContact CG-CG1 3.69Å; W153-I158 HydrophobicContact CH2-CG2 4.38Å; W153-I158 HydrophobicContact CZ2-CG2 4.1Å; I158-V187 HydrophobicContact CD1-CG1 3.51Å; I158-V187 HydrophobicContact CG1-CG1 3.96Å; I158-T188 PolarHBondContact N-O 3.3Å; I158-F189 HydrophobicContact CB-CD1 3.79Å; I158-F189 HydrophobicContact CB-CE1 3.91Å; I158-F189 HydrophobicContact CD1-CE1 3.86Å; I158-F189 HydrophobicContact CD1-CZ 4.05Å; I158-F189 HydrophobicContact CG1-CE1 4.38Å; I158-F189 HydrophobicContact CG2-CD1 3.94Å; I158-F189 HydrophobicContact CG2-CE1 3.87Å; I158-F189 WeakPolarHBondContact O-CA 3.49Å; I158-I190 PolarHBondContact O-N 3.2Å; I158-I190 VanDerWaalsContact O-N 3.16Å; I158-I199 HydrophobicContact CG2-CD1 4.18Å; I158-I199 HydrophobicContact CG2-CG1 4.37Å; I158-I199 HydrophobicContact CG2-CG2 4.07Å; I158-V241 HydrophobicContact CD1-CG1 4.1Å; I158-V241 HydrophobicContact CG2-CG1 3.8Å; I158-I242 HydrophobicContact CD1-CG1 3.97Å
159	P	94.8	Very high	86.3	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.032	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	140.3	175.6	-14.9	29.8	0	0	0	110.5	V157 I190 R192 E195 Y198 I199	V157-P159 HydrophobicContact CG1-CG 4.41Å; P159-I190 CarbonylContact C-O 3.58Å; P159-I190 VanDerWaalsContact CA-O 3.27Å; P159-I190 WeakPolarHBondContact CA-O 3.35Å; P159-I190 HydrophobicContact CB-CG1 4.09Å; P159-I190 HydrophobicContact CG-CD1 4.34Å; P159-I190 HydrophobicContact CG-CG1 4.25Å; P159-R192 HydrophobicContact CB-CB 4.19Å; P159-R192 HydrophobicContact CB-CG 4.35Å; P159-E195 HydrophobicContact CB-CB 4.1Å; P159-E195 HydrophobicContact CB-CG 4.22Å; P159-E195 HydrophobicContact CG-CB 3.69Å; P159-E195 HydrophobicContact CG-CG 3.62Å; P159-Y198 CarbonylContact O-C 3.54Å; P159-Y198 VanDerWaalsContact O-CA 3.28Å; P159-Y198 WeakPolarHBondContact O-CA 3.02Å; P159-Y198 WeakPolarHBondContact O-CB 3.43Å; P159-I199 PolarHBondContact O-N 2.94Å
160	Y	94.8	Very high	86.5	Confident	19 Å²	19	39.8 Å²	39.8	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	156.8	-177.7	75.1	-93.3	0	0	0	114	I162 K175 M178 F189 I190 E191 R192 I199	Y160-I162 HydrophobicContact CD2-CD1 4.44Å; Y160-I162 HydrophobicContact CD2-CG1 4.03Å; Y160-I162 HydrophobicContact CE2-CD1 4.04Å; Y160-I162 HydrophobicContact CE2-CG1 4.1Å; Y160-K175 WeakPolarHBondContact OH-CE 3.34Å; Y160-M178 HydrophobicContact CD1-CE 4.06Å; Y160-M178 HydrophobicContact CD1-SD 3.7Å; Y160-M178 HydrophobicContact CD2-CE 3.9Å; Y160-M178 HydrophobicContact CD2-SD 4.29Å; Y160-M178 HydrophobicContact CE1-CE 3.79Å; Y160-M178 HydrophobicContact CE1-SD 3.91Å; Y160-M178 HydrophobicContact CE2-CE 3.62Å; Y160-M178 HydrophobicContact CE2-SD 4.47Å; Y160-M178 HydrophobicContact CG-CE 4.11Å; Y160-M178 HydrophobicContact CG-SD 3.91Å; Y160-F189 HydrophobicContact CD1-CB 3.96Å; Y160-F189 HydrophobicContact CE1-CB 4.06Å; Y160-I190 VanDerWaalsContact CD1-C 3.44Å; Y160-I190 WeakPolarHBondContact CD1-O 3.3Å; Y160-I190 VanDerWaalsContact CE1-C 3.45Å; Y160-I190 PolarHBondContact N-O 2.93Å; Y160-E191 HydrophobicContact CE1-CG 4.02Å; Y160-E191 HydrophobicContact CE2-CG 3.84Å; Y160-E191 VanDerWaalsContact CZ-CG 3.47Å; Y160-E191 WeakPolarHBondContact OH-CG 3.23Å; Y160-E191 PolarHBondContact OH-OE1 2.8Å; Y160-R192 PolarHBondContact O-N 3.04Å; Y160-R192 VanDerWaalsContact O-N 3.1Å; Y160-I199 CarbonylContact C-O 3.57Å; Y160-I199 WeakPolarHBondContact CA-O 3.4Å; Y160-I199 VanDerWaalsContact CB-CG1 3.42Å
161	V	93	Very high	86.6	Confident	54 Å²	54	37.3 Å²	37.3	33%	0.327	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.4	169.8	178.5	0	0	0	0	108.6	R192 Y198 I199 V200 F201	V161-R192 HydrophobicContact CG2-CB 3.91Å; V161-Y198 HydrophobicContact CB-CD2 4.44Å; V161-Y198 HydrophobicContact CB-CE2 4.49Å; V161-Y198 HydrophobicContact CG2-CD2 3.8Å; V161-Y198 HydrophobicContact CG2-CE2 3.88Å; V161-I199 PolarHBondContact N-O 3.29Å; V161-V200 HydrophobicContact CB-CG2 4.46Å; V161-V200 WeakPolarHBondContact O-CA 3.22Å; V161-F201 PolarHBondContact O-N 2.9Å
162	I	89.8	Confident	86.3	Confident	21 Å²	21	36.7 Å²	36.7	11%	0.108	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	120.1	173.8	-53.2	172.5	0	0	0	109.7	Y160 F166 R171 F174 K175 F201	Y160-I162 HydrophobicContact CD2-CD1 4.44Å; Y160-I162 HydrophobicContact CD2-CG1 4.03Å; Y160-I162 HydrophobicContact CE2-CD1 4.04Å; Y160-I162 HydrophobicContact CE2-CG1 4.1Å; I162-F166 HydrophobicContact CG2-CB 4.24Å; I162-F166 HydrophobicContact CG2-CD2 3.93Å; I162-F166 HydrophobicContact CG2-CG 4.34Å; I162-R171 HydrophobicContact CD1-CG 4.5Å; I162-R171 HydrophobicContact CG2-CG 3.89Å; I162-R171 PolarHBondContact O-NH2 2.82Å; I162-F174 HydrophobicContact CD1-CB 4.29Å; I162-F174 HydrophobicContact CD1-CD2 4.34Å; I162-F174 HydrophobicContact CG2-CD2 3.99Å; I162-F174 HydrophobicContact CG2-CE2 4.24Å; I162-K175 HydrophobicContact CD1-CG 4.49Å; I162-F201 HydrophobicContact CG1-CB 4.49Å; I162-F201 HydrophobicContact CG1-CD2 3.84Å; I162-F201 HydrophobicContact CG1-CE2 4.43Å; I162-F201 HydrophobicContact CG1-CG 4.38Å; I162-F201 HydrophobicContact CG2-CB 4.16Å
163	G	84.1	Confident	86.2	Confident	23 Å²	23	36.4 Å²	36.4	24%	0.237	24%	0.242	C	C	.	.			trans	-57.4	151.2	-178	0	0	0	0	0	114.1	N165 F166 R171 F201	G163-N165 PolarHBondContact O-N 2.94Å; G163-N165 VanDerWaalsContact O-N 3.15Å; G163-F166 PolarHBondContact O-N 2.67Å; G163-R171 PolarHBondContact O-NH2 2.72Å; G163-F201 PolarHBondContact N-O 2.04Å
164	G	77.3	Confident	86.1	Confident	67 Å²	67	36.3 Å²	36.3	69%	0.691	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.5	-178.1	0	0	0	0	0	114.3	F166	G164-F166 PolarHBondContact O-N 2.77Å; G164-F166 VanDerWaalsContact O-N 3.15Å
165	N	80.1	Confident	86.1	Confident	141 Å²	141	33.3 Å²	33.3	75%	0.754	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-0.8	-171.8	-58.2	17.2	0	0	0	115.2	G163 Y203	G163-N165 PolarHBondContact O-N 2.94Å; G163-N165 VanDerWaalsContact O-N 3.15Å; N165-Y203 HydrophobicContact CB-CD2 4.03Å; N165-Y203 HydrophobicContact CB-CE2 4.09Å
166	F	81.8	Confident	86.2	Confident	8 Å²	8	34.4 Å²	34.4	4%	0.035	21%	0.212	C	C	.	.	S	Bend	trans	-95.9	137.8	178.6	-67.1	-80.2	0	0	0	112.1	I162 G163 G164 Q170 R171 F174 F201 Y203 I224	I162-F166 HydrophobicContact CG2-CB 4.24Å; I162-F166 HydrophobicContact CG2-CD2 3.93Å; I162-F166 HydrophobicContact CG2-CG 4.34Å; G163-F166 PolarHBondContact O-N 2.67Å; G164-F166 PolarHBondContact O-N 2.77Å; G164-F166 VanDerWaalsContact O-N 3.15Å; F166-Q170 HydrophobicContact CB-CB 4.21Å; F166-Q170 HydrophobicContact CD1-CB 4.25Å; F166-R171 HydrophobicContact CB-CG 4.26Å; F166-R171 PolarHBondContact O-NE 2.84Å; F166-F174 HydrophobicContact CB-CE2 4.37Å; F166-F174 AromaticContact CD1-CE2 3.56Å; F166-F174 HydrophobicContact CD1-CE2 3.56Å; F166-F174 AromaticContact CD1-CZ 3.59Å; F166-F174 HydrophobicContact CD1-CZ 3.59Å; F166-F174 HydrophobicContact CD2-CE2 4.13Å; F166-F174 AromaticContact CE1-CE2 3.76Å; F166-F174 HydrophobicContact CE1-CE2 3.76Å; F166-F174 AromaticContact CE1-CZ 3.62Å; F166-F174 HydrophobicContact CE1-CZ 3.62Å; F166-F174 HydrophobicContact CE2-CE2 4.31Å; F166-F174 AromaticContact CG-CE2 3.75Å; F166-F174 HydrophobicContact CG-CE2 3.75Å; F166-F174 HydrophobicContact CG-CZ 4.26Å; F166-F174 HydrophobicContact CZ-CE2 4.14Å; F166-F174 HydrophobicContact CZ-CZ 4.32Å; F166-F201 HydrophobicContact CE2-CB 4.11Å; F166-F201 WeakPolarHBondContact CE2-O 3.23Å; F166-Y203 HydrophobicContact CD1-CE1 4.5Å; F166-Y203 AromaticContact CD1-CE2 3.59Å; F166-Y203 HydrophobicContact CD1-CE2 3.59Å; F166-Y203 AromaticContact CD1-CZ 3.59Å; F166-Y203 WeakPolarHBondContact CD1-OH 3.26Å; F166-Y203 HydrophobicContact CD2-CE2 4.35Å; F166-Y203 HydrophobicContact CE1-CD1 4.32Å; F166-Y203 AromaticContact CE1-CD2 3.94Å; F166-Y203 HydrophobicContact CE1-CD2 3.94Å; F166-Y203 AromaticContact CE1-CE1 3.79Å; F166-Y203 HydrophobicContact CE1-CE1 3.79Å; F166-Y203 AromaticContact CE1-CE2 3.36Å; F166-Y203 HydrophobicContact CE1-CE2 3.36Å; F166-Y203 HydrophobicContact CE1-CG 4.39Å; F166-Y203 AromaticContact CE1-CZ 3.27Å; F166-Y203 HydrophobicContact CE2-CD2 4.2Å; F166-Y203 HydrophobicContact CE2-CE2 4.15Å; F166-Y203 HydrophobicContact CG-CE2 4.09Å; F166-Y203 HydrophobicContact CZ-CD1 4.46Å; F166-Y203 AromaticContact CZ-CD2 3.77Å; F166-Y203 HydrophobicContact CZ-CD2 3.77Å; F166-Y203 HydrophobicContact CZ-CE1 4.36Å; F166-Y203 AromaticContact CZ-CE2 3.67Å; F166-Y203 HydrophobicContact CZ-CE2 3.67Å; F166-Y203 HydrophobicContact CZ-CG 4.18Å; F166-Y203 AromaticContact CZ-CZ 3.98Å; F166-I224 HydrophobicContact CE1-CB 4.16Å; F166-I224 HydrophobicContact CZ-CB 4.39Å
167	T	80.9	Confident	86.4	Confident	72 Å²	72	34.4 Å²	34.4	44%	0.442	21%	0.212	S	C	.	.			trans	-66.6	164.3	177.8	67.5	0	0	0	0	112.3	S169 Q170 R171	T167-S169 VanDerWaalsContact C-N 3.31Å; T167-S169 PolarHBondContact O-N 3.1Å; T167-S169 PolarHBondContact OG1-OG 3.44Å; T167-S169 VanDerWaalsContact OG1-OG 3.07Å; T167-Q170 VanDerWaalsContact N-OE1 3.16Å; T167-Q170 PolarHBondContact O-N 3.41Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.41Å; T167-Q170 PolarHBondContact OG1-N 2.78Å; T167-R171 WeakPolarHBondContact O-CB 3.3Å; T167-R171 WeakPolarHBondContact O-CD 3.36Å; T167-R171 VanDerWaalsContact O-CG 3.29Å; T167-R171 WeakPolarHBondContact O-CG 3.41Å; T167-R171 PolarHBondContact O-N 2.92Å
168	G	73.4	Confident	86.5	Confident	13 Å²	13	33.7 Å²	33.7	13%	0.134	21%	0.208	C	C	.	.	H	α-helix	trans	-54.8	-43.2	174.4	0	0	0	0	0	113.5	R171 A172 Q501	G168-R171 WeakPolarHBondContact O-CB 3.49Å; G168-R171 PolarHBondContact O-N 3.18Å; G168-A172 WeakPolarHBondContact O-CB 3.18Å; G168-A172 PolarHBondContact O-N 2.98Å; G168-Q501 WeakPolarHBondContact CA-O 3.2Å
169	S	76.1	Confident	86.3	Confident	78 Å²	78	35.2 Å²	35.2	55%	0.545	21%	0.214	S	C	.	.	H	α-helix	trans	-67.5	-38.4	177.6	53.1	0	0	0	0	113.2	T167 A172 M173	T167-S169 VanDerWaalsContact C-N 3.31Å; T167-S169 PolarHBondContact O-N 3.1Å; T167-S169 PolarHBondContact OG1-OG 3.44Å; T167-S169 VanDerWaalsContact OG1-OG 3.07Å; S169-A172 WeakPolarHBondContact O-CB 3.06Å; S169-A172 PolarHBondContact O-N 2.94Å; S169-M173 PolarHBondContact O-N 3.32Å
170	Q	84.6	Confident	86.2	Confident	20 Å²	20	36.5 Å²	36.5	9%	0.093	22%	0.219	C	C	.	.	H	α-helix	trans	-65.6	-43.3	172.8	-71.9	174.1	-28.2	0	0	111.2	F166 T167 A172 M173 F174 Y203 D229	F166-Q170 HydrophobicContact CB-CB 4.21Å; F166-Q170 HydrophobicContact CD1-CB 4.25Å; T167-Q170 VanDerWaalsContact N-OE1 3.16Å; T167-Q170 PolarHBondContact O-N 3.41Å; T167-Q170 WeakPolarHBondContact OG1-CG 3.41Å; T167-Q170 PolarHBondContact OG1-N 2.78Å; Q170-A172 VanDerWaalsContact C-N 3.34Å; Q170-A172 PolarHBondContact O-N 2.84Å; Q170-M173 PolarHBondContact O-N 2.93Å; Q170-F174 HydrophobicContact CB-CZ 4.21Å; Q170-F174 WeakPolarHBondContact O-CD1 3.46Å; Q170-F174 WeakPolarHBondContact O-CG 3.31Å; Q170-F174 PolarHBondContact O-N 2.78Å; Q170-Y203 PolarHBondContact NE2-OH 3.04Å; Q170-Y203 PolarHBondContact OE1-OH 3.09Å; Q170-Y203 VanDerWaalsContact OE1-OH 3.06Å; Q170-D229 HydrophobicContact CG-CB 4.38Å; Q170-D229 PolarHBondContact NE2-OD2 3.48Å
171	R	85.1	Confident	86.2	Confident	42 Å²	42	35.6 Å²	35.6	16%	0.158	22%	0.216	C	C	.	.	H	α-helix	trans	-58.6	-43.9	173.7	-72.4	161.6	170.7	-92	-18.2	112	I162 G163 F166 T167 G168 F174 K175	I162-R171 HydrophobicContact CD1-CG 4.5Å; I162-R171 HydrophobicContact CG2-CG 3.89Å; I162-R171 PolarHBondContact O-NH2 2.82Å; G163-R171 PolarHBondContact O-NH2 2.72Å; F166-R171 HydrophobicContact CB-CG 4.26Å; F166-R171 PolarHBondContact O-NE 2.84Å; T167-R171 WeakPolarHBondContact O-CB 3.3Å; T167-R171 WeakPolarHBondContact O-CD 3.36Å; T167-R171 VanDerWaalsContact O-CG 3.29Å; T167-R171 WeakPolarHBondContact O-CG 3.41Å; T167-R171 PolarHBondContact O-N 2.92Å; G168-R171 WeakPolarHBondContact O-CB 3.49Å; G168-R171 PolarHBondContact O-N 3.18Å; R171-F174 PolarHBondContact O-N 3.11Å; R171-K175 WeakPolarHBondContact O-CG 3.27Å; R171-K175 PolarHBondContact O-N 3.07Å; R171-K175 VanDerWaalsContact O-N 3.08Å
172	A	81.4	Confident	86.2	Confident	15 Å²	15	33.2 Å²	33.2	12%	0.124	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-51.1	175.7	0	0	0	0	0	111.5	G168 S169 Q170 F174 K175 Q176 P475	G168-A172 WeakPolarHBondContact O-CB 3.18Å; G168-A172 PolarHBondContact O-N 2.98Å; S169-A172 WeakPolarHBondContact O-CB 3.06Å; S169-A172 PolarHBondContact O-N 2.94Å; Q170-A172 VanDerWaalsContact C-N 3.34Å; Q170-A172 PolarHBondContact O-N 2.84Å; A172-F174 PolarHBondContact O-N 2.87Å; A172-K175 PolarHBondContact O-N 2.79Å; A172-Q176 PolarHBondContact O-N 2.97Å; A172-P475 HydrophobicContact CB-CB 3.65Å
173	M	87.3	Confident	86.3	Confident	36 Å²	36	36.9 Å²	36.9	18%	0.177	22%	0.216	C	C	.	.	H	α-helix	trans	-58.5	-41.9	176.6	-176.2	-156.5	-49.7	0	0	112.8	S169 Q170 Q176 A177 D229 V234	S169-M173 PolarHBondContact O-N 3.32Å; Q170-M173 PolarHBondContact O-N 2.93Å; M173-Q176 PolarHBondContact O-N 2.84Å; M173-A177 WeakPolarHBondContact O-CB 3.45Å; M173-A177 PolarHBondContact O-N 3.09Å; M173-D229 HydrophobicContact CE-CB 3.98Å; M173-D229 WeakPolarHBondContact CE-O 3.49Å; M173-D229 HydrophobicContact SD-CB 4.35Å; M173-V234 HydrophobicContact SD-CG2 3.91Å
174	F	91.4	Very high	86.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-42.9	177.7	-59.3	-11.1	0	0	0	111.1	I162 F166 Q170 R171 A172 Q176 A177 M178 F201 I224 V234	I162-F174 HydrophobicContact CD1-CB 4.29Å; I162-F174 HydrophobicContact CD1-CD2 4.34Å; I162-F174 HydrophobicContact CG2-CD2 3.99Å; I162-F174 HydrophobicContact CG2-CE2 4.24Å; F166-F174 HydrophobicContact CB-CE2 4.37Å; F166-F174 AromaticContact CD1-CE2 3.56Å; F166-F174 HydrophobicContact CD1-CE2 3.56Å; F166-F174 AromaticContact CD1-CZ 3.59Å; F166-F174 HydrophobicContact CD1-CZ 3.59Å; F166-F174 HydrophobicContact CD2-CE2 4.13Å; F166-F174 AromaticContact CE1-CE2 3.76Å; F166-F174 HydrophobicContact CE1-CE2 3.76Å; F166-F174 AromaticContact CE1-CZ 3.62Å; F166-F174 HydrophobicContact CE1-CZ 3.62Å; F166-F174 HydrophobicContact CE2-CE2 4.31Å; F166-F174 AromaticContact CG-CE2 3.75Å; F166-F174 HydrophobicContact CG-CE2 3.75Å; F166-F174 HydrophobicContact CG-CZ 4.26Å; F166-F174 HydrophobicContact CZ-CE2 4.14Å; F166-F174 HydrophobicContact CZ-CZ 4.32Å; Q170-F174 HydrophobicContact CB-CZ 4.21Å; Q170-F174 WeakPolarHBondContact O-CD1 3.46Å; Q170-F174 WeakPolarHBondContact O-CG 3.31Å; Q170-F174 PolarHBondContact O-N 2.78Å; R171-F174 PolarHBondContact O-N 3.11Å; A172-F174 PolarHBondContact O-N 2.87Å; F174-Q176 VanDerWaalsContact C-N 3.34Å; F174-Q176 PolarHBondContact O-N 3.47Å; F174-A177 PolarHBondContact O-N 2.77Å; F174-M178 WeakPolarHBondContact O-CE 3.26Å; F174-M178 WeakPolarHBondContact O-CG 3.29Å; F174-M178 PolarHBondContact O-N 2.87Å; F174-F201 HydrophobicContact CB-CD1 4.41Å; F174-F201 HydrophobicContact CB-CE1 3.98Å; F174-F201 HydrophobicContact CB-CZ 4.07Å; F174-F201 HydrophobicContact CD1-CD1 4.41Å; F174-F201 HydrophobicContact CD1-CE1 4.28Å; F174-F201 HydrophobicContact CD2-CB 4.14Å; F174-F201 AromaticContact CD2-CD1 3.48Å; F174-F201 HydrophobicContact CD2-CD1 3.48Å; F174-F201 VanDerWaalsContact CD2-CD1 3.48Å; F174-F201 HydrophobicContact CD2-CD2 4.46Å; F174-F201 AromaticContact CD2-CE1 3.92Å; F174-F201 HydrophobicContact CD2-CE1 3.92Å; F174-F201 AromaticContact CD2-CG 3.79Å; F174-F201 HydrophobicContact CD2-CG 3.79Å; F174-F201 HydrophobicContact CE2-CB 4.07Å; F174-F201 AromaticContact CE2-CD1 3.76Å; F174-F201 HydrophobicContact CE2-CD1 3.76Å; F174-F201 HydrophobicContact CE2-CG 4.13Å; F174-F201 AromaticContact CG-CD1 3.86Å; F174-F201 HydrophobicContact CG-CD1 3.86Å; F174-F201 AromaticContact CG-CE1 3.79Å; F174-F201 HydrophobicContact CG-CE1 3.79Å; F174-F201 HydrophobicContact CG-CG 4.49Å; F174-F201 HydrophobicContact CG-CZ 4.37Å; F174-F201 HydrophobicContact CZ-CD1 4.34Å; F174-I224 HydrophobicContact CE1-CB 4.4Å; F174-I224 HydrophobicContact CE1-CG1 4.04Å; F174-I224 HydrophobicContact CE1-CG2 4.01Å; F174-I224 HydrophobicContact CZ-CB 4.02Å; F174-I224 HydrophobicContact CZ-CG1 3.88Å; F174-I224 HydrophobicContact CZ-CG2 3.95Å; F174-V234 HydrophobicContact CD1-CG1 3.87Å; F174-V234 HydrophobicContact CD1-CG2 3.86Å; F174-V234 HydrophobicContact CE1-CG2 3.89Å
175	K	88.9	Confident	87.4	Confident	20 Å²	20	37.7 Å²	37.7	9%	0.087	19%	0.193	C	C	.	.	H	α-helix	trans	-62.7	-38.9	173.2	-71	-171.9	175.7	-163.9	0	111.8	Y160 I162 R171 A172 M178 R179 E191	Y160-K175 WeakPolarHBondContact OH-CE 3.34Å; I162-K175 HydrophobicContact CD1-CG 4.49Å; R171-K175 WeakPolarHBondContact O-CG 3.27Å; R171-K175 PolarHBondContact O-N 3.07Å; R171-K175 VanDerWaalsContact O-N 3.08Å; A172-K175 PolarHBondContact O-N 2.79Å; K175-M178 HydrophobicContact CG-CE 4.18Å; K175-M178 PolarHBondContact O-N 2.79Å; K175-R179 WeakPolarHBondContact O-CG 3.45Å; K175-R179 PolarHBondContact O-N 3.3Å; K175-E191 VanDerWaalsContact CE-OE1 3.28Å; K175-E191 WeakPolarHBondContact CE-OE1 3.09Å; K175-E191 IonicContact NZ-OE1 2.83Å; K175-E191 PolarHBondContact NZ-OE1 2.89Å
176	Q	89.2	Confident	87.9	Confident	70 Å²	70	31.4 Å²	31.4	33%	0.327	16%	0.16	S	C	.	.	H	α-helix	trans	-65.6	-43.1	176	-158.7	-174.2	44.5	0	0	112.3	A172 M173 F174 M178 R179 H180 F231 P475 D476	A172-Q176 PolarHBondContact O-N 2.97Å; M173-Q176 PolarHBondContact O-N 2.84Å; F174-Q176 VanDerWaalsContact C-N 3.34Å; F174-Q176 PolarHBondContact O-N 3.47Å; Q176-M178 VanDerWaalsContact C-N 3.35Å; Q176-M178 PolarHBondContact O-N 2.84Å; Q176-R179 PolarHBondContact O-N 2.62Å; Q176-H180 WeakPolarHBondContact O-CB 3.32Å; Q176-H180 PolarHBondContact O-N 2.63Å; Q176-F231 HydrophobicContact CB-CE2 4.38Å; Q176-F231 HydrophobicContact CG-CE2 4.11Å; Q176-P475 HydrophobicContact CB-CG 4.12Å; Q176-D476 PolarHBondContact NE2-OD1 2.72Å
177	A	92.6	Very high	88.5	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-37.1	176.1	0	0	0	0	0	112.4	M173 F174 W181 F231 V234 V235 L238	M173-A177 WeakPolarHBondContact O-CB 3.45Å; M173-A177 PolarHBondContact O-N 3.09Å; F174-A177 PolarHBondContact O-N 2.77Å; A177-W181 PolarHBondContact O-N 2.56Å; A177-F231 HydrophobicContact CB-CD2 4.4Å; A177-F231 HydrophobicContact CB-CE2 4.31Å; A177-V234 HydrophobicContact CB-CB 3.94Å; A177-V234 HydrophobicContact CB-CG1 3.65Å; A177-V235 HydrophobicContact CB-CG2 3.74Å; A177-L238 HydrophobicContact CB-CD1 3.87Å
178	M	94.1	Very high	89	Confident	4 Å²	4	27.7 Å²	27.7	2%	0.02	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-47.9	170.8	-71.9	-175.9	-67.6	0	0	111.6	Y160 F174 K175 Q176 H180 W181 E182 F189 F201 L238	Y160-M178 HydrophobicContact CD1-CE 4.06Å; Y160-M178 HydrophobicContact CD1-SD 3.7Å; Y160-M178 HydrophobicContact CD2-CE 3.9Å; Y160-M178 HydrophobicContact CD2-SD 4.29Å; Y160-M178 HydrophobicContact CE1-CE 3.79Å; Y160-M178 HydrophobicContact CE1-SD 3.91Å; Y160-M178 HydrophobicContact CE2-CE 3.62Å; Y160-M178 HydrophobicContact CE2-SD 4.47Å; Y160-M178 HydrophobicContact CG-CE 4.11Å; Y160-M178 HydrophobicContact CG-SD 3.91Å; F174-M178 WeakPolarHBondContact O-CE 3.26Å; F174-M178 WeakPolarHBondContact O-CG 3.29Å; F174-M178 PolarHBondContact O-N 2.87Å; K175-M178 HydrophobicContact CG-CE 4.18Å; K175-M178 PolarHBondContact O-N 2.79Å; Q176-M178 VanDerWaalsContact C-N 3.35Å; Q176-M178 PolarHBondContact O-N 2.84Å; M178-H180 PolarHBondContact O-N 2.98Å; M178-W181 PolarHBondContact O-N 2.84Å; M178-W181 VanDerWaalsContact O-N 3.1Å; M178-E182 WeakPolarHBondContact O-CG 3.34Å; M178-E182 PolarHBondContact O-N 2.78Å; M178-F189 HydrophobicContact CB-CB 4.05Å; M178-F189 HydrophobicContact CB-CD1 4.41Å; M178-F189 HydrophobicContact CB-CD2 3.72Å; M178-F189 HydrophobicContact CB-CE2 4.26Å; M178-F189 HydrophobicContact CB-CG 3.81Å; M178-F189 HydrophobicContact CG-CB 4.16Å; M178-F189 HydrophobicContact CG-CD1 3.79Å; M178-F189 HydrophobicContact CG-CD2 3.97Å; M178-F189 HydrophobicContact CG-CE1 4.13Å; M178-F189 HydrophobicContact CG-CE2 4.3Å; M178-F189 HydrophobicContact CG-CG 3.71Å; M178-F189 HydrophobicContact CG-CZ 4.37Å; M178-F189 HydrophobicContact SD-CB 3.72Å; M178-F189 HydrophobicContact SD-CD1 3.58Å; M178-F189 VanDerWaalsContact SD-CD1 3.58Å; M178-F189 HydrophobicContact SD-CE1 4.33Å; M178-F189 HydrophobicContact SD-CG 3.71Å; M178-F201 HydrophobicContact CE-CE2 4.26Å; M178-F201 HydrophobicContact CE-CZ 4.49Å; M178-F201 HydrophobicContact SD-CE2 4.15Å; M178-F201 HydrophobicContact SD-CZ 4.31Å; M178-L238 HydrophobicContact CB-CD1 4.5Å; M178-L238 HydrophobicContact CG-CD1 3.66Å; M178-L238 HydrophobicContact CG-CD2 4.12Å
179	R	91.1	Very high	90	Very high	32 Å²	32	27.2 Å²	27.2	12%	0.121	13%	0.132	C	C	.	.	H	α-helix	trans	-55.5	-38.4	175.4	-77.9	177.9	73.8	153.8	0	112.1	K175 Q176 E182 K183 Q350 Y474	K175-R179 WeakPolarHBondContact O-CG 3.45Å; K175-R179 PolarHBondContact O-N 3.3Å; Q176-R179 PolarHBondContact O-N 2.62Å; R179-E182 PolarHBondContact O-N 2.94Å; R179-K183 WeakPolarHBondContact O-CB 3.39Å; R179-K183 PolarHBondContact O-N 2.78Å; R179-Q350 PolarHBondContact NH2-O 3.43Å; R179-Q350 VanDerWaalsContact NH2-O 3.15Å; R179-Q350 PolarHBondContact O-NE2 3.06Å; R179-Q350 PolarHBondContact O-OE1 3.37Å; R179-Y474 PolarHBondContact NH1-O 3.43Å
180	H	93.1	Very high	90.7	Very high	32 Å²	32	24 Å²	24	15%	0.148	11%	0.108	C	C	.	.	H	α-helix	trans	-61.8	-42.6	176.6	-177.7	77	0	0	0	112.7	Q176 M178 Y184 F231 L328	Q176-H180 WeakPolarHBondContact O-CB 3.32Å; Q176-H180 PolarHBondContact O-N 2.63Å; M178-H180 PolarHBondContact O-N 2.98Å; H180-Y184 AromaticContact CE1-CE2 3.67Å; H180-Y184 AromaticContact ND1-CE2 3.66Å; H180-Y184 VanDerWaalsContact O-CD2 3.29Å; H180-Y184 WeakPolarHBondContact O-CD2 3.44Å; H180-F231 HydrophobicContact CB-CE2 4.37Å; H180-F231 HydrophobicContact CB-CZ 3.88Å; H180-F231 AromaticContact CG-CZ 3.79Å; H180-L328 PolarHBondContact NE2-N 3.31Å
181	W	94.8	Very high	90.9	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-41.1	171.6	-84.9	108.5	0	0	0	112.8	A177 M178 K183 T185 F189 V235 G239 I242 F244 L328 A336	A177-W181 PolarHBondContact O-N 2.56Å; M178-W181 PolarHBondContact O-N 2.84Å; M178-W181 VanDerWaalsContact O-N 3.1Å; W181-K183 VanDerWaalsContact C-N 3.32Å; W181-K183 PolarHBondContact O-N 2.85Å; W181-T185 HydrophobicContact CE3-CG2 3.94Å; W181-T185 HydrophobicContact CZ3-CG2 4.29Å; W181-T185 WeakPolarHBondContact O-CB 3.11Å; W181-T185 PolarHBondContact O-N 3.45Å; W181-T185 PolarHBondContact O-OG1 2.83Å; W181-F189 HydrophobicContact CB-CE2 3.84Å; W181-V235 PolarHBondContact NE1-O 2.93Å; W181-G239 VanDerWaalsContact CZ2-CA 3.43Å; W181-I242 HydrophobicContact CB-CD1 4.22Å; W181-I242 HydrophobicContact CD2-CD1 3.24Å; W181-I242 HydrophobicContact CE3-CD1 3.36Å; W181-I242 HydrophobicContact CG-CD1 3.68Å; W181-I242 HydrophobicContact CH2-CD1 4.09Å; W181-I242 HydrophobicContact CZ2-CD1 4Å; W181-I242 HydrophobicContact CZ3-CD1 3.8Å; W181-F244 HydrophobicContact CH2-CD2 4.12Å; W181-F244 AromaticContact CH2-CE2 3.73Å; W181-F244 HydrophobicContact CH2-CE2 3.73Å; W181-F244 HydrophobicContact CH2-CZ 4.43Å; W181-F244 HydrophobicContact CZ3-CE2 4.3Å; W181-L328 HydrophobicContact CD2-CD1 3.71Å; W181-L328 HydrophobicContact CD2-CD2 4.01Å; W181-L328 HydrophobicContact CD2-CG 4.47Å; W181-L328 HydrophobicContact CE3-CD1 3.6Å; W181-L328 HydrophobicContact CE3-CD2 4.11Å; W181-L328 HydrophobicContact CG-CD1 4.22Å; W181-L328 HydrophobicContact CH2-CD1 4.46Å; W181-L328 HydrophobicContact CH2-CD2 3.48Å; W181-L328 VanDerWaalsContact CH2-CD2 3.48Å; W181-L328 HydrophobicContact CZ2-CD2 3.33Å; W181-L328 HydrophobicContact CZ3-CD1 4Å; W181-L328 HydrophobicContact CZ3-CD2 3.86Å; W181-A336 HydrophobicContact CZ3-CB 4.05Å
182	E	93.3	Very high	91.1	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.019	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-35.4	176.4	-64	-166.9	154.1	0	0	112.7	M178 R179 T185 F189 T348 R434	M178-E182 WeakPolarHBondContact O-CG 3.34Å; M178-E182 PolarHBondContact O-N 2.78Å; R179-E182 PolarHBondContact O-N 2.94Å; E182-T185 VanDerWaalsContact O-O 3.09Å; E182-F189 HydrophobicContact CG-CD2 3.93Å; E182-F189 PolarHBondContact OE1-N 2.95Å; E182-T348 HydrophobicContact CB-CG2 4.35Å; E182-T348 WeakPolarHBondContact O-CB 3.29Å; E182-T348 PolarHBondContact O-OG1 2.98Å; E182-R434 IonicContact OE1-CZ 2.69Å; E182-R434 IonicContact OE1-NH1 2.68Å; E182-R434 PolarHBondContact OE1-NH1 2.82Å; E182-R434 VanDerWaalsContact OE1-NH1 3.09Å; E182-R434 IonicContact OE1-NH2 3.16Å; E182-R434 PolarHBondContact OE1-NH2 3.06Å; E182-R434 IonicContact OE2-CZ 3.72Å; E182-R434 IonicContact OE2-NH1 3.7Å; E182-R434 PolarHBondContact OE2-NH1 2.88Å; E182-R434 IonicContact OE2-NH2 2.77Å
183	K	91.5	Very high	91.3	Very high	98 Å²	98	34 Å²	34	43%	0.426	16%	0.16	S	C	.	.	H	α-helix	trans	-63.7	-43	-176.9	-176.3	168	-177.4	164.3	0	112.9	R179 W181	R179-K183 WeakPolarHBondContact O-CB 3.39Å; R179-K183 PolarHBondContact O-N 2.78Å; W181-K183 VanDerWaalsContact C-N 3.32Å; W181-K183 PolarHBondContact O-N 2.85Å
184	Y	91.6	Very high	91.2	Very high	98 Å²	98	38.9 Å²	38.9	38%	0.384	19%	0.187	S	C	.	.	H	α-helix	trans	-97.7	-14.4	-174.5	-62.4	-69.5	0	0	0	114.3	H180 L328 I333	H180-Y184 AromaticContact CE1-CE2 3.67Å; H180-Y184 AromaticContact ND1-CE2 3.66Å; H180-Y184 VanDerWaalsContact O-CD2 3.29Å; H180-Y184 WeakPolarHBondContact O-CD2 3.44Å; Y184-L328 HydrophobicContact CD2-CD1 4.46Å; Y184-I333 HydrophobicContact CD1-CD1 4.09Å; Y184-I333 HydrophobicContact CD2-CD1 4.45Å; Y184-I333 HydrophobicContact CG-CD1 3.83Å; Y184-I333 HydrophobicContact CG-CG1 4.39Å; Y184-I333 WeakPolarHBondContact O-CG2 3.42Å
185	T	93.1	Very high	91.1	Very high	9 Å²	9	40.6 Å²	40.6	6%	0.055	20%	0.195	C	C	.	.	S	Bend	trans	-122.1	-171.4	-176.9	78.9	0	0	0	0	111.7	W181 E182 V187 A336	W181-T185 HydrophobicContact CE3-CG2 3.94Å; W181-T185 HydrophobicContact CZ3-CG2 4.29Å; W181-T185 WeakPolarHBondContact O-CB 3.11Å; W181-T185 PolarHBondContact O-N 3.45Å; W181-T185 PolarHBondContact O-OG1 2.83Å; E182-T185 VanDerWaalsContact O-O 3.09Å; T185-V187 PolarHBondContact OG1-N 2.84Å; T185-A336 HydrophobicContact CG2-CB 3.76Å
186	C	91.3	Very high	91	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.054	22%	0.218	C	C	.	.	S	Bend	trans	-109.3	9.3	170.6	71.3	0	0	0	0	113.4	C342 R374	C186-C342 HydrophobicContact CB-CB 3.62Å; C186-C342 WeakPolarHBondContact CB-SG 3.48Å; C186-C342 PolarHBondContact N-SG 2.82Å; C186-C342 WeakPolarHBondContact SG-CA 3.04Å; C186-C342 WeakPolarHBondContact SG-CB 3.33Å; C186-C342 CovalentContact SG-SG 2.01Å; C186-C342 PolarHBondContact SG-SG 2.97Å; C186-R374 PolarHBondContact O-NH2 3.39Å
187	V	93.5	Very high	91.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.207	C	C	.	.			trans	-66.5	147.5	169	179.2	0	0	0	0	108.5	G156 I158 T185 F189 I242 Y340	G156-V187 CarbonylContact O-C 3.59Å; G156-V187 WeakPolarHBondContact O-CA 3.33Å; I158-V187 HydrophobicContact CD1-CG1 3.51Å; I158-V187 HydrophobicContact CG1-CG1 3.96Å; T185-V187 PolarHBondContact OG1-N 2.84Å; V187-F189 HydrophobicContact CG1-CD2 4.43Å; V187-F189 HydrophobicContact CG1-CE2 3.88Å; V187-F189 HydrophobicContact CG1-CZ 4.12Å; V187-I242 HydrophobicContact CG1-CD1 4.4Å; V187-I242 HydrophobicContact CG1-CG1 4.3Å; V187-Y340 HydrophobicContact CG2-CD2 3.71Å; V187-Y340 HydrophobicContact CG2-CE2 3.95Å; V187-Y340 HydrophobicContact CG2-CG 4.05Å
188	T	92.2	Very high	91.2	Very high	3 Å²	3	44.4 Å²	44.4	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	128.5	-178.4	-54.6	0	0	0	0	109.4	G156 V157 I158 I190 R374	G156-T188 PolarHBondContact O-N 3.01Å; V157-T188 WeakPolarHBondContact CA-O 3.45Å; V157-T188 HydrophobicContact CG2-CG2 4.5Å; I158-T188 PolarHBondContact N-O 3.3Å; T188-I190 HydrophobicContact CG2-CG2 4.21Å; T188-R374 PolarHBondContact OG1-NE 2.9Å
189	F	93.7	Very high	91.2	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123.4	179.6	-66.7	-90.1	0	0	0	109.1	I158 Y160 M178 W181 E182 V187 I199 L238 I242 R434	I158-F189 HydrophobicContact CB-CD1 3.79Å; I158-F189 HydrophobicContact CB-CE1 3.91Å; I158-F189 HydrophobicContact CD1-CE1 3.86Å; I158-F189 HydrophobicContact CD1-CZ 4.05Å; I158-F189 HydrophobicContact CG1-CE1 4.38Å; I158-F189 HydrophobicContact CG2-CD1 3.94Å; I158-F189 HydrophobicContact CG2-CE1 3.87Å; I158-F189 WeakPolarHBondContact O-CA 3.49Å; Y160-F189 HydrophobicContact CD1-CB 3.96Å; Y160-F189 HydrophobicContact CE1-CB 4.06Å; M178-F189 HydrophobicContact CB-CB 4.05Å; M178-F189 HydrophobicContact CB-CD1 4.41Å; M178-F189 HydrophobicContact CB-CD2 3.72Å; M178-F189 HydrophobicContact CB-CE2 4.26Å; M178-F189 HydrophobicContact CB-CG 3.81Å; M178-F189 HydrophobicContact CG-CB 4.16Å; M178-F189 HydrophobicContact CG-CD1 3.79Å; M178-F189 HydrophobicContact CG-CD2 3.97Å; M178-F189 HydrophobicContact CG-CE1 4.13Å; M178-F189 HydrophobicContact CG-CE2 4.3Å; M178-F189 HydrophobicContact CG-CG 3.71Å; M178-F189 HydrophobicContact CG-CZ 4.37Å; M178-F189 HydrophobicContact SD-CB 3.72Å; M178-F189 HydrophobicContact SD-CD1 3.58Å; M178-F189 VanDerWaalsContact SD-CD1 3.58Å; M178-F189 HydrophobicContact SD-CE1 4.33Å; M178-F189 HydrophobicContact SD-CG 3.71Å; W181-F189 HydrophobicContact CB-CE2 3.84Å; E182-F189 HydrophobicContact CG-CD2 3.93Å; E182-F189 PolarHBondContact OE1-N 2.95Å; V187-F189 HydrophobicContact CG1-CD2 4.43Å; V187-F189 HydrophobicContact CG1-CE2 3.88Å; V187-F189 HydrophobicContact CG1-CZ 4.12Å; F189-I199 HydrophobicContact CD1-CD1 4.46Å; F189-I199 HydrophobicContact CE1-CD1 4.38Å; F189-L238 HydrophobicContact CE1-CD2 3.78Å; F189-L238 HydrophobicContact CZ-CD2 4.07Å; F189-I242 HydrophobicContact CZ-CD1 4.19Å; F189-I242 HydrophobicContact CZ-CG1 4.37Å; F189-R434 PolarHBondContact O-NH2 3.33Å
190	I	91.4	Very high	91.3	Very high	11 Å²	11	44.1 Å²	44.1	6%	0.056	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	143.6	-178.9	64	178.9	0	0	0	110	V157 I158 P159 Y160 T188 R192 E195 Y409	V157-I190 HydrophobicContact CG1-CD1 3.48Å; V157-I190 VanDerWaalsContact CG1-CD1 3.48Å; V157-I190 HydrophobicContact CG1-CG1 4.01Å; I158-I190 PolarHBondContact O-N 3.2Å; I158-I190 VanDerWaalsContact O-N 3.16Å; P159-I190 CarbonylContact C-O 3.58Å; P159-I190 VanDerWaalsContact CA-O 3.27Å; P159-I190 WeakPolarHBondContact CA-O 3.35Å; P159-I190 HydrophobicContact CB-CG1 4.09Å; P159-I190 HydrophobicContact CG-CD1 4.34Å; P159-I190 HydrophobicContact CG-CG1 4.25Å; Y160-I190 VanDerWaalsContact CD1-C 3.44Å; Y160-I190 WeakPolarHBondContact CD1-O 3.3Å; Y160-I190 VanDerWaalsContact CE1-C 3.45Å; Y160-I190 PolarHBondContact N-O 2.93Å; T188-I190 HydrophobicContact CG2-CG2 4.21Å; I190-R192 PolarHBondContact O-N 3.36Å; I190-E195 WeakPolarHBondContact CD1-OE1 3.46Å; I190-Y409 HydrophobicContact CD1-CE1 4.21Å; I190-Y409 HydrophobicContact CD1-CE2 3.98Å; I190-Y409 WeakPolarHBondContact CD1-OH 3.33Å; I190-Y409 HydrophobicContact CG2-CD1 4.06Å; I190-Y409 HydrophobicContact CG2-CD2 3.99Å; I190-Y409 HydrophobicContact CG2-CE1 4.19Å; I190-Y409 HydrophobicContact CG2-CE2 4.15Å; I190-Y409 HydrophobicContact CG2-CG 3.97Å
191	E	88.5	Confident	91.3	Very high	103 Å²	103	42.6 Å²	42.6	48%	0.481	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.9	166.6	-67.2	-172.6	173.1	0	0	107.9	Y160 K175 S193	Y160-E191 HydrophobicContact CE1-CG 4.02Å; Y160-E191 HydrophobicContact CE2-CG 3.84Å; Y160-E191 VanDerWaalsContact CZ-CG 3.47Å; Y160-E191 WeakPolarHBondContact OH-CG 3.23Å; Y160-E191 PolarHBondContact OH-OE1 2.8Å; K175-E191 VanDerWaalsContact CE-OE1 3.28Å; K175-E191 WeakPolarHBondContact CE-OE1 3.09Å; K175-E191 IonicContact NZ-OE1 2.83Å; K175-E191 PolarHBondContact NZ-OE1 2.89Å; E191-S193 PolarHBondContact O-N 2.9Å
192	R	89.5	Confident	91	Very high	96 Å²	96	44.6 Å²	44.6	36%	0.362	22%	0.22	S	C	.	.			trans	-65.1	131.7	-173.6	-176.7	-161.6	-176.9	-138.4	-6.8	111.4	P159 Y160 V161 I190 E195 Y198	P159-R192 HydrophobicContact CB-CB 4.19Å; P159-R192 HydrophobicContact CB-CG 4.35Å; Y160-R192 PolarHBondContact O-N 3.04Å; Y160-R192 VanDerWaalsContact O-N 3.1Å; V161-R192 HydrophobicContact CG2-CB 3.91Å; I190-R192 PolarHBondContact O-N 3.36Å; R192-E195 WeakPolarHBondContact CG-OE2 3.5Å; R192-E195 VanDerWaalsContact CZ-O 3.31Å; R192-E195 PolarHBondContact NE-O 2.91Å; R192-E195 PolarHBondContact NH2-O 2.82Å; R192-Y198 HydrophobicContact CG-CG 4.33Å; R192-Y198 VanDerWaalsContact NE-CE1 3.31Å; R192-Y198 PolarHBondContact NH1-OH 2.98Å
193	S	85.1	Confident	90.5	Very high	88 Å²	88	48.6 Å²	48.6	62%	0.615	24%	0.236	S	C	*	.	S	Bend	trans	-96.8	-80.5	164.3	50	0	0	0	0	110.6	E191 E195	E191-S193 PolarHBondContact O-N 2.9Å; S193-E195 PolarHBondContact N-OE2 2.88Å
194	D	84.9	Confident	89.8	Confident	138 Å²	138	48.8 Å²	48.8	74%	0.738	23%	0.234	S	C	*	.	S	Bend	trans	-124.3	1.4	-168.8	60.7	-46.8	0	0	0	112.1	E196	D194-E196 PolarHBondContact O-N 2.76Å
195	E	89.4	Confident	88.6	Confident	37 Å²	37	48.9 Å²	48.9	17%	0.173	25%	0.246	C	C	.	.			trans	-65.3	134.9	-176.2	-59.2	90.5	163.9	0	0	112.5	P159 I190 R192 S193	P159-E195 HydrophobicContact CB-CB 4.1Å; P159-E195 HydrophobicContact CB-CG 4.22Å; P159-E195 HydrophobicContact CG-CB 3.69Å; P159-E195 HydrophobicContact CG-CG 3.62Å; I190-E195 WeakPolarHBondContact CD1-OE1 3.46Å; R192-E195 WeakPolarHBondContact CG-OE2 3.5Å; R192-E195 VanDerWaalsContact CZ-O 3.31Å; R192-E195 PolarHBondContact NE-O 2.91Å; R192-E195 PolarHBondContact NH2-O 2.82Å; S193-E195 PolarHBondContact N-OE2 2.88Å
196	E	87.6	Confident	87.2	Confident	124 Å²	124	49.2 Å²	49.2	58%	0.579	25%	0.249	S	C	*	.	S	Bend	trans	-71.4	-40.2	179.8	-168.9	-159.4	159.7	0	0	112.3	D194 Y198 G218	D194-E196 PolarHBondContact O-N 2.76Å; E196-Y198 WeakPolarHBondContact O-CD1 3.29Å; E196-G218 CarbonylContact O-C 3.51Å; E196-G218 WeakPolarHBondContact O-CA 3.41Å; E196-G218 PolarHBondContact O-N 3.26Å
197	S	91.1	Very high	86.3	Confident	11 Å²	11	49.7 Å²	49.7	8%	0.077	26%	0.255	C	S	.	.	S	Bend	trans	-103	122.1	-179.7	-47.4	0	0	0	0	110	W153 R214	W153-S197 WeakPolarHBondContact CZ3-O 3.35Å; S197-R214 PolarHBondContact OG-NE 2.82Å; S197-R214 PolarHBondContact OG-NH2 2.88Å
198	Y	94.3	Very high	85.7	Confident	34 Å²	34	50 Å²	50	13%	0.133	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	157.8	-175.8	62.4	-78.3	0	0	0	111.7	P159 V161 R192 E196 V200 P219 Q220	P159-Y198 CarbonylContact O-C 3.54Å; P159-Y198 VanDerWaalsContact O-CA 3.28Å; P159-Y198 WeakPolarHBondContact O-CA 3.02Å; P159-Y198 WeakPolarHBondContact O-CB 3.43Å; V161-Y198 HydrophobicContact CB-CD2 4.44Å; V161-Y198 HydrophobicContact CB-CE2 4.49Å; V161-Y198 HydrophobicContact CG2-CD2 3.8Å; V161-Y198 HydrophobicContact CG2-CE2 3.88Å; R192-Y198 HydrophobicContact CG-CG 4.33Å; R192-Y198 VanDerWaalsContact NE-CE1 3.31Å; R192-Y198 PolarHBondContact NH1-OH 2.98Å; E196-Y198 WeakPolarHBondContact O-CD1 3.29Å; Y198-V200 HydrophobicContact CD2-CG2 3.62Å; Y198-V200 HydrophobicContact CE2-CG2 3.35Å; Y198-P219 HydrophobicContact CD2-CB 4.39Å; Y198-P219 HydrophobicContact CE1-CB 3.96Å; Y198-P219 HydrophobicContact CE1-CG 4.38Å; Y198-P219 HydrophobicContact CE2-CB 3.78Å; Y198-P219 WeakPolarHBondContact O-CA 3.18Å; Y198-Q220 PolarHBondContact O-N 3.01Å
199	I	94.9	Very high	85.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	147.1	173.4	67.7	175	0	0	0	111.7	W153 I158 P159 Y160 V161 F189 F201 Q220 I222 L238 V241	W153-I199 HydrophobicContact CH2-CG2 4.16Å; W153-I199 HydrophobicContact CZ2-CG2 3.84Å; I158-I199 HydrophobicContact CG2-CD1 4.18Å; I158-I199 HydrophobicContact CG2-CG1 4.37Å; I158-I199 HydrophobicContact CG2-CG2 4.07Å; P159-I199 PolarHBondContact O-N 2.94Å; Y160-I199 CarbonylContact C-O 3.57Å; Y160-I199 WeakPolarHBondContact CA-O 3.4Å; Y160-I199 VanDerWaalsContact CB-CG1 3.42Å; V161-I199 PolarHBondContact N-O 3.29Å; F189-I199 HydrophobicContact CD1-CD1 4.46Å; F189-I199 HydrophobicContact CE1-CD1 4.38Å; I199-F201 HydrophobicContact CD1-CE2 4.05Å; I199-F201 HydrophobicContact CD1-CZ 4.5Å; I199-Q220 CarbonylContact C-O 3.52Å; I199-Q220 WeakPolarHBondContact CA-O 3.5Å; I199-Q220 HydrophobicContact CG2-CG 3.91Å; I199-I222 HydrophobicContact CB-CG2 4.33Å; I199-I222 HydrophobicContact CD1-CG2 4.49Å; I199-L238 HydrophobicContact CD1-CD2 4.12Å; I199-V241 HydrophobicContact CD1-CG1 4.28Å; I199-V241 HydrophobicContact CD1-CG2 4.5Å; I199-V241 HydrophobicContact CG2-CB 4.49Å; I199-V241 HydrophobicContact CG2-CG1 3.57Å; I199-V241 HydrophobicContact CG2-CG2 4.04Å
200	V	93.1	Very high	84.8	Confident	31 Å²	31	51 Å²	51	19%	0.188	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	113.1	176.8	-174.3	0	0	0	0	110	V161 Y198 T202 P219 Q220 I222	V161-V200 HydrophobicContact CB-CG2 4.46Å; V161-V200 WeakPolarHBondContact O-CA 3.22Å; Y198-V200 HydrophobicContact CD2-CG2 3.62Å; Y198-V200 HydrophobicContact CE2-CG2 3.35Å; V200-T202 PolarHBondContact O-N 2.82Å; V200-P219 HydrophobicContact CG2-CB 3.63Å; V200-Q220 PolarHBondContact N-O 3.07Å; V200-I222 WeakPolarHBondContact O-CG2 3.4Å; V200-I222 PolarHBondContact O-N 3.35Å
201	F	91.9	Very high	84.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	124.7	168.6	-67.8	-97.2	0	0	0	109.2	V161 I162 G163 F166 F174 M178 I199 I222 I224 V234 L238	V161-F201 PolarHBondContact O-N 2.9Å; I162-F201 HydrophobicContact CG1-CB 4.49Å; I162-F201 HydrophobicContact CG1-CD2 3.84Å; I162-F201 HydrophobicContact CG1-CE2 4.43Å; I162-F201 HydrophobicContact CG1-CG 4.38Å; I162-F201 HydrophobicContact CG2-CB 4.16Å; G163-F201 PolarHBondContact N-O 2.04Å; F166-F201 HydrophobicContact CE2-CB 4.11Å; F166-F201 WeakPolarHBondContact CE2-O 3.23Å; F174-F201 HydrophobicContact CB-CD1 4.41Å; F174-F201 HydrophobicContact CB-CE1 3.98Å; F174-F201 HydrophobicContact CB-CZ 4.07Å; F174-F201 HydrophobicContact CD1-CD1 4.41Å; F174-F201 HydrophobicContact CD1-CE1 4.28Å; F174-F201 HydrophobicContact CD2-CB 4.14Å; F174-F201 AromaticContact CD2-CD1 3.48Å; F174-F201 HydrophobicContact CD2-CD1 3.48Å; F174-F201 VanDerWaalsContact CD2-CD1 3.48Å; F174-F201 HydrophobicContact CD2-CD2 4.46Å; F174-F201 AromaticContact CD2-CE1 3.92Å; F174-F201 HydrophobicContact CD2-CE1 3.92Å; F174-F201 AromaticContact CD2-CG 3.79Å; F174-F201 HydrophobicContact CD2-CG 3.79Å; F174-F201 HydrophobicContact CE2-CB 4.07Å; F174-F201 AromaticContact CE2-CD1 3.76Å; F174-F201 HydrophobicContact CE2-CD1 3.76Å; F174-F201 HydrophobicContact CE2-CG 4.13Å; F174-F201 AromaticContact CG-CD1 3.86Å; F174-F201 HydrophobicContact CG-CD1 3.86Å; F174-F201 AromaticContact CG-CE1 3.79Å; F174-F201 HydrophobicContact CG-CE1 3.79Å; F174-F201 HydrophobicContact CG-CG 4.49Å; F174-F201 HydrophobicContact CG-CZ 4.37Å; F174-F201 HydrophobicContact CZ-CD1 4.34Å; M178-F201 HydrophobicContact CE-CE2 4.26Å; M178-F201 HydrophobicContact CE-CZ 4.49Å; M178-F201 HydrophobicContact SD-CE2 4.15Å; M178-F201 HydrophobicContact SD-CZ 4.31Å; I199-F201 HydrophobicContact CD1-CE2 4.05Å; I199-F201 HydrophobicContact CD1-CZ 4.5Å; F201-I222 WeakPolarHBondContact CA-O 3.25Å; F201-I222 HydrophobicContact CB-CG2 4.36Å; F201-I222 HydrophobicContact CD1-CD1 4.34Å; F201-I222 HydrophobicContact CD1-CG1 4.4Å; F201-I222 HydrophobicContact CD1-CG2 3.85Å; F201-I222 HydrophobicContact CD2-CG2 4.05Å; F201-I222 HydrophobicContact CE1-CD1 3.82Å; F201-I222 HydrophobicContact CE1-CG1 4.37Å; F201-I222 HydrophobicContact CE1-CG2 4.14Å; F201-I222 HydrophobicContact CE2-CG2 4.33Å; F201-I222 HydrophobicContact CG-CG2 3.81Å; F201-I222 HydrophobicContact CZ-CD1 4.26Å; F201-I222 HydrophobicContact CZ-CG2 4.37Å; F201-I224 HydrophobicContact CD1-CG1 4.04Å; F201-V234 HydrophobicContact CE1-CG1 4.09Å; F201-L238 HydrophobicContact CZ-CD2 4.13Å
202	T	88.4	Confident	84.6	Confident	41 Å²	41	47.7 Å²	47.7	25%	0.252	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	166	-172.9	-171.8	0	0	0	0	111.3	V200 R204 A221 I222 S223 I224	V200-T202 PolarHBondContact O-N 2.82Å; T202-R204 HydrophobicContact CG2-CG 4Å; T202-A221 HydrophobicContact CG2-CB 3.75Å; T202-I222 PolarHBondContact N-O 3.44Å; T202-S223 VanDerWaalsContact O-CA 3.31Å; T202-S223 WeakPolarHBondContact O-CA 3.33Å; T202-I224 PolarHBondContact O-N 2.71Å; T202-I224 VanDerWaalsContact O-N 3.08Å
203	Y	83.6	Confident	84.6	Confident	89 Å²	89	43.1 Å²	43.1	35%	0.349	23%	0.232	S	C	.	.			trans	-99.8	119.8	170.4	-73.9	-76.9	0	0	0	108.7	N165 F166 Q170 I224	N165-Y203 HydrophobicContact CB-CD2 4.03Å; N165-Y203 HydrophobicContact CB-CE2 4.09Å; F166-Y203 HydrophobicContact CD1-CE1 4.5Å; F166-Y203 AromaticContact CD1-CE2 3.59Å; F166-Y203 HydrophobicContact CD1-CE2 3.59Å; F166-Y203 AromaticContact CD1-CZ 3.59Å; F166-Y203 WeakPolarHBondContact CD1-OH 3.26Å; F166-Y203 HydrophobicContact CD2-CE2 4.35Å; F166-Y203 HydrophobicContact CE1-CD1 4.32Å; F166-Y203 AromaticContact CE1-CD2 3.94Å; F166-Y203 HydrophobicContact CE1-CD2 3.94Å; F166-Y203 AromaticContact CE1-CE1 3.79Å; F166-Y203 HydrophobicContact CE1-CE1 3.79Å; F166-Y203 AromaticContact CE1-CE2 3.36Å; F166-Y203 HydrophobicContact CE1-CE2 3.36Å; F166-Y203 HydrophobicContact CE1-CG 4.39Å; F166-Y203 AromaticContact CE1-CZ 3.27Å; F166-Y203 HydrophobicContact CE2-CD2 4.2Å; F166-Y203 HydrophobicContact CE2-CE2 4.15Å; F166-Y203 HydrophobicContact CG-CE2 4.09Å; F166-Y203 HydrophobicContact CZ-CD1 4.46Å; F166-Y203 AromaticContact CZ-CD2 3.77Å; F166-Y203 HydrophobicContact CZ-CD2 3.77Å; F166-Y203 HydrophobicContact CZ-CE1 4.36Å; F166-Y203 AromaticContact CZ-CE2 3.67Å; F166-Y203 HydrophobicContact CZ-CE2 3.67Å; F166-Y203 HydrophobicContact CZ-CG 4.18Å; F166-Y203 AromaticContact CZ-CZ 3.98Å; Q170-Y203 PolarHBondContact NE2-OH 3.04Å; Q170-Y203 PolarHBondContact OE1-OH 3.09Å; Q170-Y203 VanDerWaalsContact OE1-OH 3.06Å; Y203-I224 WeakPolarHBondContact CD1-O 3.37Å; Y203-I224 WeakPolarHBondContact CE1-O 3.5Å
204	R	76.8	Confident	84.9	Confident	102 Å²	102	41.9 Å²	41.9	39%	0.385	21%	0.214	S	C	.	.			trans	-125.8	157.8	173.5	-70.1	-177.1	170.9	-145	-6.2	112.4	C50 T202 C206 G207 S223	C50-R204 WeakPolarHBondContact SG-CD 3.23Å; C50-R204 PolarHBondContact SG-NH1 3.25Å; T202-R204 HydrophobicContact CG2-CG 4Å; R204-C206 PolarHBondContact O-N 3.16Å; R204-C206 VanDerWaalsContact O-N 3.08Å; R204-G207 PolarHBondContact O-N 3.32Å; R204-S223 WeakPolarHBondContact CB-OG 3.31Å; R204-S223 PolarHBondContact N-OG 3.31Å; R204-S223 VanDerWaalsContact N-OG 3.11Å
205	P	65.9	Low	85	Confident	99 Å²	99	42 Å²	42	64%	0.643	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-12.5	177.9	-23.3	34.9	0	0	0	115.4	V54 G207	V54-P205 HydrophobicContact CG2-CB 4.24Å; P205-G207 PolarHBondContact O-N 3.21Å
206	C	63.2	Low	84.4	Confident	16 Å²	16	40.9 Å²	40.9	11%	0.108	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-6.9	177.6	67.5	0	0	0	0	114.6	R204 C209 S223	R204-C206 PolarHBondContact O-N 3.16Å; R204-C206 VanDerWaalsContact O-N 3.08Å; C206-C209 HydrophobicContact CB-CB 3.86Å; C206-C209 WeakPolarHBondContact CB-SG 3.43Å; C206-C209 WeakPolarHBondContact SG-CB 3.35Å; C206-C209 CovalentContact SG-SG 2.05Å; C206-C209 PolarHBondContact SG-SG 3.32Å; C206-S223 WeakPolarHBondContact SG-CB 3.48Å
207	G	74.3	Confident	84	Confident	18 Å²	18	42 Å²	42	19%	0.186	21%	0.212	C	C	.	.	S	Bend	trans	81.2	-131.9	-173.1	0	0	0	0	0	112.2	R204 P205 S223 G225	R204-G207 PolarHBondContact O-N 3.32Å; P205-G207 PolarHBondContact O-N 3.21Å; G207-S223 WeakPolarHBondContact O-CB 3.44Å; G207-S223 PolarHBondContact O-OG 3.41Å; G207-G225 PolarHBondContact O-N 2.84Å
208	C	80.1	Confident	83.7	Confident	7 Å²	7	42.2 Å²	42.2	5%	0.047	22%	0.216	C	C	.	.	S	Bend	trans	-84	110.8	171.3	-29.7	0	0	0	0	106.9	S223 C228 I233	C208-S223 WeakPolarHBondContact CA-O 3.37Å; C208-C228 WeakPolarHBondContact CA-SG 3.32Å; C208-C228 HydrophobicContact CB-CB 3.86Å; C208-C228 WeakPolarHBondContact CB-SG 3.29Å; C208-C228 PolarHBondContact N-SG 2.8Å; C208-C228 WeakPolarHBondContact SG-CB 3.35Å; C208-C228 CovalentContact SG-SG 2.03Å; C208-C228 PolarHBondContact SG-SG 3.32Å; C208-I233 HydrophobicContact CB-CG2 4.14Å
209	C	81.5	Confident	83.4	Confident	15 Å²	15	44.6 Å²	44.6	10%	0.101	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	141.2	-179.9	89.2	0	0	0	0	113.5	C206 S223 E237	C206-C209 HydrophobicContact CB-CB 3.86Å; C206-C209 WeakPolarHBondContact CB-SG 3.43Å; C206-C209 WeakPolarHBondContact SG-CB 3.35Å; C206-C209 CovalentContact SG-SG 2.05Å; C206-C209 PolarHBondContact SG-SG 3.32Å; C209-S223 PolarHBondContact N-O 3.24Å; C209-S223 WeakPolarHBondContact O-CB 3.47Å; C209-S223 PolarHBondContact O-N 2.03Å; C209-E237 VanDerWaalsContact C-OE2 3.24Å; C209-E237 WeakPolarHBondContact CA-OE2 3.2Å
210	S	86.3	Confident	83.2	Confident	11 Å²	11	44.8 Å²	44.8	8%	0.077	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.6	-175.3	-177.1	0	0	0	0	111.5	E237 V241	S210-E237 WeakPolarHBondContact CB-O 3.03Å; S210-E237 WeakPolarHBondContact CB-OE2 3.01Å; S210-E237 PolarHBondContact N-OE2 2.85Å; S210-E237 VanDerWaalsContact N-OE2 3.1Å; S210-E237 PolarHBondContact OG-O 2.8Å; S210-V241 WeakPolarHBondContact OG-CG2 3.44Å
211	Y	86.1	Confident	82.9	Confident	23 Å²	23	43.8 Å²	43.8	9%	0.09	23%	0.231	C	C	.	.			trans	-87.8	138.9	176	-69.1	-85.6	0	0	0	110.9	D48 P49 G213 R215 Q220 A221 H240	D48-Y211 PolarHBondContact OD1-OH 3.49Å; P49-Y211 HydrophobicContact CG-CD1 3.96Å; P49-Y211 HydrophobicContact CG-CE1 3.82Å; P49-Y211 HydrophobicContact CG-CG 4.48Å; Y211-G213 PolarHBondContact O-N 3.08Å; Y211-R215 HydrophobicContact CD1-CG 4.41Å; Y211-R215 HydrophobicContact CG-CG 4.37Å; Y211-R215 VanDerWaalsContact CZ-NH1 3.29Å; Y211-R215 PolarHBondContact OH-NH1 2.66Å; Y211-Q220 HydrophobicContact CD2-CB 4.14Å; Y211-A221 WeakPolarHBondContact CD2-O 3.45Å; Y211-A221 HydrophobicContact CE2-CB 4.48Å; Y211-H240 CarbonylContact O-C 3.57Å
212	V	88.6	Confident	82.9	Confident	22 Å²	22	43.8 Å²	43.8	13%	0.133	23%	0.231	C	C	.	.	S	Bend	trans	-75.3	109.6	177.3	-175.9	0	0	0	0	111.1	R151 H240 W245	R151-V212 WeakPolarHBondContact CD-O 3.22Å; V212-H240 CarbonylContact C-O 3.52Å; V212-H240 VanDerWaalsContact CA-O 3.29Å; V212-H240 WeakPolarHBondContact CA-O 3.38Å; V212-H240 HydrophobicContact CG2-CB 4.42Å; V212-W245 HydrophobicContact CB-CD2 4.42Å; V212-W245 HydrophobicContact CB-CH2 4.17Å; V212-W245 HydrophobicContact CB-CZ2 4.04Å; V212-W245 HydrophobicContact CB-CZ3 4.43Å; V212-W245 HydrophobicContact CG1-CD2 4.07Å; V212-W245 HydrophobicContact CG1-CG 4.37Å; V212-W245 HydrophobicContact CG1-CZ2 4.07Å; V212-W245 HydrophobicContact CG2-CD2 3.99Å; V212-W245 HydrophobicContact CG2-CE3 3.75Å; V212-W245 HydrophobicContact CG2-CH2 3.97Å; V212-W245 HydrophobicContact CG2-CZ2 4.21Å; V212-W245 HydrophobicContact CG2-CZ3 3.74Å
213	G	89.4	Confident	82.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	74.8	-171.7	178.9	0	0	0	0	0	114	R151 Y211 Q220 H240 V241	R151-G213 CarbonylContact O-C 3.59Å; R151-G213 WeakPolarHBondContact O-CA 3.37Å; Y211-G213 PolarHBondContact O-N 3.08Å; G213-Q220 PolarHBondContact O-NE2 3.2Å; G213-Q220 PolarHBondContact O-OE1 2.96Å; G213-H240 PolarHBondContact N-O 2.83Å; G213-V241 VanDerWaalsContact CA-O 3.28Å; G213-V241 WeakPolarHBondContact CA-O 3.4Å
214	R	92	Very high	83	Confident	62 Å²	62	37.6 Å²	37.6	23%	0.234	20%	0.203	C	C	.	.			trans	-70.2	128.1	174.3	-178.2	174.9	170.1	-95.1	-4.6	111	R151 W153 S197	R151-R214 WeakPolarHBondContact CA-O 3.09Å; R151-R214 PolarHBondContact O-N 3.21Å; W153-R214 HydrophobicContact CD2-CB 3.78Å; W153-R214 HydrophobicContact CD2-CG 4.13Å; W153-R214 HydrophobicContact CE3-CB 4.26Å; W153-R214 HydrophobicContact CE3-CG 4.09Å; W153-R214 HydrophobicContact CG-CB 4.08Å; W153-R214 HydrophobicContact CH2-CG 4.24Å; W153-R214 HydrophobicContact CZ2-CB 4.06Å; W153-R214 HydrophobicContact CZ2-CG 4.28Å; W153-R214 HydrophobicContact CZ3-CG 4.14Å; S197-R214 PolarHBondContact OG-NE 2.82Å; S197-R214 PolarHBondContact OG-NH2 2.88Å
215	R	86.8	Confident	82.9	Confident	140 Å²	140	33 Å²	33	53%	0.528	19%	0.187	S	C	.	.			trans	-83.5	-36.5	169.7	-69	-166.1	68.8	174.7	-0	113.6	Y211 Q220	Y211-R215 HydrophobicContact CD1-CG 4.41Å; Y211-R215 HydrophobicContact CG-CG 4.37Å; Y211-R215 VanDerWaalsContact CZ-NH1 3.29Å; Y211-R215 PolarHBondContact OH-NH1 2.66Å; R215-Q220 HydrophobicContact CG-CB 4.44Å
216	G	76.8	Confident	83.1	Confident	13 Å²	13	36.6 Å²	36.6	13%	0.134	19%	0.193	C	C	.	.			trans	79.3	172.9	-164.4	0	0	0	0	0	112.6
217	N	79.9	Confident	83.4	Confident	149 Å²	149	40 Å²	40	80%	0.797	21%	0.21	S	C	*	.	S	Bend	trans	58.9	50	172.1	-49.1	-8.3	0	0	0	114.9
218	G	83.9	Confident	83.4	Confident	15 Å²	15	39.1 Å²	39.1	16%	0.155	20%	0.201	C	C	.	.	S	Bend	trans	109.9	-161.5	173.1	0	0	0	0	0	115.7	E196	E196-G218 CarbonylContact O-C 3.51Å; E196-G218 WeakPolarHBondContact O-CA 3.41Å; E196-G218 PolarHBondContact O-N 3.26Å
219	P	88.7	Confident	82.9	Confident	83 Å²	83	41.6 Å²	41.6	54%	0.539	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	136.3	178.9	24.2	-31	0	0	0	112.6	Y198 V200	Y198-P219 HydrophobicContact CD2-CB 4.39Å; Y198-P219 HydrophobicContact CE1-CB 3.96Å; Y198-P219 HydrophobicContact CE1-CG 4.38Å; Y198-P219 HydrophobicContact CE2-CB 3.78Å; Y198-P219 WeakPolarHBondContact O-CA 3.18Å; V200-P219 HydrophobicContact CG2-CB 3.63Å
220	Q	90.6	Very high	83.1	Confident	5 Å²	5	45.4 Å²	45.4	2%	0.023	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.8	162.8	64.8	-176.5	74.8	0	0	110.8	Y198 I199 V200 Y211 G213 R215	Y198-Q220 PolarHBondContact O-N 3.01Å; I199-Q220 CarbonylContact C-O 3.52Å; I199-Q220 WeakPolarHBondContact CA-O 3.5Å; I199-Q220 HydrophobicContact CG2-CG 3.91Å; V200-Q220 PolarHBondContact N-O 3.07Å; Y211-Q220 HydrophobicContact CD2-CB 4.14Å; G213-Q220 PolarHBondContact O-NE2 3.2Å; G213-Q220 PolarHBondContact O-OE1 2.96Å; R215-Q220 HydrophobicContact CG-CB 4.44Å
221	A	86.9	Confident	83.1	Confident	9 Å²	9	47.7 Å²	47.7	7%	0.074	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	139.5	-178	0	0	0	0	0	111.9	T202 Y211	T202-A221 HydrophobicContact CG2-CB 3.75Å; Y211-A221 WeakPolarHBondContact CD2-O 3.45Å; Y211-A221 HydrophobicContact CE2-CB 4.48Å
222	I	90.9	Very high	83.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111.6	158.6	171.7	170.2	0	0	0	106.1	I199 V200 F201 T202 I224 E237 L238 V241	I199-I222 HydrophobicContact CB-CG2 4.33Å; I199-I222 HydrophobicContact CD1-CG2 4.49Å; V200-I222 WeakPolarHBondContact O-CG2 3.4Å; V200-I222 PolarHBondContact O-N 3.35Å; F201-I222 WeakPolarHBondContact CA-O 3.25Å; F201-I222 HydrophobicContact CB-CG2 4.36Å; F201-I222 HydrophobicContact CD1-CD1 4.34Å; F201-I222 HydrophobicContact CD1-CG1 4.4Å; F201-I222 HydrophobicContact CD1-CG2 3.85Å; F201-I222 HydrophobicContact CD2-CG2 4.05Å; F201-I222 HydrophobicContact CE1-CD1 3.82Å; F201-I222 HydrophobicContact CE1-CG1 4.37Å; F201-I222 HydrophobicContact CE1-CG2 4.14Å; F201-I222 HydrophobicContact CE2-CG2 4.33Å; F201-I222 HydrophobicContact CG-CG2 3.81Å; F201-I222 HydrophobicContact CZ-CD1 4.26Å; F201-I222 HydrophobicContact CZ-CG2 4.37Å; T202-I222 PolarHBondContact N-O 3.44Å; I222-I224 HydrophobicContact CG1-CD1 4.23Å; I222-E237 HydrophobicContact CD1-CB 3.57Å; I222-E237 HydrophobicContact CG1-CB 3.95Å; I222-L238 HydrophobicContact CD1-CD2 4.13Å; I222-L238 HydrophobicContact CD1-CG 4.32Å; I222-V241 HydrophobicContact CD1-CG2 4.24Å
223	S	87.9	Confident	83.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	119.8	-176	-176.3	0	0	0	0	110.2	T202 R204 C206 G207 C208 C209	T202-S223 VanDerWaalsContact O-CA 3.31Å; T202-S223 WeakPolarHBondContact O-CA 3.33Å; R204-S223 WeakPolarHBondContact CB-OG 3.31Å; R204-S223 PolarHBondContact N-OG 3.31Å; R204-S223 VanDerWaalsContact N-OG 3.11Å; C206-S223 WeakPolarHBondContact SG-CB 3.48Å; G207-S223 WeakPolarHBondContact O-CB 3.44Å; G207-S223 PolarHBondContact O-OG 3.41Å; C208-S223 WeakPolarHBondContact CA-O 3.37Å; C209-S223 PolarHBondContact N-O 3.24Å; C209-S223 WeakPolarHBondContact O-CB 3.47Å; C209-S223 PolarHBondContact O-N 2.03Å
224	I	85.4	Confident	83.3	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	23%	0.23	C	C	.	.			trans	-110.9	90.9	170.2	-53.9	-57.1	0	0	0	106.8	F166 F174 F201 T202 Y203 I222 C228 D229 V234 E237	F166-I224 HydrophobicContact CE1-CB 4.16Å; F166-I224 HydrophobicContact CZ-CB 4.39Å; F174-I224 HydrophobicContact CE1-CB 4.4Å; F174-I224 HydrophobicContact CE1-CG1 4.04Å; F174-I224 HydrophobicContact CE1-CG2 4.01Å; F174-I224 HydrophobicContact CZ-CB 4.02Å; F174-I224 HydrophobicContact CZ-CG1 3.88Å; F174-I224 HydrophobicContact CZ-CG2 3.95Å; F201-I224 HydrophobicContact CD1-CG1 4.04Å; T202-I224 PolarHBondContact O-N 2.71Å; T202-I224 VanDerWaalsContact O-N 3.08Å; Y203-I224 WeakPolarHBondContact CD1-O 3.37Å; Y203-I224 WeakPolarHBondContact CE1-O 3.5Å; I222-I224 HydrophobicContact CG1-CD1 4.23Å; I224-C228 HydrophobicContact CB-CB 4.45Å; I224-C228 HydrophobicContact CG2-CB 3.67Å; I224-D229 HydrophobicContact CG2-CB 4.38Å; I224-V234 HydrophobicContact CD1-CG2 4.26Å; I224-E237 HydrophobicContact CD1-CB 4.39Å; I224-E237 HydrophobicContact CD1-CG 4.05Å
225	G	75.5	Confident	83.4	Confident	6 Å²	6	43.2 Å²	43.2	6%	0.062	22%	0.219	C	C	.	.			trans	-69.8	-177.9	178.4	0	0	0	0	0	114.2	G207 N227 C228	G207-G225 PolarHBondContact O-N 2.84Å; G225-N227 PolarHBondContact O-N 2.75Å; G225-C228 PolarHBondContact N-SG 2.79Å; G225-C228 VanDerWaalsContact O-CB 3.25Å; G225-C228 WeakPolarHBondContact O-CB 3.24Å; G225-C228 PolarHBondContact O-N 3.28Å; G225-C228 VanDerWaalsContact O-N 3.1Å
226	K	69.4	Low	83.7	Confident	173 Å²	173	36.7 Å²	36.7	75%	0.752	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	134.6	171.4	-69.1	-174.4	176.3	-176.3	0	109.9	C228	K226-C228 PolarHBondContact O-N 3.28Å
227	N	70.8	Confident	84.4	Confident	87 Å²	87	36.3 Å²	36.3	47%	0.465	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	69	4.6	-175.6	-46.4	-31.8	0	0	0	115.5	I59 G225	I59-N227 HydrophobicContact CD1-CB 3.68Å; G225-N227 PolarHBondContact O-N 2.75Å
228	C	73.4	Confident	85.1	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.007	15%	0.151	C	C	.	.			trans	-86.9	-6.9	174.5	-56.6	0	0	0	0	113.1	C208 I224 G225 K226 K230 I233	C208-C228 WeakPolarHBondContact CA-SG 3.32Å; C208-C228 HydrophobicContact CB-CB 3.86Å; C208-C228 WeakPolarHBondContact CB-SG 3.29Å; C208-C228 PolarHBondContact N-SG 2.8Å; C208-C228 WeakPolarHBondContact SG-CB 3.35Å; C208-C228 CovalentContact SG-SG 2.03Å; C208-C228 PolarHBondContact SG-SG 3.32Å; I224-C228 HydrophobicContact CB-CB 4.45Å; I224-C228 HydrophobicContact CG2-CB 3.67Å; G225-C228 PolarHBondContact N-SG 2.79Å; G225-C228 VanDerWaalsContact O-CB 3.25Å; G225-C228 WeakPolarHBondContact O-CB 3.24Å; G225-C228 PolarHBondContact O-N 3.28Å; G225-C228 VanDerWaalsContact O-N 3.1Å; K226-C228 PolarHBondContact O-N 3.28Å; C228-K230 PolarHBondContact O-N 2.7Å; C228-I233 HydrophobicContact CB-CG2 4.19Å; C228-I233 WeakPolarHBondContact O-CB 3.21Å; C228-I233 WeakPolarHBondContact O-CG2 3.33Å
229	D	70.6	Confident	85.6	Confident	58 Å²	58	28.5 Å²	28.5	31%	0.31	14%	0.144	S	C	.	.			trans	-83.6	50.2	-179.4	56.6	-24	0	0	0	112.2	Q170 M173 I224	Q170-D229 HydrophobicContact CG-CB 4.38Å; Q170-D229 PolarHBondContact NE2-OD2 3.48Å; M173-D229 HydrophobicContact CE-CB 3.98Å; M173-D229 WeakPolarHBondContact CE-O 3.49Å; M173-D229 HydrophobicContact SD-CB 4.35Å; I224-D229 HydrophobicContact CG2-CB 4.38Å
230	K	85.3	Confident	85.8	Confident	96 Å²	96	25.1 Å²	25.1	42%	0.417	12%	0.121	S	C	.	.	S	Bend	trans	-106	136.3	161.5	-65.6	-173.3	175.1	-171.5	0	108.2	D65 C228 G232 I233 V234	D65-K230 IonicContact OD1-NZ 3.09Å; D65-K230 PolarHBondContact OD1-NZ 3.47Å; D65-K230 IonicContact OD2-NZ 3.27Å; D65-K230 PolarHBondContact OD2-NZ 3.23Å; C228-K230 PolarHBondContact O-N 2.7Å; K230-G232 VanDerWaalsContact C-N 3.33Å; K230-G232 PolarHBondContact O-N 3.03Å; K230-G232 VanDerWaalsContact O-N 3.14Å; K230-I233 HydrophobicContact CB-CD1 3.95Å; K230-I233 HydrophobicContact CB-CG1 4.13Å; K230-I233 HydrophobicContact CD-CD1 4.39Å; K230-I233 HydrophobicContact CG-CD1 4.32Å; K230-I233 WeakPolarHBondContact O-CB 3.31Å; K230-I233 PolarHBondContact O-N 3Å; K230-V234 PolarHBondContact O-N 2.03Å
231	F	86.9	Confident	86	Confident	58 Å²	58	25 Å²	25	25%	0.254	12%	0.12	S	C	.	.	H	α-helix	trans	-44.3	-51.1	-176.4	170.9	-97.6	0	0	0	113.9	Q176 A177 H180 I233 V234 V235	Q176-F231 HydrophobicContact CB-CE2 4.38Å; Q176-F231 HydrophobicContact CG-CE2 4.11Å; A177-F231 HydrophobicContact CB-CD2 4.4Å; A177-F231 HydrophobicContact CB-CE2 4.31Å; H180-F231 HydrophobicContact CB-CE2 4.37Å; H180-F231 HydrophobicContact CB-CZ 3.88Å; H180-F231 AromaticContact CG-CZ 3.79Å; F231-I233 VanDerWaalsContact C-N 3.33Å; F231-I233 PolarHBondContact O-N 2.67Å; F231-V234 PolarHBondContact O-N 2.8Å; F231-V235 HydrophobicContact CD1-CG2 4.31Å; F231-V235 HydrophobicContact CE1-CG2 3.94Å; F231-V235 HydrophobicContact CE2-CG2 4.2Å; F231-V235 HydrophobicContact CZ-CG2 3.89Å; F231-V235 WeakPolarHBondContact O-CG2 3.35Å; F231-V235 PolarHBondContact O-N 3.49Å
232	G	87.3	Confident	86.3	Confident	2 Å²	2	24.5 Å²	24.5	2%	0.021	12%	0.117	C	C	.	.	H	α-helix	trans	-70.6	-21.7	-178.6	0	0	0	0	0	115.5	K230 H236 R325	K230-G232 VanDerWaalsContact C-N 3.33Å; K230-G232 PolarHBondContact O-N 3.03Å; K230-G232 VanDerWaalsContact O-N 3.14Å; G232-H236 WeakPolarHBondContact O-CB 3.41Å; G232-H236 PolarHBondContact O-N 2.77Å; G232-R325 WeakPolarHBondContact CA-O 3.03Å
233	I	87.9	Confident	86.3	Confident	11 Å²	11	24.5 Å²	24.5	6%	0.056	12%	0.117	C	C	.	.	H	α-helix	trans	-70.2	-44.9	170.7	-60.7	176.2	0	0	0	108.7	I59 C208 C228 K230 F231 V235 H236 E237	I59-I233 HydrophobicContact CG1-CD1 4.48Å; C208-I233 HydrophobicContact CB-CG2 4.14Å; C228-I233 HydrophobicContact CB-CG2 4.19Å; C228-I233 WeakPolarHBondContact O-CB 3.21Å; C228-I233 WeakPolarHBondContact O-CG2 3.33Å; K230-I233 HydrophobicContact CB-CD1 3.95Å; K230-I233 HydrophobicContact CB-CG1 4.13Å; K230-I233 HydrophobicContact CD-CD1 4.39Å; K230-I233 HydrophobicContact CG-CD1 4.32Å; K230-I233 WeakPolarHBondContact O-CB 3.31Å; K230-I233 PolarHBondContact O-N 3Å; F231-I233 VanDerWaalsContact C-N 3.33Å; F231-I233 PolarHBondContact O-N 2.67Å; I233-V235 VanDerWaalsContact C-N 3.31Å; I233-V235 PolarHBondContact O-N 2.86Å; I233-H236 VanDerWaalsContact O-CB 3.3Å; I233-H236 WeakPolarHBondContact O-CB 3.3Å; I233-H236 PolarHBondContact O-N 2.86Å; I233-H236 VanDerWaalsContact O-N 3.08Å; I233-E237 WeakPolarHBondContact O-CG 3.5Å; I233-E237 PolarHBondContact O-N 2.81Å
234	V	91.5	Very high	86.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.7	-38.7	176.4	-172.8	0	0	0	0	111.5	M173 F174 A177 F201 I224 K230 F231 H236 E237 L238	M173-V234 HydrophobicContact SD-CG2 3.91Å; F174-V234 HydrophobicContact CD1-CG1 3.87Å; F174-V234 HydrophobicContact CD1-CG2 3.86Å; F174-V234 HydrophobicContact CE1-CG2 3.89Å; A177-V234 HydrophobicContact CB-CB 3.94Å; A177-V234 HydrophobicContact CB-CG1 3.65Å; F201-V234 HydrophobicContact CE1-CG1 4.09Å; I224-V234 HydrophobicContact CD1-CG2 4.26Å; K230-V234 PolarHBondContact O-N 2.03Å; F231-V234 PolarHBondContact O-N 2.8Å; V234-H236 VanDerWaalsContact C-N 3.34Å; V234-H236 PolarHBondContact O-N 2.83Å; V234-E237 PolarHBondContact O-N 2.88Å; V234-L238 HydrophobicContact CG1-CD1 4.22Å; V234-L238 WeakPolarHBondContact O-CB 3.43Å; V234-L238 VanDerWaalsContact O-CG 3.27Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 2.83Å
235	V	94.4	Very high	86.6	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-37.4	173.7	177.2	0	0	0	0	111.9	A177 W181 F231 I233 G239 I292 L328	A177-V235 HydrophobicContact CB-CG2 3.74Å; W181-V235 PolarHBondContact NE1-O 2.93Å; F231-V235 HydrophobicContact CD1-CG2 4.31Å; F231-V235 HydrophobicContact CE1-CG2 3.94Å; F231-V235 HydrophobicContact CE2-CG2 4.2Å; F231-V235 HydrophobicContact CZ-CG2 3.89Å; F231-V235 WeakPolarHBondContact O-CG2 3.35Å; F231-V235 PolarHBondContact O-N 3.49Å; I233-V235 VanDerWaalsContact C-N 3.31Å; I233-V235 PolarHBondContact O-N 2.86Å; V235-G239 PolarHBondContact O-N 2.93Å; V235-I292 HydrophobicContact CB-CD1 3.89Å; V235-I292 HydrophobicContact CG1-CD1 3.64Å; V235-L328 HydrophobicContact CG1-CD2 3.67Å; V235-L328 HydrophobicContact CG1-CG 4.07Å
236	H	92.9	Very high	87.3	Confident	4 Å²	4	28 Å²	28	2%	0.019	13%	0.129	C	C	.	.	H	α-helix	trans	-63.3	-51.1	173.5	-179.4	101.6	0	0	0	112.1	G232 I233 V234 L238 G239 H240 H246 I292 M293	G232-H236 WeakPolarHBondContact O-CB 3.41Å; G232-H236 PolarHBondContact O-N 2.77Å; I233-H236 VanDerWaalsContact O-CB 3.3Å; I233-H236 WeakPolarHBondContact O-CB 3.3Å; I233-H236 PolarHBondContact O-N 2.86Å; I233-H236 VanDerWaalsContact O-N 3.08Å; V234-H236 VanDerWaalsContact C-N 3.34Å; V234-H236 PolarHBondContact O-N 2.83Å; H236-L238 PolarHBondContact O-N 2.92Å; H236-G239 WeakPolarHBondContact O-CA 3.03Å; H236-G239 PolarHBondContact O-N 3.3Å; H236-H240 AromaticContact CD2-NE2 3.96Å; H236-H240 AromaticContact NE2-NE2 3.5Å; H236-H240 PolarHBondContact NE2-NE2 2.88Å; H236-H240 PolarHBondContact O-N 3.15Å; H236-H246 AromaticContact CE1-CD2 3.47Å; H236-H246 PolarHBondContact CE1-CD2 2.82Å; H236-H246 VanDerWaalsContact CE1-CD2 3.47Å; H236-H246 AromaticContact CE1-NE2 3.51Å; H236-H246 AromaticContact NE2-CD2 3.53Å; H236-H246 AromaticContact NE2-NE2 3.08Å; H236-H246 PolarHBondContact NE2-NE2 2.97Å; H236-I292 HydrophobicContact CB-CG1 4.24Å; H236-I292 PolarHBondContact ND1-O 2.72Å; H236-M293 WeakPolarHBondContact O-CE 3.38Å
237	E	92.6	Very high	88.4	Confident	4 Å²	4	20 Å²	20	2%	0.019	10%	0.095	C	C	.	.	H	α-helix	trans	-61.9	-33.2	179.1	-63.7	-51.9	143	0	0	112.6	C209 S210 I222 I224 I233 V234 H240 V241	C209-E237 VanDerWaalsContact C-OE2 3.24Å; C209-E237 WeakPolarHBondContact CA-OE2 3.2Å; S210-E237 WeakPolarHBondContact CB-O 3.03Å; S210-E237 WeakPolarHBondContact CB-OE2 3.01Å; S210-E237 PolarHBondContact N-OE2 2.85Å; S210-E237 VanDerWaalsContact N-OE2 3.1Å; S210-E237 PolarHBondContact OG-O 2.8Å; I222-E237 HydrophobicContact CD1-CB 3.57Å; I222-E237 HydrophobicContact CG1-CB 3.95Å; I224-E237 HydrophobicContact CD1-CB 4.39Å; I224-E237 HydrophobicContact CD1-CG 4.05Å; I233-E237 WeakPolarHBondContact O-CG 3.5Å; I233-E237 PolarHBondContact O-N 2.81Å; V234-E237 PolarHBondContact O-N 2.88Å; E237-H240 WeakPolarHBondContact O-CB 3.45Å; E237-H240 PolarHBondContact O-N 3.38Å; E237-H240 IonicContact OE2-CD2 3.96Å; E237-V241 PolarHBondContact O-N 2.98Å
238	L	94.7	Very high	89.2	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-69.7	-29.8	170.5	-72.8	172.2	0	0	0	112.8	A177 M178 F189 I199 F201 I222 V234 H236 H240 V241 I242	A177-L238 HydrophobicContact CB-CD1 3.87Å; M178-L238 HydrophobicContact CB-CD1 4.5Å; M178-L238 HydrophobicContact CG-CD1 3.66Å; M178-L238 HydrophobicContact CG-CD2 4.12Å; F189-L238 HydrophobicContact CE1-CD2 3.78Å; F189-L238 HydrophobicContact CZ-CD2 4.07Å; I199-L238 HydrophobicContact CD1-CD2 4.12Å; F201-L238 HydrophobicContact CZ-CD2 4.13Å; I222-L238 HydrophobicContact CD1-CD2 4.13Å; I222-L238 HydrophobicContact CD1-CG 4.32Å; V234-L238 HydrophobicContact CG1-CD1 4.22Å; V234-L238 WeakPolarHBondContact O-CB 3.43Å; V234-L238 VanDerWaalsContact O-CG 3.27Å; V234-L238 WeakPolarHBondContact O-CG 3.44Å; V234-L238 PolarHBondContact O-N 2.83Å; H236-L238 PolarHBondContact O-N 2.92Å; L238-H240 VanDerWaalsContact C-N 3.34Å; L238-V241 WeakPolarHBondContact O-CB 3.42Å; L238-V241 PolarHBondContact O-N 2.98Å; L238-I242 WeakPolarHBondContact O-CB 3.37Å; L238-I242 VanDerWaalsContact O-CG1 3.3Å; L238-I242 WeakPolarHBondContact O-CG1 3.26Å; L238-I242 PolarHBondContact O-N 2.87Å
239	G	94.2	Very high	90	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-61.5	-41.2	170.6	0	0	0	0	0	112.3	W181 V235 H236 I242 G243 F244	W181-G239 VanDerWaalsContact CZ2-CA 3.43Å; V235-G239 PolarHBondContact O-N 2.93Å; H236-G239 WeakPolarHBondContact O-CA 3.03Å; H236-G239 PolarHBondContact O-N 3.3Å; G239-I242 PolarHBondContact O-N 2.67Å; G239-G243 PolarHBondContact O-N 3.36Å; G239-F244 WeakPolarHBondContact O-CB 3.33Å; G239-F244 PolarHBondContact O-N 2.79Å
240	H	93	Very high	90.7	Very high	13 Å²	13	13.7 Å²	13.7	6%	0.06	6%	0.061	C	C	.	.	H	α-helix	trans	-59.6	-49.9	168.8	-71.7	-43.6	0	0	0	111.6	Y211 V212 G213 H236 E237 L238 I242 G243 F244 H246 M293	Y211-H240 CarbonylContact O-C 3.57Å; V212-H240 CarbonylContact C-O 3.52Å; V212-H240 VanDerWaalsContact CA-O 3.29Å; V212-H240 WeakPolarHBondContact CA-O 3.38Å; V212-H240 HydrophobicContact CG2-CB 4.42Å; G213-H240 PolarHBondContact N-O 2.83Å; H236-H240 AromaticContact CD2-NE2 3.96Å; H236-H240 AromaticContact NE2-NE2 3.5Å; H236-H240 PolarHBondContact NE2-NE2 2.88Å; H236-H240 PolarHBondContact O-N 3.15Å; E237-H240 WeakPolarHBondContact O-CB 3.45Å; E237-H240 PolarHBondContact O-N 3.38Å; E237-H240 IonicContact OE2-CD2 3.96Å; L238-H240 VanDerWaalsContact C-N 3.34Å; H240-I242 PolarHBondContact O-N 2.88Å; H240-G243 WeakPolarHBondContact O-CA 2.97Å; H240-G243 PolarHBondContact O-N 2.95Å; H240-F244 PolarHBondContact ND1-O 3.11Å; H240-H246 AromaticContact CE1-CD2 3.52Å; H240-H246 AromaticContact CE1-CE1 3.68Å; H240-H246 AromaticContact CE1-NE2 3.22Å; H240-H246 PolarHBondContact CE1-NE2 3.12Å; H240-H246 AromaticContact NE2-CD2 3.7Å; H240-H246 AromaticContact NE2-CE1 3.55Å; H240-H246 AromaticContact NE2-NE2 2.97Å; H240-H246 PolarHBondContact NE2-NE2 2.69Å; H240-M293 WeakPolarHBondContact CE1-CE 3.05Å; H240-M293 WeakPolarHBondContact ND1-CE 3.46Å
241	V	94.1	Very high	90.8	Very high	1 Å²	1	10.6 Å²	10.6	1%	0.006	5%	0.051	C	C	.	.	H	α-helix	trans	-53.3	-41.2	176.9	170.9	0	0	0	0	112.2	W153 I158 I199 S210 G213 I222 E237 L238 G243	W153-V241 HydrophobicContact CZ2-CG1 4.35Å; W153-V241 PolarHBondContact NE1-O 2.78Å; I158-V241 HydrophobicContact CD1-CG1 4.1Å; I158-V241 HydrophobicContact CG2-CG1 3.8Å; I199-V241 HydrophobicContact CD1-CG1 4.28Å; I199-V241 HydrophobicContact CD1-CG2 4.5Å; I199-V241 HydrophobicContact CG2-CB 4.49Å; I199-V241 HydrophobicContact CG2-CG1 3.57Å; I199-V241 HydrophobicContact CG2-CG2 4.04Å; S210-V241 WeakPolarHBondContact OG-CG2 3.44Å; G213-V241 VanDerWaalsContact CA-O 3.28Å; G213-V241 WeakPolarHBondContact CA-O 3.4Å; I222-V241 HydrophobicContact CD1-CG2 4.24Å; E237-V241 PolarHBondContact O-N 2.98Å; L238-V241 WeakPolarHBondContact O-CB 3.42Å; L238-V241 PolarHBondContact O-N 2.98Å; V241-G243 PolarHBondContact O-N 3.19Å
242	I	94.4	Very high	90.8	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-67.4	-23.3	178.8	-75.7	170.6	0	0	0	112.2	I158 W181 V187 F189 L238 G239 H240 F244 Y340	I158-I242 HydrophobicContact CD1-CG1 3.97Å; W181-I242 HydrophobicContact CB-CD1 4.22Å; W181-I242 HydrophobicContact CD2-CD1 3.24Å; W181-I242 HydrophobicContact CE3-CD1 3.36Å; W181-I242 HydrophobicContact CG-CD1 3.68Å; W181-I242 HydrophobicContact CH2-CD1 4.09Å; W181-I242 HydrophobicContact CZ2-CD1 4Å; W181-I242 HydrophobicContact CZ3-CD1 3.8Å; V187-I242 HydrophobicContact CG1-CD1 4.4Å; V187-I242 HydrophobicContact CG1-CG1 4.3Å; F189-I242 HydrophobicContact CZ-CD1 4.19Å; F189-I242 HydrophobicContact CZ-CG1 4.37Å; L238-I242 WeakPolarHBondContact O-CB 3.37Å; L238-I242 VanDerWaalsContact O-CG1 3.3Å; L238-I242 WeakPolarHBondContact O-CG1 3.26Å; L238-I242 PolarHBondContact O-N 2.87Å; G239-I242 PolarHBondContact O-N 2.67Å; H240-I242 PolarHBondContact O-N 2.88Å; I242-F244 HydrophobicContact CG2-CD1 4.46Å; I242-F244 HydrophobicContact CG2-CE1 4.26Å; I242-Y340 HydrophobicContact CG2-CE2 3.78Å; I242-Y340 WeakPolarHBondContact O-CE2 3.46Å; I242-Y340 PolarHBondContact O-OH 3.22Å
243	G	90.6	Very high	91	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.044	C	C	.	.	T	Hydrogen-bonded Turn	trans	118.1	19.2	173.9	0	0	0	0	0	114.7	T146 G239 H240 V241	T146-G243 WeakPolarHBondContact CB-O 3.04Å; T146-G243 PolarHBondContact N-O 2.85Å; G239-G243 PolarHBondContact O-N 3.36Å; H240-G243 WeakPolarHBondContact O-CA 2.97Å; H240-G243 PolarHBondContact O-N 2.95Å; V241-G243 PolarHBondContact O-N 3.19Å
244	F	91.2	Very high	91.1	Very high	3 Å²	3	12.3 Å²	12.3	1%	0.013	6%	0.062	C	C	.	.	B	Isolated β-bridge	trans	-89.3	141.5	178.7	-66.6	-1.1	0	0	0	112.3	A145 W181 G239 H240 I242 M293 D332 Q335 A336 L339	A145-F244 HydrophobicContact CB-CD1 3.94Å; A145-F244 HydrophobicContact CB-CE1 4.12Å; W181-F244 HydrophobicContact CH2-CD2 4.12Å; W181-F244 AromaticContact CH2-CE2 3.73Å; W181-F244 HydrophobicContact CH2-CE2 3.73Å; W181-F244 HydrophobicContact CH2-CZ 4.43Å; W181-F244 HydrophobicContact CZ3-CE2 4.3Å; G239-F244 WeakPolarHBondContact O-CB 3.33Å; G239-F244 PolarHBondContact O-N 2.79Å; H240-F244 PolarHBondContact ND1-O 3.11Å; I242-F244 HydrophobicContact CG2-CD1 4.46Å; I242-F244 HydrophobicContact CG2-CE1 4.26Å; F244-M293 HydrophobicContact CB-CE 4.44Å; F244-M293 HydrophobicContact CB-CG 3.94Å; F244-M293 HydrophobicContact CD2-CG 3.84Å; F244-M293 HydrophobicContact CG-CG 4.44Å; F244-D332 HydrophobicContact CE2-CB 4.28Å; F244-D332 WeakPolarHBondContact CZ-O 3.29Å; F244-Q335 HydrophobicContact CE1-CB 4.38Å; F244-Q335 HydrophobicContact CE1-CG 4.11Å; F244-Q335 HydrophobicContact CZ-CB 3.94Å; F244-Q335 HydrophobicContact CZ-CG 4.15Å; F244-A336 HydrophobicContact CE1-CB 4.39Å; F244-A336 HydrophobicContact CZ-CB 3.77Å; F244-L339 HydrophobicContact CD1-CD2 4.45Å; F244-L339 HydrophobicContact CE1-CD2 4.15Å
245	W	88.4	Confident	91.1	Very high	50 Å²	50	18.5 Å²	18.5	19%	0.189	10%	0.095	C	C	.	.	P	Polyproline II helix	trans	-92.3	169.5	164.6	-66.5	98.9	0	0	0	109.6	A144 V212 M275 V280	A144-W245 PolarHBondContact O-N 3.47Å; V212-W245 HydrophobicContact CB-CD2 4.42Å; V212-W245 HydrophobicContact CB-CH2 4.17Å; V212-W245 HydrophobicContact CB-CZ2 4.04Å; V212-W245 HydrophobicContact CB-CZ3 4.43Å; V212-W245 HydrophobicContact CG1-CD2 4.07Å; V212-W245 HydrophobicContact CG1-CG 4.37Å; V212-W245 HydrophobicContact CG1-CZ2 4.07Å; V212-W245 HydrophobicContact CG2-CD2 3.99Å; V212-W245 HydrophobicContact CG2-CE3 3.75Å; V212-W245 HydrophobicContact CG2-CH2 3.97Å; V212-W245 HydrophobicContact CG2-CZ2 4.21Å; V212-W245 HydrophobicContact CG2-CZ3 3.74Å; W245-M275 HydrophobicContact CD2-CE 3.77Å; W245-M275 HydrophobicContact CD2-CG 4.44Å; W245-M275 HydrophobicContact CD2-SD 4.34Å; W245-M275 HydrophobicContact CE3-CE 3.8Å; W245-M275 HydrophobicContact CE3-SD 4.01Å; W245-M275 HydrophobicContact CH2-CE 3.61Å; W245-M275 HydrophobicContact CZ2-CE 3.54Å; W245-M275 HydrophobicContact CZ3-CE 3.73Å; W245-M275 HydrophobicContact CZ3-SD 4.15Å; W245-V280 HydrophobicContact CG-CG2 4.23Å
246	H	90.6	Very high	90.9	Very high	27 Å²	27	21 Å²	21	13%	0.125	11%	0.107	C	C	.	.	P	Polyproline II helix	trans	-69.5	136	174.4	-60.8	128	0	0	0	111.6	H236 H240 H248 T249 M293 Y295	H236-H246 AromaticContact CE1-CD2 3.47Å; H236-H246 PolarHBondContact CE1-CD2 2.82Å; H236-H246 VanDerWaalsContact CE1-CD2 3.47Å; H236-H246 AromaticContact CE1-NE2 3.51Å; H236-H246 AromaticContact NE2-CD2 3.53Å; H236-H246 AromaticContact NE2-NE2 3.08Å; H236-H246 PolarHBondContact NE2-NE2 2.97Å; H240-H246 AromaticContact CE1-CD2 3.52Å; H240-H246 AromaticContact CE1-CE1 3.68Å; H240-H246 AromaticContact CE1-NE2 3.22Å; H240-H246 PolarHBondContact CE1-NE2 3.12Å; H240-H246 AromaticContact NE2-CD2 3.7Å; H240-H246 AromaticContact NE2-CE1 3.55Å; H240-H246 AromaticContact NE2-NE2 2.97Å; H240-H246 PolarHBondContact NE2-NE2 2.69Å; H246-H248 WeakPolarHBondContact CB-CE1 3.4Å; H246-H248 WeakPolarHBondContact CB-ND1 3.46Å; H246-H248 AromaticContact CG-CE1 3.88Å; H246-H248 PolarHBondContact O-N 2.71Å; H246-T249 HydrophobicContact CB-CG2 4.02Å; H246-T249 WeakPolarHBondContact O-CB 3.43Å; H246-T249 PolarHBondContact O-N 2.98Å; H246-T249 PolarHBondContact O-OG1 2.87Å; H246-M293 WeakPolarHBondContact CA-O 3.46Å; H246-M293 WeakPolarHBondContact CB-O 3.2Å; H246-M293 PolarHBondContact CD2-O 2.53Å; H246-Y295 AromaticContact CD2-CE1 3.82Å; H246-Y295 AromaticContact CE1-CE1 3.51Å; H246-Y295 AromaticContact CE1-CZ 3.76Å; H246-Y295 PolarHBondContact CE1-OH 3.35Å; H246-Y295 AromaticContact CG-CE1 3.87Å; H246-Y295 AromaticContact ND1-CE1 3.71Å; H246-Y295 AromaticContact ND1-CZ 3.81Å; H246-Y295 AromaticContact NE2-CE1 3.59Å
247	E	90.7	Very high	90.9	Very high	6 Å²	6	20.9 Å²	20.9	3%	0.028	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-63	-29	-171.8	-173.4	67.9	-175.2	0	0	112.7	A144 T249 R250 Y287 D288 M293 H294	A144-E247 WeakPolarHBondContact CB-OE2 3.38Å; E247-T249 PolarHBondContact O-N 2.84Å; E247-R250 WeakPolarHBondContact O-CD 3.05Å; E247-R250 WeakPolarHBondContact O-CG 3.43Å; E247-R250 PolarHBondContact O-N 3.4Å; E247-R250 WeakPolarHBondContact OE1-CD 3.32Å; E247-R250 IonicContact OE1-CZ 2.83Å; E247-R250 IonicContact OE1-NE 2.8Å; E247-R250 IonicContact OE1-NH1 2.86Å; E247-R250 PolarHBondContact OE1-NH1 2.77Å; E247-R250 WeakPolarHBondContact OE2-CD 3.42Å; E247-R250 IonicContact OE2-NH1 3.52Å; E247-Y287 HydrophobicContact CG-CE1 4.17Å; E247-Y287 HydrophobicContact CG-CE2 4.15Å; E247-Y287 WeakPolarHBondContact O-CE2 3.03Å; E247-Y287 PolarHBondContact O-OH 3.25Å; E247-Y287 WeakPolarHBondContact OE1-CA 3.46Å; E247-D288 PolarHBondContact OE1-N 3.43Å; E247-M293 PolarHBondContact N-O 3.34Å; E247-M293 VanDerWaalsContact N-O 3.12Å; E247-H294 HydrophobicContact CB-CB 4.11Å
248	H	89.4	Confident	90.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-75.1	-5.7	174.9	73.9	-76.3	0	0	0	114.1	H246 R253 N271 Y287 Y295 I309	H246-H248 WeakPolarHBondContact CB-CE1 3.4Å; H246-H248 WeakPolarHBondContact CB-ND1 3.46Å; H246-H248 AromaticContact CG-CE1 3.88Å; H246-H248 PolarHBondContact O-N 2.71Å; H248-R253 VanDerWaalsContact O-CD 3.23Å; H248-R253 WeakPolarHBondContact O-CD 3.14Å; H248-R253 WeakPolarHBondContact O-CG 3.48Å; H248-R253 PolarHBondContact O-NH1 2.8Å; H248-N271 PolarHBondContact NE2-O 2.78Å; H248-Y287 WeakPolarHBondContact CA-OH 3.39Å; H248-Y295 AromaticContact CE1-CD1 3.71Å; H248-Y295 AromaticContact CE1-CD2 3.09Å; H248-Y295 WeakPolarHBondContact CE1-CD2 3.3Å; H248-Y295 AromaticContact CE1-CE1 3.98Å; H248-Y295 AromaticContact CE1-CE2 3.34Å; H248-Y295 WeakPolarHBondContact CE1-CE2 3.23Å; H248-Y295 AromaticContact CE1-CG 3.3Å; H248-Y295 AromaticContact CE1-CZ 3.83Å; H248-Y295 AromaticContact ND1-CD2 3.75Å; H248-Y295 AromaticContact ND1-CG 3.56Å; H248-Y295 AromaticContact NE2-CD2 3.38Å; H248-Y295 WeakPolarHBondContact NE2-CD2 3.02Å; H248-Y295 AromaticContact NE2-CE2 3.56Å; H248-I309 HydrophobicContact CB-CD1 3.95Å
249	T	88.8	Confident	90.9	Very high	11 Å²	11	25.8 Å²	25.8	7%	0.067	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-95.8	-1.2	178.4	70.1	0	0	0	0	113.2	H246 E247 K274 M275	H246-T249 HydrophobicContact CB-CG2 4.02Å; H246-T249 WeakPolarHBondContact O-CB 3.43Å; H246-T249 PolarHBondContact O-N 2.98Å; H246-T249 PolarHBondContact O-OG1 2.87Å; E247-T249 PolarHBondContact O-N 2.84Å; T249-K274 CarbonylContact O-C 3.48Å; T249-K274 WeakPolarHBondContact O-CA 3.37Å; T249-M275 PolarHBondContact O-N 2.8Å
250	R	86.9	Confident	90.8	Very high	1 Å²	1	27.3 Å²	27.3	0%	0.004	14%	0.143	C	C	.	.	S	Bend	trans	-55.3	145.5	179	-65.7	171.9	56.9	143.7	-8.2	112.4	R143 A144 E247 D252 R253 S282 P286	R143-R250 WeakPolarHBondContact O-CB 3.15Å; R143-R250 VanDerWaalsContact O-CG 3.24Å; R143-R250 WeakPolarHBondContact O-CG 3.32Å; A144-R250 HydrophobicContact CB-CG 3.77Å; E247-R250 WeakPolarHBondContact O-CD 3.05Å; E247-R250 WeakPolarHBondContact O-CG 3.43Å; E247-R250 PolarHBondContact O-N 3.4Å; E247-R250 WeakPolarHBondContact OE1-CD 3.32Å; E247-R250 IonicContact OE1-CZ 2.83Å; E247-R250 IonicContact OE1-NE 2.8Å; E247-R250 IonicContact OE1-NH1 2.86Å; E247-R250 PolarHBondContact OE1-NH1 2.77Å; E247-R250 WeakPolarHBondContact OE2-CD 3.42Å; E247-R250 IonicContact OE2-NH1 3.52Å; R250-D252 IonicContact CZ-OD2 3.44Å; R250-D252 IonicContact NE-OD1 3.95Å; R250-D252 PolarHBondContact NE-OD1 3Å; R250-D252 IonicContact NE-OD2 2.7Å; R250-D252 PolarHBondContact NE-OD2 2.71Å; R250-D252 IonicContact NH2-OD1 3.25Å; R250-D252 IonicContact NH2-OD2 2.84Å; R250-D252 PolarHBondContact NH2-OD2 2.81Å; R250-D252 PolarHBondContact O-N 2.87Å; R250-R253 HydrophobicContact CB-CB 4.14Å; R250-R253 VanDerWaalsContact O-CB 3.3Å; R250-R253 WeakPolarHBondContact O-CB 3.37Å; R250-R253 WeakPolarHBondContact O-CG 3.48Å; R250-R253 PolarHBondContact O-N 2.94Å; R250-S282 VanDerWaalsContact CZ-OG 3.32Å; R250-S282 PolarHBondContact NH1-OG 3.29Å; R250-S282 PolarHBondContact NH2-OG 2.71Å; R250-P286 PolarHBondContact NH1-O 2.81Å
251	P	86.5	Confident	90.7	Very high	31 Å²	31	32.2 Å²	32.2	20%	0.201	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-32.1	176.5	-23.5	34.1	0	0	0	114	R143 K274	R143-P251 HydrophobicContact CB-CG 4.07Å; R143-P251 WeakPolarHBondContact O-CD 3.24Å; P251-K274 PolarHBondContact O-NZ 2.71Å
252	D	87.4	Confident	90.6	Very high	22 Å²	22	38.2 Å²	38.2	12%	0.118	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	0.1	178.5	53.1	-58.6	0	0	0	114.1	P142 R143 R250 D254 D255	P142-D252 HydrophobicContact CB-CB 4.24Å; P142-D252 VanDerWaalsContact CB-CG 3.46Å; P142-D252 WeakPolarHBondContact CB-OD2 3.33Å; R143-D252 PolarHBondContact N-OD1 3.13Å; R250-D252 IonicContact CZ-OD2 3.44Å; R250-D252 IonicContact NE-OD1 3.95Å; R250-D252 PolarHBondContact NE-OD1 3Å; R250-D252 IonicContact NE-OD2 2.7Å; R250-D252 PolarHBondContact NE-OD2 2.71Å; R250-D252 IonicContact NH2-OD1 3.25Å; R250-D252 IonicContact NH2-OD2 2.84Å; R250-D252 PolarHBondContact NH2-OD2 2.81Å; R250-D252 PolarHBondContact O-N 2.87Å; D252-D254 PolarHBondContact O-N 2.89Å; D252-D255 WeakPolarHBondContact O-CB 3.32Å; D252-D255 PolarHBondContact O-N 3.21Å
253	R	90.1	Very high	90.4	Very high	5 Å²	5	39.5 Å²	39.5	2%	0.019	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-58.2	-28.5	-173.4	72.9	98.6	-172.6	-82.4	0.4	114.8	H248 R250 D255 H256 V257 F272 K274 Y287	H248-R253 VanDerWaalsContact O-CD 3.23Å; H248-R253 WeakPolarHBondContact O-CD 3.14Å; H248-R253 WeakPolarHBondContact O-CG 3.48Å; H248-R253 PolarHBondContact O-NH1 2.8Å; R250-R253 HydrophobicContact CB-CB 4.14Å; R250-R253 VanDerWaalsContact O-CB 3.3Å; R250-R253 WeakPolarHBondContact O-CB 3.37Å; R250-R253 WeakPolarHBondContact O-CG 3.48Å; R250-R253 PolarHBondContact O-N 2.94Å; R253-D255 PolarHBondContact O-N 2.91Å; R253-H256 CarbonylContact O-C 3.48Å; R253-H256 PolarHBondContact O-N 2.89Å; R253-V257 HydrophobicContact CB-CG2 4.2Å; R253-V257 WeakPolarHBondContact O-CG2 3.29Å; R253-V257 PolarHBondContact O-N 3.06Å; R253-F272 PolarHBondContact NH1-O 2.9Å; R253-F272 PolarHBondContact NH2-O 3.04Å; R253-K274 HydrophobicContact CG-CD 3.79Å; R253-K274 HydrophobicContact CG-CG 4.03Å; R253-Y287 HydrophobicContact CB-CE2 3.86Å
254	D	90.9	Very high	90.2	Very high	80 Å²	80	39.5 Å²	39.5	43%	0.428	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-68.3	-16.4	-179.3	-58.5	-37.4	0	0	0	112.8	D252 K274	D252-D254 PolarHBondContact O-N 2.89Å; D254-K274 WeakPolarHBondContact OD2-CD 3.17Å; D254-K274 VanDerWaalsContact OD2-CE 3.22Å; D254-K274 WeakPolarHBondContact OD2-CE 3.22Å; D254-K274 IonicContact OD2-NZ 2.76Å; D254-K274 PolarHBondContact OD2-NZ 3.41Å
255	D	90.5	Very high	89.9	Confident	130 Å²	130	43.2 Å²	43.2	70%	0.695	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-77.4	-12	171.8	-60.3	-35.4	0	0	0	112	D252 R253	D252-D255 WeakPolarHBondContact O-CB 3.32Å; D252-D255 PolarHBondContact O-N 3.21Å; R253-D255 PolarHBondContact O-N 2.91Å
256	H	90.6	Very high	89.7	Confident	54 Å²	54	46.1 Å²	46.1	25%	0.25	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-33.8	-170.4	-60.9	-67.6	0	0	0	114.2	R253 Y287 F289 S312	R253-H256 CarbonylContact O-C 3.48Å; R253-H256 PolarHBondContact O-N 2.89Å; H256-Y287 HydrophobicContact CB-CD1 3.73Å; H256-Y287 HydrophobicContact CB-CD2 3.78Å; H256-Y287 HydrophobicContact CB-CE1 4.04Å; H256-Y287 HydrophobicContact CB-CE2 4.07Å; H256-Y287 HydrophobicContact CB-CG 3.61Å; H256-Y287 VanDerWaalsContact CD2-CB 3.49Å; H256-Y287 WeakPolarHBondContact CD2-CB 3.32Å; H256-Y287 AromaticContact CD2-CD2 3.47Å; H256-Y287 VanDerWaalsContact CD2-CD2 3.47Å; H256-Y287 WeakPolarHBondContact CD2-CD2 3.01Å; H256-Y287 AromaticContact CD2-CG 3.59Å; H256-Y287 AromaticContact CG-CD2 3.74Å; H256-Y287 AromaticContact CG-CG 3.49Å; H256-Y287 VanDerWaalsContact CG-CG 3.49Å; H256-F289 HydrophobicContact CB-CE1 4.3Å; H256-F289 HydrophobicContact CB-CZ 3.98Å; H256-S312 WeakPolarHBondContact O-CB 3.47Å; H256-S312 PolarHBondContact O-N 3.34Å; H256-S312 PolarHBondContact O-OG 3.31Å
257	V	93.2	Very high	89.2	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	142	179.7	-57.1	0	0	0	0	110.9	R253 I259 Y287 F289 I309 P311	R253-V257 HydrophobicContact CB-CG2 4.2Å; R253-V257 WeakPolarHBondContact O-CG2 3.29Å; R253-V257 PolarHBondContact O-N 3.06Å; V257-I259 HydrophobicContact CG2-CD1 4.22Å; V257-Y287 HydrophobicContact CG1-CE1 3.94Å; V257-F289 HydrophobicContact CG1-CD1 4.45Å; V257-F289 HydrophobicContact CG1-CE1 3.94Å; V257-I309 HydrophobicContact CB-CG2 3.81Å; V257-I309 HydrophobicContact CG1-CG2 4.13Å; V257-I309 HydrophobicContact CG2-CG2 4.05Å; V257-P311 HydrophobicContact CG1-CB 4.29Å
258	T	93.4	Very high	88.7	Confident	86 Å²	86	48 Å²	48	53%	0.528	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128	172	-54.9	0	0	0	0	109.6	L310	T258-L310 PolarHBondContact N-O 3.14Å; T258-L310 PolarHBondContact O-N 3.34Å
259	I	93.4	Very high	88.3	Confident	21 Å²	21	51.2 Å²	51.2	11%	0.108	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.2	174.3	-53.7	-50.9	0	0	0	109.7	V257 R261 I264 F272 T308 I309	V257-I259 HydrophobicContact CG2-CD1 4.22Å; I259-R261 HydrophobicContact CG2-CG 4.21Å; I259-R261 PolarHBondContact O-N 3.2Å; I259-I264 HydrophobicContact CG2-CD1 3.93Å; I259-F272 HydrophobicContact CD1-CD1 4.12Å; I259-F272 HydrophobicContact CG2-CB 3.99Å; I259-F272 HydrophobicContact CG2-CD1 3.87Å; I259-F272 HydrophobicContact CG2-CG 4.11Å; I259-T308 WeakPolarHBondContact CA-O 2.98Å; I259-I309 HydrophobicContact CD1-CB 4.37Å; I259-I309 HydrophobicContact CD1-CG1 3.98Å; I259-I309 HydrophobicContact CD1-CG2 4.03Å
260	I	92.3	Very high	87.9	Confident	31 Å²	31	55.5 Å²	55.5	16%	0.159	29%	0.291	C	S	.	.			trans	-90.5	86.8	-179.7	-55.1	174.4	0	0	0	107.9	E262 N263 D307 T308 L310	I260-E262 VanDerWaalsContact C-N 3.25Å; I260-E262 HydrophobicContact CG2-CG 3.78Å; I260-E262 WeakPolarHBondContact CG2-OE2 3.45Å; I260-E262 PolarHBondContact O-N 2.04Å; I260-N263 HydrophobicContact CB-CB 4.38Å; I260-N263 HydrophobicContact CG2-CB 3.98Å; I260-N263 WeakPolarHBondContact CG2-ND2 3.29Å; I260-N263 PolarHBondContact O-N 2.03Å; I260-D307 HydrophobicContact CD1-CB 4.5Å; I260-T308 PolarHBondContact N-O 3.2Å; I260-L310 HydrophobicContact CD1-CB 3.97Å; I260-L310 HydrophobicContact CD1-CD2 4.17Å; I260-L310 HydrophobicContact CG1-CB 4.46Å
261	R	90.9	Very high	87.6	Confident	116 Å²	116	56.8 Å²	56.8	44%	0.438	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-63.7	-32.7	-171.5	-67.8	-174.6	175.7	-81.9	1.4	112.6	I259 N263 I264	I259-R261 HydrophobicContact CG2-CG 4.21Å; I259-R261 PolarHBondContact O-N 3.2Å; R261-N263 PolarHBondContact O-N 2.6Å; R261-I264 HydrophobicContact CB-CD1 4.42Å; R261-I264 HydrophobicContact CG-CD1 4.31Å; R261-I264 PolarHBondContact O-N 3.42Å; R261-I264 VanDerWaalsContact O-N 3.14Å
262	E	91.6	Very high	87.7	Confident	128 Å²	128	55.3 Å²	55.3	60%	0.598	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.9	-5.6	174.2	68	-88.7	-144.2	0	0	114.4	I260 R302	I260-E262 VanDerWaalsContact C-N 3.25Å; I260-E262 HydrophobicContact CG2-CG 3.78Å; I260-E262 WeakPolarHBondContact CG2-OE2 3.45Å; I260-E262 PolarHBondContact O-N 2.04Å; E262-R302 PolarHBondContact O-NE 3.46Å; E262-R302 VanDerWaalsContact O-NE 3.12Å; E262-R302 PolarHBondContact O-NH1 3.36Å; E262-R302 PolarHBondContact O-NH2 2.8Å
263	N	90.9	Very high	87.6	Confident	26 Å²	26	59 Å²	59	14%	0.139	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-105.2	-9.9	170.8	-73.1	-13.4	0	0	0	113.3	I260 R261 S301 R302 L306 D307 T308	I260-N263 HydrophobicContact CB-CB 4.38Å; I260-N263 HydrophobicContact CG2-CB 3.98Å; I260-N263 WeakPolarHBondContact CG2-ND2 3.29Å; I260-N263 PolarHBondContact O-N 2.03Å; R261-N263 PolarHBondContact O-N 2.6Å; N263-S301 CarbonylContact O-C 3.53Å; N263-S301 WeakPolarHBondContact O-CA 3.31Å; N263-R302 WeakPolarHBondContact O-CG 3.01Å; N263-R302 PolarHBondContact O-N 3.41Å; N263-L306 HydrophobicContact CB-CB 4.23Å; N263-D307 WeakPolarHBondContact CB-O 3.25Å; N263-D307 PolarHBondContact ND2-O 3.21Å; N263-T308 HydrophobicContact CB-CG2 4.17Å
264	I	87.4	Confident	87.5	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-72	146.9	-179.9	-55.4	171.1	0	0	0	110.2	I259 R261 Q268 E269 F272 F300 R302 T308	I259-I264 HydrophobicContact CG2-CD1 3.93Å; R261-I264 HydrophobicContact CB-CD1 4.42Å; R261-I264 HydrophobicContact CG-CD1 4.31Å; R261-I264 PolarHBondContact O-N 3.42Å; R261-I264 VanDerWaalsContact O-N 3.14Å; I264-Q268 HydrophobicContact CG2-CB 3.95Å; I264-E269 HydrophobicContact CG2-CG 4.22Å; I264-F272 HydrophobicContact CD1-CB 4.31Å; I264-F272 HydrophobicContact CD1-CD1 4.41Å; I264-F272 HydrophobicContact CD1-CD2 3.6Å; I264-F272 HydrophobicContact CD1-CE2 3.95Å; I264-F272 HydrophobicContact CD1-CG 3.86Å; I264-F272 HydrophobicContact CD1-CZ 4.48Å; I264-F272 HydrophobicContact CG1-CD2 4.27Å; I264-F272 HydrophobicContact CG1-CE2 4.1Å; I264-F272 HydrophobicContact CG1-CZ 4.41Å; I264-F272 HydrophobicContact CG2-CD2 4.25Å; I264-F272 HydrophobicContact CG2-CE2 3.88Å; I264-F300 CarbonylContact C-O 3.55Å; I264-F300 WeakPolarHBondContact CA-O 3.02Å; I264-F300 HydrophobicContact CG2-CB 4.47Å; I264-R302 VanDerWaalsContact O-CZ 3.31Å; I264-R302 PolarHBondContact O-NE 3.4Å; I264-R302 PolarHBondContact O-NH2 2.93Å; I264-T308 HydrophobicContact CG1-CG2 3.94Å
265	Q	83.9	Confident	87.1	Confident	82 Å²	82	61 Å²	61	38%	0.383	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-66.6	138.3	170.4	-70.6	173.6	15.3	0	0	111.5	G267 Q268 F300 S301 R302	Q265-G267 PolarHBondContact O-N 3.27Å; Q265-Q268 HydrophobicContact CB-CB 4.38Å; Q265-Q268 HydrophobicContact CB-CG 3.98Å; Q265-Q268 WeakPolarHBondContact O-CB 3.48Å; Q265-Q268 PolarHBondContact O-N 3.33Å; Q265-F300 WeakPolarHBondContact CG-O 3.3Å; Q265-F300 PolarHBondContact N-O 2.86Å; Q265-S301 WeakPolarHBondContact CG-O 3.41Å; Q265-S301 PolarHBondContact NE2-O 3.46Å; Q265-R302 HydrophobicContact CG-CB 4.39Å
266	P	84.2	Confident	86.5	Confident	111 Å²	111	61.4 Å²	61.4	72%	0.721	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	127.9	178.7	-25.8	34.6	0	0	0	112.7
267	G	79.7	Confident	85.6	Confident	48 Å²	48	61.5 Å²	61.5	50%	0.495	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	-3.4	-179	0	0	0	0	0	114.8	Q265 E269 Y270	Q265-G267 PolarHBondContact O-N 3.27Å; G267-E269 VanDerWaalsContact C-OE2 3.29Å; G267-E269 WeakPolarHBondContact CA-OE2 3.43Å; G267-E269 PolarHBondContact N-OE2 3.35Å; G267-Y270 VanDerWaalsContact O-CD1 3.27Å; G267-Y270 WeakPolarHBondContact O-CD1 3.44Å; G267-Y270 VanDerWaalsContact O-CE1 3.27Å; G267-Y270 WeakPolarHBondContact O-CE1 3.47Å
268	Q	80.4	Confident	84.5	Confident	23 Å²	23	64.1 Å²	64.1	11%	0.107	34%	0.344	C	S	.	.			trans	-101.7	2.8	178.4	-59.3	-61.6	-22.8	0	0	113.5	I264 Q265 Y270 N271 F300	I264-Q268 HydrophobicContact CG2-CB 3.95Å; Q265-Q268 HydrophobicContact CB-CB 4.38Å; Q265-Q268 HydrophobicContact CB-CG 3.98Å; Q265-Q268 WeakPolarHBondContact O-CB 3.48Å; Q265-Q268 PolarHBondContact O-N 3.33Å; Q268-Y270 PolarHBondContact O-N 2.87Å; Q268-N271 PolarHBondContact O-N 3.44Å; Q268-N271 PolarHBondContact O-ND2 2.81Å; Q268-N271 PolarHBondContact OE1-ND2 2.84Å; Q268-F300 HydrophobicContact CB-CB 3.97Å; Q268-F300 HydrophobicContact CB-CD1 3.86Å; Q268-F300 HydrophobicContact CB-CG 4.01Å; Q268-F300 HydrophobicContact CG-CB 4.46Å; Q268-F300 HydrophobicContact CG-CD1 3.7Å; Q268-F300 HydrophobicContact CG-CE1 4.32Å; Q268-F300 HydrophobicContact CG-CG 4.34Å
269	E	82.2	Confident	83.5	Confident	69 Å²	69	61.4 Å²	61.4	32%	0.322	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-65.1	-21.2	-175.8	-59.3	84	173	0	0	113.3	I264 G267 N271 F272	I264-E269 HydrophobicContact CG2-CG 4.22Å; G267-E269 VanDerWaalsContact C-OE2 3.29Å; G267-E269 WeakPolarHBondContact CA-OE2 3.43Å; G267-E269 PolarHBondContact N-OE2 3.35Å; E269-N271 VanDerWaalsContact C-N 3.32Å; E269-N271 PolarHBondContact O-N 3.49Å; E269-F272 PolarHBondContact O-N 2.88Å
270	Y	80.3	Confident	82.7	Confident	100 Å²	100	60.4 Å²	60.4	39%	0.392	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-66.4	-32	178.8	73.4	-90.5	0	0	0	112.4	Y46 G267 Q268 F272 L273	Y46-Y270 WeakPolarHBondContact OH-CD2 3.37Å; Y46-Y270 WeakPolarHBondContact OH-CE2 3.31Å; G267-Y270 VanDerWaalsContact O-CD1 3.27Å; G267-Y270 WeakPolarHBondContact O-CD1 3.44Å; G267-Y270 VanDerWaalsContact O-CE1 3.27Å; G267-Y270 WeakPolarHBondContact O-CE1 3.47Å; Q268-Y270 PolarHBondContact O-N 2.87Å; Y270-F272 PolarHBondContact O-N 2.6Å; Y270-F272 VanDerWaalsContact O-N 3.08Å; Y270-L273 WeakPolarHBondContact O-CB 3.2Å; Y270-L273 WeakPolarHBondContact O-CG 3.2Å; Y270-L273 PolarHBondContact O-N 3.39Å; Y270-L273 VanDerWaalsContact O-N 3.11Å
271	N	80.8	Confident	82.1	Confident	28 Å²	28	61.9 Å²	61.9	15%	0.15	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-65.9	-10.7	177.3	-59.6	-62.8	0	0	0	113.6	H248 Q268 E269 Y295 F300	H248-N271 PolarHBondContact NE2-O 2.78Å; Q268-N271 PolarHBondContact O-N 3.44Å; Q268-N271 PolarHBondContact O-ND2 2.81Å; Q268-N271 PolarHBondContact OE1-ND2 2.84Å; E269-N271 VanDerWaalsContact C-N 3.32Å; E269-N271 PolarHBondContact O-N 3.49Å; N271-Y295 HydrophobicContact CB-CE2 4.27Å; N271-F300 HydrophobicContact CB-CD2 4.19Å; N271-F300 HydrophobicContact CB-CE2 3.93Å
272	F	86.9	Confident	81.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-112	8.6	179.4	-57.9	-95.7	0	0	0	112.7	R253 I259 I264 E269 Y270 T299 F300 I309	R253-F272 PolarHBondContact NH1-O 2.9Å; R253-F272 PolarHBondContact NH2-O 3.04Å; I259-F272 HydrophobicContact CD1-CD1 4.12Å; I259-F272 HydrophobicContact CG2-CB 3.99Å; I259-F272 HydrophobicContact CG2-CD1 3.87Å; I259-F272 HydrophobicContact CG2-CG 4.11Å; I264-F272 HydrophobicContact CD1-CB 4.31Å; I264-F272 HydrophobicContact CD1-CD1 4.41Å; I264-F272 HydrophobicContact CD1-CD2 3.6Å; I264-F272 HydrophobicContact CD1-CE2 3.95Å; I264-F272 HydrophobicContact CD1-CG 3.86Å; I264-F272 HydrophobicContact CD1-CZ 4.48Å; I264-F272 HydrophobicContact CG1-CD2 4.27Å; I264-F272 HydrophobicContact CG1-CE2 4.1Å; I264-F272 HydrophobicContact CG1-CZ 4.41Å; I264-F272 HydrophobicContact CG2-CD2 4.25Å; I264-F272 HydrophobicContact CG2-CE2 3.88Å; E269-F272 PolarHBondContact O-N 2.88Å; Y270-F272 PolarHBondContact O-N 2.6Å; Y270-F272 VanDerWaalsContact O-N 3.08Å; F272-T299 WeakPolarHBondContact CZ-O 3.25Å; F272-F300 HydrophobicContact CE2-CB 3.89Å; F272-F300 AromaticContact CE2-CD2 3.86Å; F272-F300 HydrophobicContact CE2-CD2 3.86Å; F272-F300 HydrophobicContact CE2-CG 4.25Å; F272-F300 HydrophobicContact CZ-CB 4.03Å; F272-F300 AromaticContact CZ-CD2 3.98Å; F272-F300 HydrophobicContact CZ-CD2 3.98Å; F272-F300 HydrophobicContact CZ-CG 4.49Å; F272-I309 HydrophobicContact CD1-CD1 4.41Å; F272-I309 HydrophobicContact CD1-CG1 4.27Å; F272-I309 HydrophobicContact CE1-CD1 3.92Å; F272-I309 HydrophobicContact CE1-CG1 3.73Å
273	L	85.6	Confident	80.6	Confident	101 Å²	101	52.5 Å²	52.5	53%	0.529	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-66	147.2	169.3	-64.8	173.7	0	0	0	110.2	Y270	Y270-L273 WeakPolarHBondContact O-CB 3.2Å; Y270-L273 WeakPolarHBondContact O-CG 3.2Å; Y270-L273 PolarHBondContact O-N 3.39Å; Y270-L273 VanDerWaalsContact O-N 3.11Å
274	K	87.8	Confident	80	Confident	84 Å²	84	54.1 Å²	54.1	37%	0.365	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-83.3	137.8	174.1	-60.9	-166.2	-59	-179.6	0	108.6	T249 P251 R253 D254	T249-K274 CarbonylContact O-C 3.48Å; T249-K274 WeakPolarHBondContact O-CA 3.37Å; P251-K274 PolarHBondContact O-NZ 2.71Å; R253-K274 HydrophobicContact CG-CD 3.79Å; R253-K274 HydrophobicContact CG-CG 4.03Å; D254-K274 WeakPolarHBondContact OD2-CD 3.17Å; D254-K274 VanDerWaalsContact OD2-CE 3.22Å; D254-K274 WeakPolarHBondContact OD2-CE 3.22Å; D254-K274 IonicContact OD2-NZ 2.76Å; D254-K274 PolarHBondContact OD2-NZ 3.41Å
275	M	82.6	Confident	80	Confident	43 Å²	43	55.5 Å²	55.5	21%	0.212	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-68.4	148	178.1	-68.4	-62.6	-65.4	0	0	111.4	W245 T249 E279 V280	W245-M275 HydrophobicContact CD2-CE 3.77Å; W245-M275 HydrophobicContact CD2-CG 4.44Å; W245-M275 HydrophobicContact CD2-SD 4.34Å; W245-M275 HydrophobicContact CE3-CE 3.8Å; W245-M275 HydrophobicContact CE3-SD 4.01Å; W245-M275 HydrophobicContact CH2-CE 3.61Å; W245-M275 HydrophobicContact CZ2-CE 3.54Å; W245-M275 HydrophobicContact CZ3-CE 3.73Å; W245-M275 HydrophobicContact CZ3-SD 4.15Å; T249-M275 PolarHBondContact O-N 2.8Å; M275-E279 HydrophobicContact CE-CB 4.04Å; M275-E279 HydrophobicContact CE-CG 4.44Å; M275-V280 HydrophobicContact CB-CB 4.47Å; M275-V280 HydrophobicContact CB-CG2 3.35Å; M275-V280 HydrophobicContact CE-CG2 4.23Å; M275-V280 HydrophobicContact CG-CG2 3.9Å
276	E	78.2	Confident	80.2	Confident	138 Å²	138	56 Å²	56	65%	0.645	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-63.7	137	175.4	-78.2	-58.2	142	0	0	111.2	G278 E279	E276-G278 PolarHBondContact O-N 3.39Å; E276-E279 HydrophobicContact CB-CG 4.49Å; E276-E279 PolarHBondContact O-N 3.27Å
277	P	71.9	Confident	80.4	Confident	56 Å²	56	51.4 Å²	51.4	36%	0.364	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.5	-179.7	-26.2	35	0	0	0	114.2	R143	R143-P277 PolarHBondContact NH1-O 2.79Å
278	G	69.6	Low	81	Confident	56 Å²	56	50.5 Å²	50.5	58%	0.577	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-21.9	175.1	0	0	0	0	0	114.9	S147 E276	S147-G278 PolarHBondContact OG-O 3.49Å; E276-G278 PolarHBondContact O-N 3.39Å
279	E	71.9	Confident	81.6	Confident	28 Å²	28	51.4 Å²	51.4	13%	0.131	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-14.2	-175	-67.9	-67.5	123.3	0	0	114.2	S147 R148 R151 M275 E276	S147-E279 PolarHBondContact N-O 3.05Å; S147-E279 VanDerWaalsContact N-O 3.09Å; S147-E279 VanDerWaalsContact OG-CA 3.25Å; S147-E279 WeakPolarHBondContact OG-CA 3.44Å; S147-E279 PolarHBondContact OG-O 3.09Å; R148-E279 IonicContact CZ-OE1 2.71Å; R148-E279 IonicContact CZ-OE2 2.8Å; R148-E279 VanDerWaalsContact NE-CD 3.28Å; R148-E279 IonicContact NE-OE1 3.81Å; R148-E279 PolarHBondContact NE-OE1 2.9Å; R148-E279 IonicContact NE-OE2 2.68Å; R148-E279 PolarHBondContact NE-OE2 3.23Å; R148-E279 VanDerWaalsContact NE-OE2 3.13Å; R148-E279 IonicContact NH2-OE1 3.74Å; R148-E279 PolarHBondContact NH2-OE1 2.89Å; R148-E279 IonicContact NH2-OE2 3.11Å; R151-E279 IonicContact CZ-OE2 3.21Å; R151-E279 VanDerWaalsContact CZ-OE2 3.25Å; R151-E279 IonicContact NH1-OE2 3.06Å; R151-E279 PolarHBondContact NH1-OE2 2.91Å; R151-E279 IonicContact NH2-OE2 2.68Å; R151-E279 PolarHBondContact NH2-OE2 3.48Å; M275-E279 HydrophobicContact CE-CB 4.04Å; M275-E279 HydrophobicContact CE-CG 4.44Å; E276-E279 HydrophobicContact CB-CG 4.49Å; E276-E279 PolarHBondContact O-N 3.27Å
280	V	77.6	Confident	82	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	152.3	-163.8	-164.7	0	0	0	0	112.4	R143 A144 A145 S147 W245 M275	R143-V280 VanDerWaalsContact C-CG1 3.46Å; R143-V280 HydrophobicContact CB-CB 4.21Å; R143-V280 HydrophobicContact CB-CG1 4.14Å; R143-V280 WeakPolarHBondContact CD-O 3.02Å; R143-V280 VanDerWaalsContact O-CG1 3.28Å; R143-V280 WeakPolarHBondContact O-CG1 3.18Å; A144-V280 VanDerWaalsContact O-CG1 3.3Å; A144-V280 WeakPolarHBondContact O-CG1 3.43Å; A145-V280 CarbonylContact O-C 3.59Å; A145-V280 VanDerWaalsContact O-C 3.28Å; A145-V280 WeakPolarHBondContact O-CA 3.42Å; A145-V280 WeakPolarHBondContact O-CG1 3.49Å; S147-V280 PolarHBondContact OG-N 2.95Å; W245-V280 HydrophobicContact CG-CG2 4.23Å; M275-V280 HydrophobicContact CB-CB 4.47Å; M275-V280 HydrophobicContact CB-CG2 3.35Å; M275-V280 HydrophobicContact CE-CG2 4.23Å; M275-V280 HydrophobicContact CG-CG2 3.9Å
281	N	78.9	Confident	82.6	Confident	62 Å²	62	46.1 Å²	46.1	33%	0.332	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	121	-176.5	-176.3	-2.6	0	0	0	112.2	A144 A145 L283	A144-N281 VanDerWaalsContact N-C 3.35Å; A145-N281 WeakPolarHBondContact CA-O 3.43Å; A145-N281 VanDerWaalsContact CB-O 3.31Å; A145-N281 WeakPolarHBondContact CB-O 3.5Å; A145-N281 PolarHBondContact N-O 2.91Å; A145-N281 PolarHBondContact O-N 2.68Å; N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 WeakPolarHBondContact ND2-CD2 3.43Å; N281-L283 PolarHBondContact O-N 2.9Å; N281-L283 PolarHBondContact OD1-N 2.83Å
282	S	72.3	Confident	83.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.26	C	S	.	.			trans	-83.2	-7	-178.2	-67	0	0	0	0	112	P142 R143 A144 R250 G284 E285	P142-S282 WeakPolarHBondContact O-CB 3.35Å; P142-S282 PolarHBondContact O-N 3.19Å; P142-S282 PolarHBondContact O-OG 3.36Å; R143-S282 VanDerWaalsContact CA-N 3.29Å; R143-S282 WeakPolarHBondContact CA-OG 3.09Å; R143-S282 PolarHBondContact N-OG 3.15Å; R143-S282 VanDerWaalsContact N-OG 3.09Å; A144-S282 WeakPolarHBondContact CB-OG 3.1Å; A144-S282 VanDerWaalsContact N-N 3.16Å; A144-S282 PolarHBondContact N-OG 2.88Å; R250-S282 VanDerWaalsContact CZ-OG 3.32Å; R250-S282 PolarHBondContact NH1-OG 3.29Å; R250-S282 PolarHBondContact NH2-OG 2.71Å; S282-G284 PolarHBondContact O-N 2.84Å; S282-G284 VanDerWaalsContact O-N 3.11Å; S282-E285 WeakPolarHBondContact O-CB 3.35Å; S282-E285 PolarHBondContact O-N 2.83Å
283	L	80.4	Confident	83.4	Confident	47 Å²	47	44.9 Å²	44.9	25%	0.246	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	27.6	-175.1	-49.9	166.5	0	0	0	111.8	N281 Q335 K338 L339	N281-L283 VanDerWaalsContact C-N 3.26Å; N281-L283 WeakPolarHBondContact ND2-CD2 3.43Å; N281-L283 PolarHBondContact O-N 2.9Å; N281-L283 PolarHBondContact OD1-N 2.83Å; L283-Q335 HydrophobicContact CD1-CG 4.35Å; L283-Q335 WeakPolarHBondContact CD1-O 3.47Å; L283-K338 HydrophobicContact CB-CB 3.83Å; L283-K338 HydrophobicContact CB-CD 3.85Å; L283-K338 HydrophobicContact CD1-CB 3.7Å; L283-K338 HydrophobicContact CG-CB 4.36Å; L283-K338 VanDerWaalsContact O-CD 3.26Å; L283-K338 WeakPolarHBondContact O-CD 3.41Å; L283-K338 PolarHBondContact O-NZ 2.87Å; L283-L339 VanDerWaalsContact CD1-CA 3.47Å; L283-L339 HydrophobicContact CD1-CB 3.67Å; L283-L339 HydrophobicContact CD1-CD1 4.21Å; L283-L339 VanDerWaalsContact CD1-N 3.29Å
284	G	77.8	Confident	83.8	Confident	60 Å²	60	40 Å²	40	62%	0.619	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.1	16.2	-177.4	0	0	0	0	0	115.4	S282	S282-G284 PolarHBondContact O-N 2.84Å; S282-G284 VanDerWaalsContact O-N 3.11Å
285	E	86.2	Confident	83.8	Confident	29 Å²	29	36.3 Å²	36.3	14%	0.136	22%	0.219	C	C	.	.			trans	-75.7	147.5	168.1	-65.1	-53.7	141.2	0	0	112.3	S282 A334 Q335 K338	S282-E285 WeakPolarHBondContact O-CB 3.35Å; S282-E285 PolarHBondContact O-N 2.83Å; E285-A334 HydrophobicContact CG-CB 4.43Å; E285-Q335 HydrophobicContact CG-CB 4.03Å; E285-Q335 HydrophobicContact CG-CG 4.47Å; E285-K338 WeakPolarHBondContact OE1-CD 3.3Å; E285-K338 WeakPolarHBondContact OE1-CE 3.38Å; E285-K338 IonicContact OE1-NZ 2.74Å; E285-K338 PolarHBondContact OE1-NZ 2.7Å
286	P	88.8	Confident	84.1	Confident	91 Å²	91	34.8 Å²	34.8	59%	0.591	21%	0.213	S	C	*	.			trans	-67.3	-179.4	172.8	31.9	-36.3	0	0	0	111.7	R250	R250-P286 PolarHBondContact NH1-O 2.81Å
287	Y	89.3	Confident	84.6	Confident	16 Å²	16	33.5 Å²	33.5	6%	0.063	20%	0.202	C	C	.	.			trans	-73.7	127.5	170.2	-164.3	-86	0	0	0	110.1	E247 H248 R253 H256 V257 F289 H294	E247-Y287 HydrophobicContact CG-CE1 4.17Å; E247-Y287 HydrophobicContact CG-CE2 4.15Å; E247-Y287 WeakPolarHBondContact O-CE2 3.03Å; E247-Y287 PolarHBondContact O-OH 3.25Å; E247-Y287 WeakPolarHBondContact OE1-CA 3.46Å; H248-Y287 WeakPolarHBondContact CA-OH 3.39Å; R253-Y287 HydrophobicContact CB-CE2 3.86Å; H256-Y287 HydrophobicContact CB-CD1 3.73Å; H256-Y287 HydrophobicContact CB-CD2 3.78Å; H256-Y287 HydrophobicContact CB-CE1 4.04Å; H256-Y287 HydrophobicContact CB-CE2 4.07Å; H256-Y287 HydrophobicContact CB-CG 3.61Å; H256-Y287 VanDerWaalsContact CD2-CB 3.49Å; H256-Y287 WeakPolarHBondContact CD2-CB 3.32Å; H256-Y287 AromaticContact CD2-CD2 3.47Å; H256-Y287 VanDerWaalsContact CD2-CD2 3.47Å; H256-Y287 WeakPolarHBondContact CD2-CD2 3.01Å; H256-Y287 AromaticContact CD2-CG 3.59Å; H256-Y287 AromaticContact CG-CD2 3.74Å; H256-Y287 AromaticContact CG-CG 3.49Å; H256-Y287 VanDerWaalsContact CG-CG 3.49Å; V257-Y287 HydrophobicContact CG1-CE1 3.94Å; Y287-F289 AromaticContact CD1-CD1 3.89Å; Y287-F289 HydrophobicContact CD1-CD1 3.89Å; Y287-F289 HydrophobicContact CD1-CD2 4.15Å; Y287-F289 AromaticContact CD1-CE1 3.74Å; Y287-F289 HydrophobicContact CD1-CE1 3.74Å; Y287-F289 AromaticContact CD1-CE2 4Å; Y287-F289 HydrophobicContact CD1-CE2 4Å; Y287-F289 HydrophobicContact CD1-CG 4.11Å; Y287-F289 AromaticContact CD1-CZ 3.8Å; Y287-F289 HydrophobicContact CD1-CZ 3.8Å; Y287-F289 AromaticContact CE1-CD1 3.74Å; Y287-F289 HydrophobicContact CE1-CD1 3.74Å; Y287-F289 AromaticContact CE1-CE1 3.71Å; Y287-F289 HydrophobicContact CE1-CE1 3.71Å; Y287-F289 HydrophobicContact CE1-CG 4.3Å; Y287-F289 HydrophobicContact CE1-CZ 4.25Å; Y287-H294 AromaticContact CE1-CD2 3.86Å; Y287-H294 AromaticContact CE1-NE2 3.58Å; Y287-H294 AromaticContact CZ-CD2 3.99Å; Y287-H294 AromaticContact CZ-NE2 3.62Å; Y287-H294 PolarHBondContact OH-CD2 3.07Å; Y287-H294 PolarHBondContact OH-NE2 2.8Å
288	D	91.8	Very high	85.3	Confident	28 Å²	28	32.8 Å²	32.8	15%	0.15	20%	0.196	C	C	.	.			trans	-110.7	95.7	-175.5	-165.6	-16.4	0	0	0	112.5	E247 D290 S291 S329 G331	E247-D288 PolarHBondContact OE1-N 3.43Å; D288-D290 PolarHBondContact O-N 2.79Å; D288-D290 WeakPolarHBondContact OD1-CA 3.46Å; D288-D290 PolarHBondContact OD1-N 3.23Å; D288-S291 WeakPolarHBondContact O-CB 3.14Å; D288-S291 PolarHBondContact O-N 2.86Å; D288-S291 VanDerWaalsContact O-N 3.13Å; D288-S291 PolarHBondContact OD1-N 2.95Å; D288-S329 VanDerWaalsContact OD2-CB 3.24Å; D288-S329 WeakPolarHBondContact OD2-CB 3.25Å; D288-S329 PolarHBondContact OD2-OG 2.84Å; D288-G331 WeakPolarHBondContact OD2-CA 2.98Å; D288-G331 PolarHBondContact OD2-N 3.34Å
289	F	91.9	Very high	85.9	Confident	42 Å²	42	30.5 Å²	30.5	18%	0.184	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.5	176.5	-60.5	-81.5	0	0	0	113.6	H256 V257 Y287 S291 P311 P320 I322	H256-F289 HydrophobicContact CB-CE1 4.3Å; H256-F289 HydrophobicContact CB-CZ 3.98Å; V257-F289 HydrophobicContact CG1-CD1 4.45Å; V257-F289 HydrophobicContact CG1-CE1 3.94Å; Y287-F289 AromaticContact CD1-CD1 3.89Å; Y287-F289 HydrophobicContact CD1-CD1 3.89Å; Y287-F289 HydrophobicContact CD1-CD2 4.15Å; Y287-F289 AromaticContact CD1-CE1 3.74Å; Y287-F289 HydrophobicContact CD1-CE1 3.74Å; Y287-F289 AromaticContact CD1-CE2 4Å; Y287-F289 HydrophobicContact CD1-CE2 4Å; Y287-F289 HydrophobicContact CD1-CG 4.11Å; Y287-F289 AromaticContact CD1-CZ 3.8Å; Y287-F289 HydrophobicContact CD1-CZ 3.8Å; Y287-F289 AromaticContact CE1-CD1 3.74Å; Y287-F289 HydrophobicContact CE1-CD1 3.74Å; Y287-F289 AromaticContact CE1-CE1 3.71Å; Y287-F289 HydrophobicContact CE1-CE1 3.71Å; Y287-F289 HydrophobicContact CE1-CG 4.3Å; Y287-F289 HydrophobicContact CE1-CZ 4.25Å; F289-S291 VanDerWaalsContact C-N 3.34Å; F289-P311 HydrophobicContact CD1-CB 4.07Å; F289-P311 HydrophobicContact CE1-CB 3.87Å; F289-P320 HydrophobicContact CB-CB 3.94Å; F289-P320 HydrophobicContact CB-CG 4.08Å; F289-P320 HydrophobicContact CD1-CB 4.4Å; F289-P320 HydrophobicContact CD1-CG 3.6Å; F289-P320 HydrophobicContact CD2-CB 4.25Å; F289-P320 HydrophobicContact CD2-CG 3.83Å; F289-P320 HydrophobicContact CE1-CG 3.88Å; F289-P320 HydrophobicContact CE2-CG 4.1Å; F289-P320 HydrophobicContact CG-CB 3.96Å; F289-P320 HydrophobicContact CG-CG 3.57Å; F289-P320 HydrophobicContact CZ-CG 4.11Å; F289-I322 HydrophobicContact CB-CG2 3.92Å; F289-I322 HydrophobicContact CD1-CG2 3.78Å; F289-I322 HydrophobicContact CG-CG2 4.35Å; F289-I322 WeakPolarHBondContact O-CA 3.13Å
290	D	91.8	Very high	86.5	Confident	56 Å²	56	30.1 Å²	30.1	30%	0.299	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-1.4	178.1	-165	50.7	0	0	0	111.9	D288 I292 Q324 R327 S329	D288-D290 PolarHBondContact O-N 2.79Å; D288-D290 WeakPolarHBondContact OD1-CA 3.46Å; D288-D290 PolarHBondContact OD1-N 3.23Å; D290-I292 PolarHBondContact O-N 2.95Å; D290-Q324 VanDerWaalsContact O-CG 3.32Å; D290-Q324 WeakPolarHBondContact O-CG 3.25Å; D290-Q324 PolarHBondContact O-NE2 3.03Å; D290-R327 VanDerWaalsContact CG-NH2 3.25Å; D290-R327 IonicContact OD1-NH2 3.76Å; D290-R327 PolarHBondContact OD1-NH2 2.7Å; D290-R327 IonicContact OD2-CZ 3.49Å; D290-R327 IonicContact OD2-NE 2.88Å; D290-R327 IonicContact OD2-NH2 3.21Å; D290-R327 PolarHBondContact OD2-NH2 3.46Å; D290-S329 WeakPolarHBondContact O-CB 3.42Å
291	S	93.2	Very high	86.9	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.014	17%	0.172	C	C	.	.			trans	-55	134.5	-180	175.1	0	0	0	0	111.8	D288 F289 M293 H294 D332	D288-S291 WeakPolarHBondContact O-CB 3.14Å; D288-S291 PolarHBondContact O-N 2.86Å; D288-S291 VanDerWaalsContact O-N 3.13Å; D288-S291 PolarHBondContact OD1-N 2.95Å; F289-S291 VanDerWaalsContact C-N 3.34Å; S291-M293 PolarHBondContact O-N 2.68Å; S291-M293 PolarHBondContact OG-N 3.3Å; S291-H294 WeakPolarHBondContact O-CB 3.37Å; S291-H294 PolarHBondContact O-N 2.98Å; S291-H294 VanDerWaalsContact O-N 3.07Å; S291-D332 WeakPolarHBondContact CB-OD1 3.5Å; S291-D332 PolarHBondContact OG-OD1 2.04Å
292	I	91.9	Very high	87.2	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.4	173.2	-161.3	145	0	0	0	111.8	V235 H236 D290 H294 R325 R327 L328 D332	V235-I292 HydrophobicContact CB-CD1 3.89Å; V235-I292 HydrophobicContact CG1-CD1 3.64Å; H236-I292 HydrophobicContact CB-CG1 4.24Å; H236-I292 PolarHBondContact ND1-O 2.72Å; D290-I292 PolarHBondContact O-N 2.95Å; I292-H294 VanDerWaalsContact C-N 3.3Å; I292-H294 PolarHBondContact O-N 2.87Å; I292-R325 PolarHBondContact O-NH1 2.85Å; I292-R325 VanDerWaalsContact O-NH1 3.15Å; I292-R327 VanDerWaalsContact CD1-O 3.25Å; I292-R327 WeakPolarHBondContact CD1-O 3.48Å; I292-L328 HydrophobicContact CG2-CD2 3.91Å; I292-D332 PolarHBondContact N-OD2 2.94Å
293	M	92.1	Very high	87.4	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.01	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	0.2	177.6	-53.2	-50.3	-59.4	0	0	113.5	H236 H240 F244 H246 E247 S291	H236-M293 WeakPolarHBondContact O-CE 3.38Å; H240-M293 WeakPolarHBondContact CE1-CE 3.05Å; H240-M293 WeakPolarHBondContact ND1-CE 3.46Å; F244-M293 HydrophobicContact CB-CE 4.44Å; F244-M293 HydrophobicContact CB-CG 3.94Å; F244-M293 HydrophobicContact CD2-CG 3.84Å; F244-M293 HydrophobicContact CG-CG 4.44Å; H246-M293 WeakPolarHBondContact CA-O 3.46Å; H246-M293 WeakPolarHBondContact CB-O 3.2Å; H246-M293 PolarHBondContact CD2-O 2.53Å; E247-M293 PolarHBondContact N-O 3.34Å; E247-M293 VanDerWaalsContact N-O 3.12Å; S291-M293 PolarHBondContact O-N 2.68Å; S291-M293 PolarHBondContact OG-N 3.3Å
294	H	92.8	Very high	87	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-81.4	143.1	175.3	-154.9	-66.5	0	0	0	111	E247 Y287 S291 I292 R325	E247-H294 HydrophobicContact CB-CB 4.11Å; Y287-H294 AromaticContact CE1-CD2 3.86Å; Y287-H294 AromaticContact CE1-NE2 3.58Å; Y287-H294 AromaticContact CZ-CD2 3.99Å; Y287-H294 AromaticContact CZ-NE2 3.62Å; Y287-H294 PolarHBondContact OH-CD2 3.07Å; Y287-H294 PolarHBondContact OH-NE2 2.8Å; S291-H294 WeakPolarHBondContact O-CB 3.37Å; S291-H294 PolarHBondContact O-N 2.98Å; S291-H294 VanDerWaalsContact O-N 3.07Å; I292-H294 VanDerWaalsContact C-N 3.3Å; I292-H294 PolarHBondContact O-N 2.87Å; H294-R325 PolarHBondContact O-NH1 2.85Å; H294-R325 PolarHBondContact O-NH2 2.8Å; H294-R325 VanDerWaalsContact O-NH2 3.11Å
295	Y	89.8	Confident	87.2	Confident	6 Å²	6	44.1 Å²	44.1	2%	0.024	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-72.8	156.2	167.8	-82.2	3.9	0	0	0	111.9	D58 H246 H248 N271 T299 F300 I309 G323	D58-Y295 PolarHBondContact OD1-OH 2.99Å; H246-Y295 AromaticContact CD2-CE1 3.82Å; H246-Y295 AromaticContact CE1-CE1 3.51Å; H246-Y295 AromaticContact CE1-CZ 3.76Å; H246-Y295 PolarHBondContact CE1-OH 3.35Å; H246-Y295 AromaticContact CG-CE1 3.87Å; H246-Y295 AromaticContact ND1-CE1 3.71Å; H246-Y295 AromaticContact ND1-CZ 3.81Å; H246-Y295 AromaticContact NE2-CE1 3.59Å; H248-Y295 AromaticContact CE1-CD1 3.71Å; H248-Y295 AromaticContact CE1-CD2 3.09Å; H248-Y295 WeakPolarHBondContact CE1-CD2 3.3Å; H248-Y295 AromaticContact CE1-CE1 3.98Å; H248-Y295 AromaticContact CE1-CE2 3.34Å; H248-Y295 WeakPolarHBondContact CE1-CE2 3.23Å; H248-Y295 AromaticContact CE1-CG 3.3Å; H248-Y295 AromaticContact CE1-CZ 3.83Å; H248-Y295 AromaticContact ND1-CD2 3.75Å; H248-Y295 AromaticContact ND1-CG 3.56Å; H248-Y295 AromaticContact NE2-CD2 3.38Å; H248-Y295 WeakPolarHBondContact NE2-CD2 3.02Å; H248-Y295 AromaticContact NE2-CE2 3.56Å; N271-Y295 HydrophobicContact CB-CE2 4.27Å; Y295-T299 HydrophobicContact CD2-CG2 3.87Å; Y295-T299 HydrophobicContact CE2-CG2 4.18Å; Y295-T299 HydrophobicContact CG-CG2 4.06Å; Y295-F300 HydrophobicContact CD2-CE2 4.5Å; Y295-F300 HydrophobicContact CE2-CD2 4.03Å; Y295-F300 AromaticContact CE2-CE2 3.63Å; Y295-F300 HydrophobicContact CE2-CE2 3.63Å; Y295-F300 AromaticContact CZ-CE2 3.93Å; Y295-I309 HydrophobicContact CD2-CD1 4.49Å; Y295-G323 WeakPolarHBondContact O-CA 3.32Å
296	A	87.4	Confident	87.2	Confident	11 Å²	11	46.1 Å²	46.1	9%	0.091	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-75.8	162.7	173.4	0	0	0	0	0	110.9	A60 N298 T299	A60-A296 HydrophobicContact CB-CB 3.43Å; A60-A296 VanDerWaalsContact CB-CB 3.43Å; A296-N298 PolarHBondContact O-N 3.17Å; A296-N298 VanDerWaalsContact O-N 3.08Å; A296-T299 WeakPolarHBondContact CB-OG1 3.07Å; A296-T299 PolarHBondContact N-OG1 2.82Å; A296-T299 PolarHBondContact O-N 2.91Å; A296-T299 PolarHBondContact O-OG1 3.36Å
297	R	89.6	Confident	87.2	Confident	110 Å²	110	44.2 Å²	44.2	42%	0.415	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-30.3	-177.8	68.4	-175.7	110.3	159.2	10.3	114.2	D63 D307 T308 I309 I322	D63-R297 IonicContact OD1-NH2 3.83Å; D63-R297 PolarHBondContact OD1-NH2 3.25Å; D63-R297 IonicContact OD2-CZ 2.6Å; D63-R297 IonicContact OD2-NH2 3.42Å; D63-R297 PolarHBondContact OD2-NH2 2.84Å; R297-D307 WeakPolarHBondContact CB-OD1 3.5Å; R297-D307 VanDerWaalsContact CD-OD1 3.24Å; R297-D307 WeakPolarHBondContact CD-OD1 3.4Å; R297-D307 WeakPolarHBondContact CG-OD1 3.48Å; R297-D307 CarbonylContact O-C 3.58Å; R297-D307 VanDerWaalsContact O-CA 3.22Å; R297-D307 WeakPolarHBondContact O-CA 3.33Å; R297-T308 PolarHBondContact O-N 3.15Å; R297-T308 PolarHBondContact O-OG1 3.31Å; R297-I309 PolarHBondContact O-N 3.1Å; R297-I322 HydrophobicContact CB-CD1 4.2Å; R297-I322 HydrophobicContact CB-CG1 4.36Å
298	N	85.2	Confident	87.3	Confident	42 Å²	42	43.5 Å²	43.5	23%	0.225	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	11.9	-173.9	63.8	-14	0	0	0	114.1	A296 F300 S301	A296-N298 PolarHBondContact O-N 3.17Å; A296-N298 VanDerWaalsContact O-N 3.08Å; N298-F300 PolarHBondContact O-N 3.29Å; N298-S301 WeakPolarHBondContact O-CB 3.34Å; N298-S301 PolarHBondContact O-N 2.81Å
299	T	83.3	Confident	87.3	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.043	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	136.2	177.6	-54.8	0	0	0	0	110.2	F272 Y295 A296 S301 T308	F272-T299 WeakPolarHBondContact CZ-O 3.25Å; Y295-T299 HydrophobicContact CD2-CG2 3.87Å; Y295-T299 HydrophobicContact CE2-CG2 4.18Å; Y295-T299 HydrophobicContact CG-CG2 4.06Å; A296-T299 WeakPolarHBondContact CB-OG1 3.07Å; A296-T299 PolarHBondContact N-OG1 2.82Å; A296-T299 PolarHBondContact O-N 2.91Å; A296-T299 PolarHBondContact O-OG1 3.36Å; T299-S301 PolarHBondContact O-N 2.96Å; T299-T308 WeakPolarHBondContact O-CG2 3.45Å; T299-T308 PolarHBondContact O-OG1 2.88Å
300	F	83.9	Confident	87.3	Confident	20 Å²	20	42 Å²	42	9%	0.088	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	26.3	-171.5	-57.7	-71.5	0	0	0	116	I264 Q265 Q268 N271 F272 Y295 N298	I264-F300 CarbonylContact C-O 3.55Å; I264-F300 WeakPolarHBondContact CA-O 3.02Å; I264-F300 HydrophobicContact CG2-CB 4.47Å; Q265-F300 WeakPolarHBondContact CG-O 3.3Å; Q265-F300 PolarHBondContact N-O 2.86Å; Q268-F300 HydrophobicContact CB-CB 3.97Å; Q268-F300 HydrophobicContact CB-CD1 3.86Å; Q268-F300 HydrophobicContact CB-CG 4.01Å; Q268-F300 HydrophobicContact CG-CB 4.46Å; Q268-F300 HydrophobicContact CG-CD1 3.7Å; Q268-F300 HydrophobicContact CG-CE1 4.32Å; Q268-F300 HydrophobicContact CG-CG 4.34Å; N271-F300 HydrophobicContact CB-CD2 4.19Å; N271-F300 HydrophobicContact CB-CE2 3.93Å; F272-F300 HydrophobicContact CE2-CB 3.89Å; F272-F300 AromaticContact CE2-CD2 3.86Å; F272-F300 HydrophobicContact CE2-CD2 3.86Å; F272-F300 HydrophobicContact CE2-CG 4.25Å; F272-F300 HydrophobicContact CZ-CB 4.03Å; F272-F300 AromaticContact CZ-CD2 3.98Å; F272-F300 HydrophobicContact CZ-CD2 3.98Å; F272-F300 HydrophobicContact CZ-CG 4.49Å; Y295-F300 HydrophobicContact CD2-CE2 4.5Å; Y295-F300 HydrophobicContact CE2-CD2 4.03Å; Y295-F300 AromaticContact CE2-CE2 3.63Å; Y295-F300 HydrophobicContact CE2-CE2 3.63Å; Y295-F300 AromaticContact CZ-CE2 3.93Å; N298-F300 PolarHBondContact O-N 3.29Å
301	S	86.3	Confident	87.3	Confident	13 Å²	13	39.7 Å²	39.7	9%	0.091	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-76.2	142.6	178.3	-171	0	0	0	0	113.6	N263 Q265 N298 T299 G303 L306	N263-S301 CarbonylContact O-C 3.53Å; N263-S301 WeakPolarHBondContact O-CA 3.31Å; Q265-S301 WeakPolarHBondContact CG-O 3.41Å; Q265-S301 PolarHBondContact NE2-O 3.46Å; N298-S301 WeakPolarHBondContact O-CB 3.34Å; N298-S301 PolarHBondContact O-N 2.81Å; T299-S301 PolarHBondContact O-N 2.96Å; S301-G303 PolarHBondContact O-N 3.13Å; S301-G303 PolarHBondContact OG-N 3.03Å; S301-G303 PolarHBondContact OG-O 3.38Å; S301-L306 VanDerWaalsContact CB-O 3.22Å; S301-L306 WeakPolarHBondContact CB-O 3.34Å; S301-L306 WeakPolarHBondContact OG-CB 3.4Å; S301-L306 PolarHBondContact OG-O 3.32Å
302	R	86.4	Confident	87.1	Confident	133 Å²	133	41.8 Å²	41.8	50%	0.502	21%	0.205	S	C	.	.	S	Bend	trans	-74	-7.4	173.8	72	-177.7	56.4	178.2	-0.8	113.9	E262 N263 I264 Q265 L306	E262-R302 PolarHBondContact O-NE 3.46Å; E262-R302 VanDerWaalsContact O-NE 3.12Å; E262-R302 PolarHBondContact O-NH1 3.36Å; E262-R302 PolarHBondContact O-NH2 2.8Å; N263-R302 WeakPolarHBondContact O-CG 3.01Å; N263-R302 PolarHBondContact O-N 3.41Å; I264-R302 VanDerWaalsContact O-CZ 3.31Å; I264-R302 PolarHBondContact O-NE 3.4Å; I264-R302 PolarHBondContact O-NH2 2.93Å; Q265-R302 HydrophobicContact CG-CB 4.39Å; R302-L306 HydrophobicContact CG-CD1 4Å
303	G	75.1	Confident	86.8	Confident	23 Å²	23	49.9 Å²	49.9	24%	0.237	24%	0.236	C	C	.	.	S	Bend	trans	-152.4	141.3	179.2	0	0	0	0	0	112.1	S301 F305 L306	S301-G303 PolarHBondContact O-N 3.13Å; S301-G303 PolarHBondContact OG-N 3.03Å; S301-G303 PolarHBondContact OG-O 3.38Å; G303-F305 PolarHBondContact O-N 3.38Å; G303-L306 PolarHBondContact O-N 2.9Å
304	M	73.1	Confident	86.2	Confident	122 Å²	122	53 Å²	53	60%	0.601	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.2	-168.4	-161	168.4	78.7	0	0	115.1
305	F	80.8	Confident	85.4	Confident	174 Å²	174	61.3 Å²	61.3	76%	0.763	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	15.1	-179.4	-52.9	-68.6	0	0	0	113.7	G303	G303-F305 PolarHBondContact O-N 3.38Å
306	L	86.3	Confident	84.9	Confident	71 Å²	71	67.1 Å²	67.1	37%	0.372	33%	0.328	S	S	.	.			trans	-103.3	119.9	179.2	-65.9	177.5	0	0	0	109.7	N263 S301 R302 G303	N263-L306 HydrophobicContact CB-CB 4.23Å; S301-L306 VanDerWaalsContact CB-O 3.22Å; S301-L306 WeakPolarHBondContact CB-O 3.34Å; S301-L306 WeakPolarHBondContact OG-CB 3.4Å; S301-L306 PolarHBondContact OG-O 3.32Å; R302-L306 HydrophobicContact CG-CD1 4Å; G303-L306 PolarHBondContact O-N 2.9Å
307	D	89	Confident	84.4	Confident	51 Å²	51	68 Å²	68	27%	0.273	34%	0.338	S	S	.	.			trans	-73	133.2	173.5	-67.3	-24.5	0	0	0	110.2	I260 N263 R297	I260-D307 HydrophobicContact CD1-CB 4.5Å; N263-D307 WeakPolarHBondContact CB-O 3.25Å; N263-D307 PolarHBondContact ND2-O 3.21Å; R297-D307 WeakPolarHBondContact CB-OD1 3.5Å; R297-D307 VanDerWaalsContact CD-OD1 3.24Å; R297-D307 WeakPolarHBondContact CD-OD1 3.4Å; R297-D307 WeakPolarHBondContact CG-OD1 3.48Å; R297-D307 CarbonylContact O-C 3.58Å; R297-D307 VanDerWaalsContact O-CA 3.22Å; R297-D307 WeakPolarHBondContact O-CA 3.33Å
308	T	91	Very high	84.2	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.345	C	S	.	.	S	Bend	trans	-94.5	-28	166.8	48.7	0	0	0	0	111.7	I259 I260 N263 I264 R297 T299	I259-T308 WeakPolarHBondContact CA-O 2.98Å; I260-T308 PolarHBondContact N-O 3.2Å; N263-T308 HydrophobicContact CB-CG2 4.17Å; I264-T308 HydrophobicContact CG1-CG2 3.94Å; R297-T308 PolarHBondContact O-N 3.15Å; R297-T308 PolarHBondContact O-OG1 3.31Å; T299-T308 WeakPolarHBondContact O-CG2 3.45Å; T299-T308 PolarHBondContact O-OG1 2.88Å
309	I	92.3	Very high	84.1	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.7	176	-47.4	-176.2	0	0	0	109.4	H248 V257 I259 F272 Y295 R297 I322	H248-I309 HydrophobicContact CB-CD1 3.95Å; V257-I309 HydrophobicContact CB-CG2 3.81Å; V257-I309 HydrophobicContact CG1-CG2 4.13Å; V257-I309 HydrophobicContact CG2-CG2 4.05Å; I259-I309 HydrophobicContact CD1-CB 4.37Å; I259-I309 HydrophobicContact CD1-CG1 3.98Å; I259-I309 HydrophobicContact CD1-CG2 4.03Å; F272-I309 HydrophobicContact CD1-CD1 4.41Å; F272-I309 HydrophobicContact CD1-CG1 4.27Å; F272-I309 HydrophobicContact CE1-CD1 3.92Å; F272-I309 HydrophobicContact CE1-CG1 3.73Å; Y295-I309 HydrophobicContact CD2-CD1 4.49Å; R297-I309 PolarHBondContact O-N 3.1Å; I309-I322 HydrophobicContact CB-CD1 4.06Å; I309-I322 HydrophobicContact CG2-CD1 3.88Å
310	L	92.3	Very high	84.3	Confident	39 Å²	39	73 Å²	73	20%	0.204	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	105.8	-179.1	-175	65.7	0	0	0	110.2	T258 I260	T258-L310 PolarHBondContact N-O 3.14Å; T258-L310 PolarHBondContact O-N 3.34Å; I260-L310 HydrophobicContact CD1-CB 3.97Å; I260-L310 HydrophobicContact CD1-CD2 4.17Å; I260-L310 HydrophobicContact CG1-CB 4.46Å
311	P	92.1	Very high	84.5	Confident	8 Å²	8	76.2 Å²	76.2	5%	0.052	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	146.8	-179.4	26.8	-32.6	0	0	0	112.2	V257 F289 R319 P320 I322	V257-P311 HydrophobicContact CG1-CB 4.29Å; F289-P311 HydrophobicContact CD1-CB 4.07Å; F289-P311 HydrophobicContact CE1-CB 3.87Å; P311-R319 HydrophobicContact CG-CB 4.37Å; P311-R319 PolarHBondContact O-NH1 2.9Å; P311-P320 HydrophobicContact CB-CG 4.01Å; P311-P320 WeakPolarHBondContact CG-O 3.41Å; P311-I322 HydrophobicContact CB-CG2 4.32Å; P311-I322 HydrophobicContact CG-CD1 4.28Å; P311-I322 HydrophobicContact CG-CG1 4.43Å; P311-I322 HydrophobicContact CG-CG2 4.36Å
312	S	89.1	Confident	84.7	Confident	46 Å²	46	76.6 Å²	76.6	32%	0.322	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-62.6	164.1	174.2	64.1	0	0	0	0	111.4	H256 P320	H256-S312 WeakPolarHBondContact O-CB 3.47Å; H256-S312 PolarHBondContact O-N 3.34Å; H256-S312 PolarHBondContact O-OG 3.31Å; S312-P320 WeakPolarHBondContact O-CD 3.48Å
313	R	85.3	Confident	84.7	Confident	170 Å²	170	70.9 Å²	70.9	64%	0.642	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-82.9	141.5	176.5	-67.9	177.2	-177.3	-115.3	11.6	109.5	G317 I318 R319	R313-G317 WeakPolarHBondContact CD-O 3.45Å; R313-G317 PolarHBondContact NH1-O 2.61Å; R313-I318 CarbonylContact C-O 3.56Å; R313-I318 WeakPolarHBondContact CA-O 3.07Å; R313-R319 HydrophobicContact CG-CG 4.17Å
314	D	78.9	Confident	85.4	Confident	67 Å²	67	71.2 Å²	71.2	36%	0.358	37%	0.374	S	S	.	.			trans	-70.5	177.6	169.9	81.2	-17.8	0	0	0	111.8	N316 G317 I318	D314-N316 PolarHBondContact O-N 2.97Å; D314-N316 VanDerWaalsContact O-N 3.07Å; D314-N316 VanDerWaalsContact OD1-C 3.3Å; D314-N316 WeakPolarHBondContact OD1-CA 3.49Å; D314-N316 WeakPolarHBondContact OD1-CB 3.35Å; D314-N316 PolarHBondContact OD1-N 3.4Å; D314-N316 PolarHBondContact OD2-ND2 3.28Å; D314-G317 PolarHBondContact O-N 3.16Å; D314-G317 PolarHBondContact OD1-N 2.69Å; D314-I318 PolarHBondContact N-O 2.96Å; D314-I318 WeakPolarHBondContact OD1-CA 3.21Å; D314-I318 PolarHBondContact OD1-N 2.79Å
315	D	76.7	Confident	86	Confident	174 Å²	174	67.8 Å²	67.8	93%	0.93	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.3	177.9	-62.7	-42.4	0	0	0	113.6
316	N	78.9	Confident	86.3	Confident	129 Å²	129	63.2 Å²	63.2	69%	0.69	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	0.4	175.9	-52.3	-68.8	0	0	0	112.9	D314 I318	D314-N316 PolarHBondContact O-N 2.97Å; D314-N316 VanDerWaalsContact O-N 3.07Å; D314-N316 VanDerWaalsContact OD1-C 3.3Å; D314-N316 WeakPolarHBondContact OD1-CA 3.49Å; D314-N316 WeakPolarHBondContact OD1-CB 3.35Å; D314-N316 PolarHBondContact OD1-N 3.4Å; D314-N316 PolarHBondContact OD2-ND2 3.28Å; N316-I318 VanDerWaalsContact C-N 3.33Å; N316-I318 HydrophobicContact CB-CD1 4.32Å; N316-I318 HydrophobicContact CB-CG1 4.36Å
317	G	78.3	Confident	86.4	Confident	28 Å²	28	65.4 Å²	65.4	29%	0.289	34%	0.344	S	S	.	.	S	Bend	trans	80.2	7	-177.9	0	0	0	0	0	115	R313 D314	R313-G317 WeakPolarHBondContact CD-O 3.45Å; R313-G317 PolarHBondContact NH1-O 2.61Å; D314-G317 PolarHBondContact O-N 3.16Å; D314-G317 PolarHBondContact OD1-N 2.69Å
318	I	83.4	Confident	86.6	Confident	112 Å²	112	63.5 Å²	63.5	57%	0.574	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-91.8	143.7	-179	-58.8	175.5	0	0	0	109	R313 D314 N316	R313-I318 CarbonylContact C-O 3.56Å; R313-I318 WeakPolarHBondContact CA-O 3.07Å; D314-I318 PolarHBondContact N-O 2.96Å; D314-I318 WeakPolarHBondContact OD1-CA 3.21Å; D314-I318 PolarHBondContact OD1-N 2.79Å; N316-I318 VanDerWaalsContact C-N 3.33Å; N316-I318 HydrophobicContact CB-CD1 4.32Å; N316-I318 HydrophobicContact CB-CG1 4.36Å
319	R	85.1	Confident	86.8	Confident	113 Å²	113	63.6 Å²	63.6	43%	0.426	34%	0.335	S	S	.	.	P	Polyproline II helix	trans	-86.1	130.2	171.5	-66.3	-171.4	-165.7	-90.8	10.2	109.5	P311 R313	P311-R319 HydrophobicContact CG-CB 4.37Å; P311-R319 PolarHBondContact O-NH1 2.9Å; R313-R319 HydrophobicContact CG-CG 4.17Å
320	P	87.3	Confident	86.8	Confident	39 Å²	39	72.6 Å²	72.6	25%	0.253	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-67.2	150.8	174.3	29.4	-33.7	0	0	0	110.8	F289 P311 S312	F289-P320 HydrophobicContact CB-CB 3.94Å; F289-P320 HydrophobicContact CB-CG 4.08Å; F289-P320 HydrophobicContact CD1-CB 4.4Å; F289-P320 HydrophobicContact CD1-CG 3.6Å; F289-P320 HydrophobicContact CD2-CB 4.25Å; F289-P320 HydrophobicContact CD2-CG 3.83Å; F289-P320 HydrophobicContact CE1-CG 3.88Å; F289-P320 HydrophobicContact CE2-CG 4.1Å; F289-P320 HydrophobicContact CG-CB 3.96Å; F289-P320 HydrophobicContact CG-CG 3.57Å; F289-P320 HydrophobicContact CZ-CG 4.11Å; P311-P320 HydrophobicContact CB-CG 4.01Å; P311-P320 WeakPolarHBondContact CG-O 3.41Å; S312-P320 WeakPolarHBondContact O-CD 3.48Å
321	A	87.6	Confident	86.7	Confident	88 Å²	88	71.3 Å²	71.3	73%	0.727	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-72.8	146.5	170.4	0	0	0	0	0	110.1
322	I	90.6	Very high	86.8	Confident	22 Å²	22	71.2 Å²	71.2	11%	0.113	37%	0.369	C	S	.	.			trans	-136.3	150.8	-179	54.7	166.2	0	0	0	111.7	F289 R297 I309 P311	F289-I322 HydrophobicContact CB-CG2 3.92Å; F289-I322 HydrophobicContact CD1-CG2 3.78Å; F289-I322 HydrophobicContact CG-CG2 4.35Å; F289-I322 WeakPolarHBondContact O-CA 3.13Å; R297-I322 HydrophobicContact CB-CD1 4.2Å; R297-I322 HydrophobicContact CB-CG1 4.36Å; I309-I322 HydrophobicContact CB-CD1 4.06Å; I309-I322 HydrophobicContact CG2-CD1 3.88Å; P311-I322 HydrophobicContact CB-CG2 4.32Å; P311-I322 HydrophobicContact CG-CD1 4.28Å; P311-I322 HydrophobicContact CG-CG1 4.43Å; P311-I322 HydrophobicContact CG-CG2 4.36Å
323	G	85.5	Confident	87	Confident	12 Å²	12	70.6 Å²	70.6	12%	0.124	36%	0.362	C	S	.	.			trans	84.5	26.9	171.3	0	0	0	0	0	116	Y295 R325	Y295-G323 WeakPolarHBondContact O-CA 3.32Å; G323-R325 PolarHBondContact O-NH1 2.78Å
324	Q	89.3	Confident	87.3	Confident	31 Å²	31	63.9 Å²	63.9	15%	0.145	34%	0.343	C	S	.	.			trans	-61.8	151.9	176.3	67.1	83.9	19.1	0	0	112.6	D290 T326 R327	D290-Q324 VanDerWaalsContact O-CG 3.32Å; D290-Q324 WeakPolarHBondContact O-CG 3.25Å; D290-Q324 PolarHBondContact O-NE2 3.03Å; Q324-T326 PolarHBondContact OE1-OG1 3.06Å; Q324-R327 PolarHBondContact NE2-O 3.11Å; Q324-R327 VanDerWaalsContact OE1-N 3.15Å; Q324-R327 PolarHBondContact OE1-O 2.8Å
325	R	87	Confident	87.9	Confident	50 Å²	50	61.2 Å²	61.2	19%	0.189	33%	0.328	C	S	.	.			trans	-132.7	46.8	179.8	-64.2	-66.6	-179	-91.7	4.6	111.3	G232 I292 H294 G323	G232-R325 WeakPolarHBondContact CA-O 3.03Å; I292-R325 PolarHBondContact O-NH1 2.85Å; I292-R325 VanDerWaalsContact O-NH1 3.15Å; H294-R325 PolarHBondContact O-NH1 2.85Å; H294-R325 PolarHBondContact O-NH2 2.8Å; H294-R325 VanDerWaalsContact O-NH2 3.11Å; G323-R325 PolarHBondContact O-NH1 2.78Å
326	T	85.8	Confident	88.7	Confident	78 Å²	78	53 Å²	53	48%	0.479	28%	0.284	S	S	.	.	S	Bend	trans	-122.6	-40.5	-172.3	64.7	0	0	0	0	114.3	Q324	Q324-T326 PolarHBondContact OE1-OG1 3.06Å
327	R	90.2	Very high	89.3	Confident	116 Å²	116	51.4 Å²	51.4	44%	0.438	27%	0.269	S	S	.	.	S	Bend	trans	-157.3	175.3	-171	67	-177.3	-178.1	-76.4	-14	111.6	D290 I292 Q324	D290-R327 VanDerWaalsContact CG-NH2 3.25Å; D290-R327 IonicContact OD1-NH2 3.76Å; D290-R327 PolarHBondContact OD1-NH2 2.7Å; D290-R327 IonicContact OD2-CZ 3.49Å; D290-R327 IonicContact OD2-NE 2.88Å; D290-R327 IonicContact OD2-NH2 3.21Å; D290-R327 PolarHBondContact OD2-NH2 3.46Å; I292-R327 VanDerWaalsContact CD1-O 3.25Å; I292-R327 WeakPolarHBondContact CD1-O 3.48Å; Q324-R327 PolarHBondContact NE2-O 3.11Å; Q324-R327 VanDerWaalsContact OE1-N 3.15Å; Q324-R327 PolarHBondContact OE1-O 2.8Å
328	L	93	Very high	89.9	Confident	11 Å²	11	54.6 Å²	54.6	6%	0.058	27%	0.274	C	S	.	.			trans	-81.8	138	168	-64.9	170.5	0	0	0	109.8	H180 W181 Y184 V235 I292 D332 I333	H180-L328 PolarHBondContact NE2-N 3.31Å; W181-L328 HydrophobicContact CD2-CD1 3.71Å; W181-L328 HydrophobicContact CD2-CD2 4.01Å; W181-L328 HydrophobicContact CD2-CG 4.47Å; W181-L328 HydrophobicContact CE3-CD1 3.6Å; W181-L328 HydrophobicContact CE3-CD2 4.11Å; W181-L328 HydrophobicContact CG-CD1 4.22Å; W181-L328 HydrophobicContact CH2-CD1 4.46Å; W181-L328 HydrophobicContact CH2-CD2 3.48Å; W181-L328 VanDerWaalsContact CH2-CD2 3.48Å; W181-L328 HydrophobicContact CZ2-CD2 3.33Å; W181-L328 HydrophobicContact CZ3-CD1 4Å; W181-L328 HydrophobicContact CZ3-CD2 3.86Å; Y184-L328 HydrophobicContact CD2-CD1 4.46Å; V235-L328 HydrophobicContact CG1-CD2 3.67Å; V235-L328 HydrophobicContact CG1-CG 4.07Å; I292-L328 HydrophobicContact CG2-CD2 3.91Å; L328-D332 HydrophobicContact CB-CB 4.3Å; L328-D332 HydrophobicContact CD2-CB 4.13Å; L328-I333 HydrophobicContact CB-CD1 4.15Å; L328-I333 HydrophobicContact CB-CG1 3.93Å; L328-I333 HydrophobicContact CD1-CG1 4.41Å
329	S	94.3	Very high	90.3	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.021	25%	0.25	C	S	.	.			trans	-76.4	172.8	172.3	79	0	0	0	0	111.4	D288 D290 G331 D332 I333	D288-S329 VanDerWaalsContact OD2-CB 3.24Å; D288-S329 WeakPolarHBondContact OD2-CB 3.25Å; D288-S329 PolarHBondContact OD2-OG 2.84Å; D290-S329 WeakPolarHBondContact O-CB 3.42Å; S329-G331 VanDerWaalsContact C-N 3.34Å; S329-G331 PolarHBondContact OG-N 3Å; S329-D332 WeakPolarHBondContact CB-OD2 3.42Å; S329-D332 PolarHBondContact N-OD2 3.23Å; S329-D332 PolarHBondContact OG-N 3.14Å; S329-D332 PolarHBondContact OG-OD2 3.1Å; S329-D332 VanDerWaalsContact OG-OD2 3.08Å; S329-I333 WeakPolarHBondContact O-CD1 3.04Å; S329-I333 VanDerWaalsContact O-CG1 3.27Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.94Å
330	K	92.3	Very high	90.6	Very high	189 Å²	189	45.2 Å²	45.2	82%	0.822	23%	0.233	S	C	*	.	H	α-helix	trans	-67.3	-35.2	173.3	-70.5	-179.3	-179.7	174.5	0	112.2	A334	K330-A334 VanDerWaalsContact O-CB 3.31Å; K330-A334 WeakPolarHBondContact O-CB 3.49Å; K330-A334 PolarHBondContact O-N 3.12Å
331	G	91	Very high	90.8	Very high	12 Å²	12	54 Å²	54	12%	0.124	26%	0.261	C	S	.	.	H	α-helix	trans	-70.6	-41.8	176.1	0	0	0	0	0	112.3	D288 S329 I333 A334 Q335	D288-G331 WeakPolarHBondContact OD2-CA 2.98Å; D288-G331 PolarHBondContact OD2-N 3.34Å; S329-G331 VanDerWaalsContact C-N 3.34Å; S329-G331 PolarHBondContact OG-N 3Å; G331-I333 VanDerWaalsContact C-N 3.29Å; G331-I333 PolarHBondContact O-N 3.42Å; G331-A334 PolarHBondContact O-N 3.04Å; G331-Q335 WeakPolarHBondContact O-CB 3.32Å; G331-Q335 PolarHBondContact O-N 3.44Å
332	D	93.9	Very high	90.9	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.027	23%	0.233	C	C	.	.	H	α-helix	trans	-53.2	-49.2	174.1	-65.4	-33.9	0	0	0	110.4	F244 S291 I292 L328 S329 A336	F244-D332 HydrophobicContact CE2-CB 4.28Å; F244-D332 WeakPolarHBondContact CZ-O 3.29Å; S291-D332 WeakPolarHBondContact CB-OD1 3.5Å; S291-D332 PolarHBondContact OG-OD1 2.04Å; I292-D332 PolarHBondContact N-OD2 2.94Å; L328-D332 HydrophobicContact CB-CB 4.3Å; L328-D332 HydrophobicContact CD2-CB 4.13Å; S329-D332 WeakPolarHBondContact CB-OD2 3.42Å; S329-D332 PolarHBondContact N-OD2 3.23Å; S329-D332 PolarHBondContact OG-N 3.14Å; S329-D332 PolarHBondContact OG-OD2 3.1Å; S329-D332 VanDerWaalsContact OG-OD2 3.08Å; D332-A336 WeakPolarHBondContact O-CB 3.37Å; D332-A336 PolarHBondContact O-N 2.84Å
333	I	93.6	Very high	90.8	Very high	33 Å²	33	50.9 Å²	50.9	17%	0.169	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-48	179.7	-64.9	165	0	0	0	111.3	Y184 L328 S329 G331 A336 R337	Y184-I333 HydrophobicContact CD1-CD1 4.09Å; Y184-I333 HydrophobicContact CD2-CD1 4.45Å; Y184-I333 HydrophobicContact CG-CD1 3.83Å; Y184-I333 HydrophobicContact CG-CG1 4.39Å; Y184-I333 WeakPolarHBondContact O-CG2 3.42Å; L328-I333 HydrophobicContact CB-CD1 4.15Å; L328-I333 HydrophobicContact CB-CG1 3.93Å; L328-I333 HydrophobicContact CD1-CG1 4.41Å; S329-I333 WeakPolarHBondContact O-CD1 3.04Å; S329-I333 VanDerWaalsContact O-CG1 3.27Å; S329-I333 WeakPolarHBondContact O-CG1 3.28Å; S329-I333 PolarHBondContact O-N 2.94Å; G331-I333 VanDerWaalsContact C-N 3.29Å; G331-I333 PolarHBondContact O-N 3.42Å; I333-A336 PolarHBondContact O-N 2.86Å; I333-R337 WeakPolarHBondContact O-CB 3.42Å; I333-R337 VanDerWaalsContact O-CG 3.27Å; I333-R337 WeakPolarHBondContact O-CG 3.41Å; I333-R337 PolarHBondContact O-N 2.8Å
334	A	91.8	Very high	90.7	Very high	30 Å²	30	55 Å²	55	25%	0.248	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-42.5	-178.7	0	0	0	0	0	112	E285 K330 G331 R337 K338	E285-A334 HydrophobicContact CG-CB 4.43Å; K330-A334 VanDerWaalsContact O-CB 3.31Å; K330-A334 WeakPolarHBondContact O-CB 3.49Å; K330-A334 PolarHBondContact O-N 3.12Å; G331-A334 PolarHBondContact O-N 3.04Å; A334-R337 PolarHBondContact O-N 3.38Å; A334-K338 WeakPolarHBondContact O-CG 3.23Å; A334-K338 PolarHBondContact O-N 2.87Å
335	Q	91.4	Very high	90.7	Very high	11 Å²	11	54.8 Å²	54.8	5%	0.051	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-44.4	178.1	-165	170.2	111.2	0	0	111.4	A145 F244 L283 E285 G331 R337 K338 L339	A145-Q335 HydrophobicContact CB-CG 4.03Å; F244-Q335 HydrophobicContact CE1-CB 4.38Å; F244-Q335 HydrophobicContact CE1-CG 4.11Å; F244-Q335 HydrophobicContact CZ-CB 3.94Å; F244-Q335 HydrophobicContact CZ-CG 4.15Å; L283-Q335 HydrophobicContact CD1-CG 4.35Å; L283-Q335 WeakPolarHBondContact CD1-O 3.47Å; E285-Q335 HydrophobicContact CG-CB 4.03Å; E285-Q335 HydrophobicContact CG-CG 4.47Å; G331-Q335 WeakPolarHBondContact O-CB 3.32Å; G331-Q335 PolarHBondContact O-N 3.44Å; Q335-R337 VanDerWaalsContact C-N 3.33Å; Q335-R337 PolarHBondContact O-N 3.38Å; Q335-K338 PolarHBondContact O-N 2.9Å; Q335-L339 WeakPolarHBondContact O-CB 3.05Å; Q335-L339 PolarHBondContact O-N 3.37Å
336	A	92.8	Very high	90.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-42.1	175.3	0	0	0	0	0	111.1	W181 T185 F244 D332 I333 K338 L339 Y340	W181-A336 HydrophobicContact CZ3-CB 4.05Å; T185-A336 HydrophobicContact CG2-CB 3.76Å; F244-A336 HydrophobicContact CE1-CB 4.39Å; F244-A336 HydrophobicContact CZ-CB 3.77Å; D332-A336 WeakPolarHBondContact O-CB 3.37Å; D332-A336 PolarHBondContact O-N 2.84Å; I333-A336 PolarHBondContact O-N 2.86Å; A336-K338 VanDerWaalsContact C-N 3.32Å; A336-K338 PolarHBondContact O-N 3.27Å; A336-L339 PolarHBondContact O-N 3.09Å; A336-Y340 PolarHBondContact O-N 3.43Å; A336-Y340 VanDerWaalsContact O-N 3.08Å
337	R	91.8	Very high	91	Very high	97 Å²	97	55.1 Å²	55.1	37%	0.366	27%	0.274	S	S	.	.	H	α-helix	trans	-62.5	-37.4	177.6	-73.7	177.8	77.7	141.9	3.8	112.8	I333 A334 Q335 R341 C342 P343	I333-R337 WeakPolarHBondContact O-CB 3.42Å; I333-R337 VanDerWaalsContact O-CG 3.27Å; I333-R337 WeakPolarHBondContact O-CG 3.41Å; I333-R337 PolarHBondContact O-N 2.8Å; A334-R337 PolarHBondContact O-N 3.38Å; Q335-R337 VanDerWaalsContact C-N 3.33Å; Q335-R337 PolarHBondContact O-N 3.38Å; R337-R341 PolarHBondContact O-N 3.33Å; R337-C342 VanDerWaalsContact CA-SG 3.52Å; R337-C342 HydrophobicContact CB-CB 4.07Å; R337-C342 HydrophobicContact CG-CB 4.1Å; R337-C342 PolarHBondContact O-N 3.46Å; R337-P343 PolarHBondContact NH2-O 3.35Å
338	K	91	Very high	91.1	Very high	94 Å²	94	50.1 Å²	50.1	41%	0.409	26%	0.256	S	S	.	.	H	α-helix	trans	-71.3	-41.9	173.1	-72.3	175.9	170.8	177.5	0	112.4	L283 E285 A334 Q335 A336 Y340 R341	L283-K338 HydrophobicContact CB-CB 3.83Å; L283-K338 HydrophobicContact CB-CD 3.85Å; L283-K338 HydrophobicContact CD1-CB 3.7Å; L283-K338 HydrophobicContact CG-CB 4.36Å; L283-K338 VanDerWaalsContact O-CD 3.26Å; L283-K338 WeakPolarHBondContact O-CD 3.41Å; L283-K338 PolarHBondContact O-NZ 2.87Å; E285-K338 WeakPolarHBondContact OE1-CD 3.3Å; E285-K338 WeakPolarHBondContact OE1-CE 3.38Å; E285-K338 IonicContact OE1-NZ 2.74Å; E285-K338 PolarHBondContact OE1-NZ 2.7Å; A334-K338 WeakPolarHBondContact O-CG 3.23Å; A334-K338 PolarHBondContact O-N 2.87Å; Q335-K338 PolarHBondContact O-N 2.9Å; A336-K338 VanDerWaalsContact C-N 3.32Å; A336-K338 PolarHBondContact O-N 3.27Å; K338-Y340 VanDerWaalsContact C-N 3.35Å; K338-Y340 PolarHBondContact O-N 3.31Å; K338-R341 PolarHBondContact O-N 2.84Å
339	L	91.2	Very high	91.1	Very high	12 Å²	12	50.6 Å²	50.6	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-45.4	-176.3	-177	60.9	0	0	0	111.1	A145 I152 F244 L283 Q335 A336	A145-L339 HydrophobicContact CB-CD2 4.29Å; I152-L339 HydrophobicContact CD1-CD1 3.78Å; I152-L339 HydrophobicContact CG1-CD1 4.11Å; F244-L339 HydrophobicContact CD1-CD2 4.45Å; F244-L339 HydrophobicContact CE1-CD2 4.15Å; L283-L339 VanDerWaalsContact CD1-CA 3.47Å; L283-L339 HydrophobicContact CD1-CB 3.67Å; L283-L339 HydrophobicContact CD1-CD1 4.21Å; L283-L339 VanDerWaalsContact CD1-N 3.29Å; Q335-L339 WeakPolarHBondContact O-CB 3.05Å; Q335-L339 PolarHBondContact O-N 3.37Å; A336-L339 PolarHBondContact O-N 3.09Å
340	Y	91.2	Very high	90.8	Very high	17 Å²	17	51.5 Å²	51.5	7%	0.067	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	4.7	179.7	-71.5	-81.7	0	0	0	114.3	I152 W153 V187 I242 A336 K338 C342	I152-Y340 HydrophobicContact CG2-CD1 4.04Å; I152-Y340 HydrophobicContact CG2-CE1 3.59Å; W153-Y340 HydrophobicContact CB-CE1 4.03Å; W153-Y340 WeakPolarHBondContact O-CE1 3.35Å; V187-Y340 HydrophobicContact CG2-CD2 3.71Å; V187-Y340 HydrophobicContact CG2-CE2 3.95Å; V187-Y340 HydrophobicContact CG2-CG 4.05Å; I242-Y340 HydrophobicContact CG2-CE2 3.78Å; I242-Y340 WeakPolarHBondContact O-CE2 3.46Å; I242-Y340 PolarHBondContact O-OH 3.22Å; A336-Y340 PolarHBondContact O-N 3.43Å; A336-Y340 VanDerWaalsContact O-N 3.08Å; K338-Y340 VanDerWaalsContact C-N 3.35Å; K338-Y340 PolarHBondContact O-N 3.31Å; Y340-C342 VanDerWaalsContact C-N 3.32Å; Y340-C342 PolarHBondContact O-N 3.36Å
341	R	90.7	Very high	90.5	Very high	222 Å²	222	47.9 Å²	47.9	84%	0.838	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	49.1	-179.6	-53.5	179.8	-173.6	174.5	2.1	112.3	R337 K338	R337-R341 PolarHBondContact O-N 3.33Å; K338-R341 PolarHBondContact O-N 2.84Å
342	C	90.8	Very high	90.1	Very high	23 Å²	23	47.6 Å²	47.6	16%	0.155	25%	0.245	C	C	.	.			trans	-60.2	147.8	-178.2	-60.8	0	0	0	0	112	C186 R337 Y340	C186-C342 HydrophobicContact CB-CB 3.62Å; C186-C342 WeakPolarHBondContact CB-SG 3.48Å; C186-C342 PolarHBondContact N-SG 2.82Å; C186-C342 WeakPolarHBondContact SG-CA 3.04Å; C186-C342 WeakPolarHBondContact SG-CB 3.33Å; C186-C342 CovalentContact SG-SG 2.01Å; C186-C342 PolarHBondContact SG-SG 2.97Å; R337-C342 VanDerWaalsContact CA-SG 3.52Å; R337-C342 HydrophobicContact CB-CB 4.07Å; R337-C342 HydrophobicContact CG-CB 4.1Å; R337-C342 PolarHBondContact O-N 3.46Å; Y340-C342 VanDerWaalsContact C-N 3.32Å; Y340-C342 PolarHBondContact O-N 3.36Å
343	P	87.9	Confident	89.8	Confident	23 Å²	23	50.6 Å²	50.6	15%	0.149	26%	0.263	C	S	.	.			trans	-54.3	151.7	175.9	-27.4	36.1	0	0	0	113.4	R337 C345 I372	R337-P343 PolarHBondContact NH2-O 3.35Å; P343-C345 WeakPolarHBondContact CB-O 3.31Å; P343-C345 PolarHBondContact O-N 2.84Å; P343-I372 HydrophobicContact CB-CG1 4.38Å; P343-I372 HydrophobicContact CG-CB 3.92Å; P343-I372 HydrophobicContact CG-CD1 3.59Å; P343-I372 HydrophobicContact CG-CG1 3.68Å
344	A	84	Confident	89.6	Confident	99 Å²	99	49.9 Å²	49.9	82%	0.818	26%	0.264	S	S	*	.	S	Bend	trans	-68.1	-24.8	179.2	0	0	0	0	0	112.7
345	C	88.6	Confident	89.7	Confident	26 Å²	26	55 Å²	55	18%	0.176	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-144.7	166.4	-178.8	49.6	0	0	0	0	111.7	P343 P359 T369 H370 C371 I372	P343-C345 WeakPolarHBondContact CB-O 3.31Å; P343-C345 PolarHBondContact O-N 2.84Å; C345-P359 HydrophobicContact CB-CG 3.94Å; C345-T369 VanDerWaalsContact SG-CG2 3.56Å; C345-H370 VanDerWaalsContact SG-C 3.59Å; C345-H370 PolarHBondContact SG-O 3.06Å; C345-C371 HydrophobicContact CB-CB 3.92Å; C345-C371 WeakPolarHBondContact CB-SG 3.26Å; C345-C371 WeakPolarHBondContact O-CA 3.32Å; C345-C371 WeakPolarHBondContact O-CB 3.48Å; C345-C371 WeakPolarHBondContact SG-CA 3.36Å; C345-C371 WeakPolarHBondContact SG-CB 3.39Å; C345-C371 CovalentContact SG-SG 2.04Å; C345-C371 PolarHBondContact SG-SG 3.08Å; C345-I372 PolarHBondContact O-N 2.81Å
346	G	88.3	Confident	89.9	Confident	22 Å²	22	55 Å²	55	23%	0.227	29%	0.287	C	S	.	.			trans	82.7	165.2	-166.9	0	0	0	0	0	112.4	I372	G346-I372 CarbonylContact C-O 3.52Å; G346-I372 WeakPolarHBondContact CA-O 3.4Å
347	E	91.1	Very high	90	Very high	113 Å²	113	57.3 Å²	57.3	53%	0.528	30%	0.304	S	S	.	.			trans	-154.5	172.4	-169.9	68.4	-157.5	140.4	0	0	111.9	L349 I372 W373 R374	E347-L349 HydrophobicContact CG-CD2 3.77Å; E347-L349 HydrophobicContact CG-CG 4.18Å; E347-I372 PolarHBondContact N-O 2.98Å; E347-W373 VanDerWaalsContact O-CA 3.31Å; E347-W373 WeakPolarHBondContact O-CA 3.39Å; E347-R374 PolarHBondContact O-N 2.92Å
348	T	92.4	Very high	90.1	Very high	10 Å²	10	52.8 Å²	52.8	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	111	173.1	-51.6	0	0	0	0	109.3	E182 Q350 R374	E182-T348 HydrophobicContact CB-CG2 4.35Å; E182-T348 WeakPolarHBondContact O-CB 3.29Å; E182-T348 PolarHBondContact O-OG1 2.98Å; T348-Q350 HydrophobicContact CG2-CG 3.95Å; T348-R374 CarbonylContact C-O 3.48Å; T348-R374 WeakPolarHBondContact CA-O 3.29Å; T348-R374 HydrophobicContact CG2-CB 4.08Å
349	L	92.9	Very high	90.1	Very high	21 Å²	21	50.1 Å²	50.1	11%	0.11	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	110.8	179.8	-61.1	170.4	0	0	0	108.6	E347 F356 W373 R374 I375 S376 Y454	E347-L349 HydrophobicContact CG-CD2 3.77Å; E347-L349 HydrophobicContact CG-CG 4.18Å; L349-F356 HydrophobicContact CD1-CB 4.05Å; L349-F356 HydrophobicContact CD1-CD1 3.65Å; L349-F356 HydrophobicContact CD1-CE1 4.27Å; L349-F356 HydrophobicContact CD1-CG 3.87Å; L349-W373 HydrophobicContact CD1-CB 4.39Å; L349-W373 HydrophobicContact CD1-CG 4.48Å; L349-R374 PolarHBondContact N-O 2.66Å; L349-I375 HydrophobicContact CB-CG1 4.29Å; L349-I375 HydrophobicContact CD1-CG1 4.15Å; L349-I375 WeakPolarHBondContact O-CA 3.42Å; L349-S376 PolarHBondContact O-N 3.35Å; L349-Y454 HydrophobicContact CB-CE1 3.88Å; L349-Y454 HydrophobicContact CD1-CD1 4.33Å; L349-Y454 HydrophobicContact CD1-CE1 3.87Å; L349-Y454 HydrophobicContact CG-CE1 4.36Å
350	Q	89.4	Confident	89.9	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.107	30%	0.298	C	S	.	.			trans	-114.4	2.4	-173.6	-69.6	-179.1	-20.4	0	0	114.1	R179 T348 S376	R179-Q350 PolarHBondContact NH2-O 3.43Å; R179-Q350 VanDerWaalsContact NH2-O 3.15Å; R179-Q350 PolarHBondContact O-NE2 3.06Å; R179-Q350 PolarHBondContact O-OE1 3.37Å; T348-Q350 HydrophobicContact CG2-CG 3.95Å; Q350-S376 WeakPolarHBondContact CA-O 3.13Å
351	E	85.5	Confident	89.9	Confident	112 Å²	112	53.9 Å²	53.9	52%	0.523	31%	0.308	S	S	.	.	S	Bend	trans	-82.6	154.4	178.1	-60.9	-172.4	-170.9	0	0	110.3	T353 Y454	E351-T353 PolarHBondContact O-N 3.12Å; E351-Y454 PolarHBondContact N-OH 2.9Å; E351-Y454 WeakPolarHBondContact O-CE2 3.29Å; E351-Y454 VanDerWaalsContact O-CZ 3.31Å; E351-Y454 PolarHBondContact O-OH 3.02Å
352	S	81.4	Confident	89.8	Confident	7 Å²	7	46.9 Å²	46.9	5%	0.049	29%	0.291	C	S	.	.	S	Bend	trans	-67.5	-21.1	179	55.7	0	0	0	0	113.5	E455 A456	S352-E455 CarbonylContact O-C 3.48Å; S352-A456 VanDerWaalsContact O-CB 3.26Å; S352-A456 WeakPolarHBondContact O-CB 3.29Å; S352-A456 PolarHBondContact O-N 3.06Å
353	T	87.6	Confident	89.7	Confident	67 Å²	67	53.2 Å²	53.2	41%	0.411	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	144.4	172.9	45.8	0	0	0	0	108.1	E351 Y454 E455	E351-T353 PolarHBondContact O-N 3.12Å; T353-Y454 WeakPolarHBondContact CA-O 3.24Å; T353-E455 HydrophobicContact CG2-CB 4Å; T353-E455 HydrophobicContact CG2-CG 3.81Å
354	G	90.9	Very high	89.6	Confident	19 Å²	19	52.9 Å²	52.9	20%	0.196	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	158.1	178.6	0	0	0	0	0	113.2	I453 Y454	G354-I453 WeakPolarHBondContact O-CA 3.48Å; G354-Y454 VanDerWaalsContact CA-CE1 3.48Å; G354-Y454 PolarHBondContact N-O 3.01Å; G354-Y454 VanDerWaalsContact N-O 3.08Å; G354-Y454 VanDerWaalsContact O-CD1 3.25Å; G354-Y454 WeakPolarHBondContact O-CD1 3.09Å; G354-Y454 PolarHBondContact O-N 2.88Å
355	N	93.9	Very high	89.8	Confident	137 Å²	137	48.3 Å²	48.3	73%	0.733	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	146.4	171.5	59.6	11.8	0	0	0	110.4	A452	N355-A452 VanDerWaalsContact CA-O 3.31Å; N355-A452 WeakPolarHBondContact CA-O 3.32Å
356	F	95.1	Very high	89.7	Confident	10 Å²	10	50.4 Å²	50.4	4%	0.044	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	156.2	175	67.7	-79	0	0	0	110.2	L349 W373 I375 L385 I437 F450 A451 A452 Y454	L349-F356 HydrophobicContact CD1-CB 4.05Å; L349-F356 HydrophobicContact CD1-CD1 3.65Å; L349-F356 HydrophobicContact CD1-CE1 4.27Å; L349-F356 HydrophobicContact CD1-CG 3.87Å; F356-W373 AromaticContact CD2-CD1 3.78Å; F356-W373 AromaticContact CD2-CD2 3.72Å; F356-W373 HydrophobicContact CD2-CD2 3.72Å; F356-W373 AromaticContact CD2-CE2 3.72Å; F356-W373 HydrophobicContact CD2-CE3 4.34Å; F356-W373 AromaticContact CD2-CG 3.78Å; F356-W373 HydrophobicContact CD2-CG 3.78Å; F356-W373 HydrophobicContact CD2-CZ2 4.35Å; F356-W373 AromaticContact CD2-NE1 3.73Å; F356-W373 HydrophobicContact CE2-CB 4.43Å; F356-W373 AromaticContact CE2-CD2 3.99Å; F356-W373 HydrophobicContact CE2-CD2 3.99Å; F356-W373 HydrophobicContact CE2-CE3 4.24Å; F356-W373 HydrophobicContact CE2-CG 4.06Å; F356-W373 HydrophobicContact CG-CG 4.46Å; F356-I375 HydrophobicContact CE1-CD1 4.3Å; F356-L385 HydrophobicContact CE1-CD1 3.74Å; F356-L385 HydrophobicContact CZ-CD1 3.88Å; F356-I437 HydrophobicContact CE1-CD1 4.33Å; F356-I437 HydrophobicContact CE2-CD1 4.26Å; F356-I437 HydrophobicContact CE2-CG2 4.47Å; F356-I437 HydrophobicContact CZ-CD1 3.54Å; F356-F450 AromaticContact CD2-CE2 3.97Å; F356-F450 HydrophobicContact CD2-CE2 3.97Å; F356-F450 AromaticContact CE2-CE2 3.71Å; F356-F450 HydrophobicContact CE2-CE2 3.71Å; F356-F450 HydrophobicContact CE2-CZ 4.28Å; F356-A451 WeakPolarHBondContact O-CA 3.46Å; F356-A452 HydrophobicContact CD1-CB 4.38Å; F356-A452 HydrophobicContact CE1-CB 3.79Å; F356-A452 HydrophobicContact CE2-CB 4.39Å; F356-A452 HydrophobicContact CZ-CB 3.79Å; F356-A452 PolarHBondContact N-O 2.8Å; F356-A452 PolarHBondContact O-N 3.1Å; F356-Y454 HydrophobicContact CD1-CD1 4.31Å; F356-Y454 HydrophobicContact CE1-CD1 4.36Å
357	S	95.1	Very high	89.6	Confident	50 Å²	50	51.8 Å²	51.8	35%	0.35	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	159.5	-176.7	58.4	0	0	0	0	111.4	W373 F450	S357-W373 WeakPolarHBondContact O-CZ2 3.42Å; S357-F450 CarbonylContact C-O 3.4Å; S357-F450 WeakPolarHBondContact CA-O 3.5Å; S357-F450 WeakPolarHBondContact CB-O 3.5Å
358	S	93	Very high	89.4	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	31%	0.308	C	S	.	.			trans	-58.9	146.3	170.2	52.1	0	0	0	0	111.1	G360 F361 G449 F450	S358-G360 PolarHBondContact O-N 3.48Å; S358-F361 WeakPolarHBondContact O-CB 3.48Å; S358-F361 PolarHBondContact O-N 3.3Å; S358-F361 VanDerWaalsContact O-N 3.12Å; S358-G449 VanDerWaalsContact OG-CA 3.24Å; S358-G449 WeakPolarHBondContact OG-CA 3.35Å; S358-F450 PolarHBondContact N-O 3.48Å; S358-F450 PolarHBondContact OG-N 3Å; S358-F450 PolarHBondContact OG-O 2.94Å
359	P	91.6	Very high	89.2	Confident	38 Å²	38	53.9 Å²	53.9	25%	0.247	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	138.1	175	-24.5	33.2	0	0	0	111.6	C345 F361 Y365 T369 C371	C345-P359 HydrophobicContact CB-CG 3.94Å; P359-F361 VanDerWaalsContact C-N 3.26Å; P359-F361 PolarHBondContact O-N 2.84Å; P359-Y365 VanDerWaalsContact O-CA 3.28Å; P359-Y365 WeakPolarHBondContact O-CA 3.35Å; P359-T369 HydrophobicContact CG-CG2 4.31Å; P359-C371 VanDerWaalsContact CD-SG 3.6Å; P359-C371 WeakPolarHBondContact CG-SG 3.4Å
360	G	87.4	Confident	89.2	Confident	44 Å²	44	56.4 Å²	56.4	45%	0.454	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-4.3	179.2	0	0	0	0	0	115.9	S358 N363 G364	S358-G360 PolarHBondContact O-N 3.48Å; G360-N363 WeakPolarHBondContact O-CA 3.42Å; G360-N363 WeakPolarHBondContact O-CB 3.49Å; G360-N363 PolarHBondContact O-N 3.45Å; G360-G364 CarbonylContact C-O 3.59Å; G360-G364 WeakPolarHBondContact CA-O 3.21Å; G360-G364 PolarHBondContact O-N 3.31Å
361	F	90	Very high	89.3	Confident	64 Å²	64	55.3 Å²	55.3	28%	0.281	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	138.1	173.4	-176.9	-90.4	0	0	0	111.6	S358 P359 T389 K448 A451	S358-F361 WeakPolarHBondContact O-CB 3.48Å; S358-F361 PolarHBondContact O-N 3.3Å; S358-F361 VanDerWaalsContact O-N 3.12Å; P359-F361 VanDerWaalsContact C-N 3.26Å; P359-F361 PolarHBondContact O-N 2.84Å; F361-T389 WeakPolarHBondContact CE2-OG1 3.24Å; F361-T389 HydrophobicContact CZ-CG2 4.47Å; F361-T389 VanDerWaalsContact CZ-OG1 3.24Å; F361-T389 WeakPolarHBondContact CZ-OG1 3.4Å; F361-K448 WeakPolarHBondContact CD2-O 3.35Å; F361-A451 HydrophobicContact CD1-CB 4.27Å; F361-A451 HydrophobicContact CE1-CB 3.8Å; F361-A451 HydrophobicContact CE2-CB 4.27Å; F361-A451 HydrophobicContact CZ-CB 3.8Å
362	P	89.8	Confident	89.8	Confident	76 Å²	76	50.8 Å²	50.8	49%	0.494	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	cis	-89.9	6.5	0.7	37.6	-37.2	0	0	0	114.3	G364	P362-G364 VanDerWaalsContact C-N 3.3Å; P362-G364 PolarHBondContact O-N 2.81Å
363	N	87.4	Confident	90.4	Very high	156 Å²	156	50.8 Å²	50.8	83%	0.834	30%	0.295	S	S	*	.	S	Bend	trans	-79.7	-10.2	-174.1	-58.1	-47.4	0	0	0	113.7	G360	G360-N363 WeakPolarHBondContact O-CA 3.42Å; G360-N363 WeakPolarHBondContact O-CB 3.49Å; G360-N363 PolarHBondContact O-N 3.45Å
364	G	85.2	Confident	90.7	Very high	16 Å²	16	49 Å²	49	17%	0.165	28%	0.28	C	S	.	.			trans	119	147.5	175.5	0	0	0	0	0	113.5	G360 P362 G447	G360-G364 CarbonylContact C-O 3.59Å; G360-G364 WeakPolarHBondContact CA-O 3.21Å; G360-G364 PolarHBondContact O-N 3.31Å; P362-G364 VanDerWaalsContact C-N 3.3Å; P362-G364 PolarHBondContact O-N 2.81Å; G364-G447 WeakPolarHBondContact CA-O 3.45Å
365	Y	88.3	Confident	90.8	Very high	3 Å²	3	48.1 Å²	48.1	1%	0.012	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-85.7	149.8	-178.4	59.8	-91.8	0	0	0	112.5	P359 L392 Y393 D401 F439 V446 G447	P359-Y365 VanDerWaalsContact O-CA 3.28Å; P359-Y365 WeakPolarHBondContact O-CA 3.35Å; Y365-L392 HydrophobicContact CD1-CD2 4.11Å; Y365-L392 HydrophobicContact CE1-CD2 3.58Å; Y365-Y393 PolarHBondContact OH-N 3.25Å; Y365-Y393 VanDerWaalsContact OH-N 3.12Å; Y365-D401 VanDerWaalsContact CE2-OD2 3.31Å; Y365-D401 WeakPolarHBondContact CE2-OD2 3.17Å; Y365-D401 PolarHBondContact OH-OD2 2.93Å; Y365-F439 HydrophobicContact CD1-CZ 4.17Å; Y365-F439 HydrophobicContact CD2-CE1 4.05Å; Y365-F439 AromaticContact CD2-CZ 3.67Å; Y365-F439 HydrophobicContact CD2-CZ 3.67Å; Y365-F439 HydrophobicContact CE1-CZ 4.38Å; Y365-F439 AromaticContact CE2-CZ 3.93Å; Y365-F439 HydrophobicContact CE2-CZ 3.93Å; Y365-F439 HydrophobicContact CG-CE1 4.1Å; Y365-F439 AromaticContact CG-CZ 3.8Å; Y365-F439 HydrophobicContact CG-CZ 3.8Å; Y365-V446 HydrophobicContact CD2-CG1 4.36Å; Y365-V446 HydrophobicContact CE2-CB 4.49Å; Y365-V446 HydrophobicContact CE2-CG1 4.29Å; Y365-V446 WeakPolarHBondContact O-CB 3.46Å; Y365-V446 WeakPolarHBondContact O-CG1 3.08Å; Y365-G447 WeakPolarHBondContact CD1-O 3.33Å; Y365-G447 WeakPolarHBondContact CE1-O 3.49Å; Y365-G447 PolarHBondContact N-O 2.74Å
366	P	87.6	Confident	90.7	Very high	69 Å²	69	41.9 Å²	41.9	45%	0.448	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-70.3	145.3	176	-12.9	27.2	0	0	0	111.7	T369	P366-T369 WeakPolarHBondContact CB-OG1 3.14Å; P366-T369 WeakPolarHBondContact O-CB 3.44Å; P366-T369 PolarHBondContact O-OG1 2.92Å
367	S	85.5	Confident	90.3	Very high	52 Å²	52	41.7 Å²	41.7	36%	0.364	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	154.4	171	54.1	0	0	0	0	111.6	T369 S443	S367-T369 PolarHBondContact O-N 2.83Å; S367-T369 VanDerWaalsContact O-N 3.15Å; S367-S443 WeakPolarHBondContact CB-O 3.39Å
368	Y	86.6	Confident	89.7	Confident	150 Å²	150	39.4 Å²	39.4	59%	0.588	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	21	-178.4	-56.3	-73.7	0	0	0	115.1	S441 S442 N444	Y368-S441 CarbonylContact C-O 3.57Å; Y368-S441 VanDerWaalsContact CA-O 3.27Å; Y368-S441 WeakPolarHBondContact CA-O 3.47Å; Y368-S442 VanDerWaalsContact CE1-O 3.25Å; Y368-S442 WeakPolarHBondContact CE1-O 3.22Å; Y368-N444 WeakPolarHBondContact CE2-OD1 3.4Å; Y368-N444 PolarHBondContact OH-OD1 2.76Å
369	T	89.3	Confident	88.9	Confident	17 Å²	17	41.2 Å²	41.2	10%	0.104	23%	0.234	C	C	.	.			trans	-73	139.9	177.6	-66.3	0	0	0	0	112	C345 P359 P366 S367 C371 F439 R440 S441	C345-T369 VanDerWaalsContact SG-CG2 3.56Å; P359-T369 HydrophobicContact CG-CG2 4.31Å; P366-T369 WeakPolarHBondContact CB-OG1 3.14Å; P366-T369 WeakPolarHBondContact O-CB 3.44Å; P366-T369 PolarHBondContact O-OG1 2.92Å; S367-T369 PolarHBondContact O-N 2.83Å; S367-T369 VanDerWaalsContact O-N 3.15Å; T369-C371 WeakPolarHBondContact CG2-SG 3.35Å; T369-F439 HydrophobicContact CG2-CD1 4.28Å; T369-F439 HydrophobicContact CG2-CE1 4.29Å; T369-R440 WeakPolarHBondContact O-CA 3.49Å; T369-S441 PolarHBondContact O-N 2.87Å
370	H	91.9	Very high	87.9	Confident	74 Å²	74	40.4 Å²	40.4	34%	0.343	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	108.9	168.7	-178.1	-143.5	0	0	0	109.8	C345 E438	C345-H370 VanDerWaalsContact SG-C 3.59Å; C345-H370 PolarHBondContact SG-O 3.06Å; H370-E438 IonicContact CD2-OE1 2.98Å; H370-E438 IonicContact CE1-OE1 2.63Å; H370-E438 IonicContact NE2-OE1 3.07Å; H370-E438 PolarHBondContact NE2-OE1 3.05Å
371	C	92.9	Very high	87.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	146.7	176.6	-48.6	0	0	0	0	110.8	C345 P359 T369 W373 F439	C345-C371 HydrophobicContact CB-CB 3.92Å; C345-C371 WeakPolarHBondContact CB-SG 3.26Å; C345-C371 WeakPolarHBondContact O-CA 3.32Å; C345-C371 WeakPolarHBondContact O-CB 3.48Å; C345-C371 WeakPolarHBondContact SG-CA 3.36Å; C345-C371 WeakPolarHBondContact SG-CB 3.39Å; C345-C371 CovalentContact SG-SG 2.04Å; C345-C371 PolarHBondContact SG-SG 3.08Å; P359-C371 VanDerWaalsContact CD-SG 3.6Å; P359-C371 WeakPolarHBondContact CG-SG 3.4Å; T369-C371 WeakPolarHBondContact CG2-SG 3.35Å; C371-W373 HydrophobicContact CB-CE3 4.2Å; C371-W373 HydrophobicContact CB-CH2 3.4Å; C371-W373 VanDerWaalsContact CB-CH2 3.4Å; C371-W373 HydrophobicContact CB-CZ2 4.12Å; C371-W373 HydrophobicContact CB-CZ3 3.45Å; C371-W373 VanDerWaalsContact CB-CZ3 3.45Å; C371-F439 HydrophobicContact CB-CB 4.43Å; C371-F439 PolarHBondContact N-O 2.82Å; C371-F439 PolarHBondContact O-N 3.05Å
372	I	94.3	Very high	87.4	Confident	16 Å²	16	38.5 Å²	38.5	8%	0.082	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	124	171.4	-55.1	179.9	0	0	0	109	P343 C345 G346 E347 W436 I437	P343-I372 HydrophobicContact CB-CG1 4.38Å; P343-I372 HydrophobicContact CG-CB 3.92Å; P343-I372 HydrophobicContact CG-CD1 3.59Å; P343-I372 HydrophobicContact CG-CG1 3.68Å; C345-I372 PolarHBondContact O-N 2.81Å; G346-I372 CarbonylContact C-O 3.52Å; G346-I372 WeakPolarHBondContact CA-O 3.4Å; E347-I372 PolarHBondContact N-O 2.98Å; I372-W436 HydrophobicContact CD1-CZ2 3.87Å; I372-W436 HydrophobicContact CG1-CZ2 4.42Å; I372-W436 HydrophobicContact CG2-CD2 4.45Å; I372-W436 HydrophobicContact CG2-CZ2 4.21Å; I372-I437 CarbonylContact C-O 3.57Å; I372-I437 VanDerWaalsContact CA-O 3.29Å; I372-I437 WeakPolarHBondContact CA-O 3.41Å
373	W	94.8	Very high	87.5	Confident	8 Å²	8	34.9 Å²	34.9	3%	0.03	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.5	165.7	-62.6	-99	0	0	0	109.7	E347 L349 F356 S357 C371 I437 F439 F450	E347-W373 VanDerWaalsContact O-CA 3.31Å; E347-W373 WeakPolarHBondContact O-CA 3.39Å; L349-W373 HydrophobicContact CD1-CB 4.39Å; L349-W373 HydrophobicContact CD1-CG 4.48Å; F356-W373 AromaticContact CD2-CD1 3.78Å; F356-W373 AromaticContact CD2-CD2 3.72Å; F356-W373 HydrophobicContact CD2-CD2 3.72Å; F356-W373 AromaticContact CD2-CE2 3.72Å; F356-W373 HydrophobicContact CD2-CE3 4.34Å; F356-W373 AromaticContact CD2-CG 3.78Å; F356-W373 HydrophobicContact CD2-CG 3.78Å; F356-W373 HydrophobicContact CD2-CZ2 4.35Å; F356-W373 AromaticContact CD2-NE1 3.73Å; F356-W373 HydrophobicContact CE2-CB 4.43Å; F356-W373 AromaticContact CE2-CD2 3.99Å; F356-W373 HydrophobicContact CE2-CD2 3.99Å; F356-W373 HydrophobicContact CE2-CE3 4.24Å; F356-W373 HydrophobicContact CE2-CG 4.06Å; F356-W373 HydrophobicContact CG-CG 4.46Å; S357-W373 WeakPolarHBondContact O-CZ2 3.42Å; C371-W373 HydrophobicContact CB-CE3 4.2Å; C371-W373 HydrophobicContact CB-CH2 3.4Å; C371-W373 VanDerWaalsContact CB-CH2 3.4Å; C371-W373 HydrophobicContact CB-CZ2 4.12Å; C371-W373 HydrophobicContact CB-CZ3 3.45Å; C371-W373 VanDerWaalsContact CB-CZ3 3.45Å; W373-I437 HydrophobicContact CB-CB 4.36Å; W373-I437 HydrophobicContact CE3-CG2 4.46Å; W373-I437 PolarHBondContact N-O 2.93Å; W373-I437 PolarHBondContact O-N 3.45Å; W373-F439 HydrophobicContact CH2-CB 4.27Å; W373-F439 HydrophobicContact CZ3-CB 3.66Å; W373-F450 HydrophobicContact CE3-CZ 4.42Å; W373-F450 HydrophobicContact CH2-CE1 4.32Å; W373-F450 AromaticContact CH2-CZ 3.7Å; W373-F450 HydrophobicContact CH2-CZ 3.7Å; W373-F450 HydrophobicContact CZ2-CZ 4.45Å; W373-F450 HydrophobicContact CZ3-CE1 4.36Å; W373-F450 AromaticContact CZ3-CZ 3.69Å; W373-F450 HydrophobicContact CZ3-CZ 3.69Å
374	R	93.9	Very high	87.7	Confident	29 Å²	29	29.2 Å²	29.2	11%	0.109	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	110.7	171.3	-66.4	174.5	-176.3	69	3.6	107.1	C186 T188 E347 T348 L349	C186-R374 PolarHBondContact O-NH2 3.39Å; T188-R374 PolarHBondContact OG1-NE 2.9Å; E347-R374 PolarHBondContact O-N 2.92Å; T348-R374 CarbonylContact C-O 3.48Å; T348-R374 WeakPolarHBondContact CA-O 3.29Å; T348-R374 HydrophobicContact CG2-CB 4.08Å; L349-R374 PolarHBondContact N-O 2.66Å
375	I	94	Very high	88.1	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	126.9	169.7	-55	169	0	0	0	106.9	L349 F356 V377 I383 L385 R434 M435 I437 Y454	L349-I375 HydrophobicContact CB-CG1 4.29Å; L349-I375 HydrophobicContact CD1-CG1 4.15Å; L349-I375 WeakPolarHBondContact O-CA 3.42Å; F356-I375 HydrophobicContact CE1-CD1 4.3Å; I375-V377 HydrophobicContact CG2-CG1 4.03Å; I375-I383 HydrophobicContact CB-CD1 3.93Å; I375-I383 HydrophobicContact CB-CG2 4.41Å; I375-I383 HydrophobicContact CD1-CG2 4Å; I375-I383 HydrophobicContact CG2-CD1 3.58Å; I375-I383 HydrophobicContact CG2-CG1 3.88Å; I375-I383 HydrophobicContact CG2-CG2 3.89Å; I375-L385 HydrophobicContact CD1-CD1 4.34Å; I375-R434 WeakPolarHBondContact O-CA 3.45Å; I375-M435 HydrophobicContact CB-CB 4.3Å; I375-M435 HydrophobicContact CD1-SD 4.47Å; I375-M435 PolarHBondContact N-O 3.06Å; I375-M435 PolarHBondContact O-N 2.66Å; I375-I437 HydrophobicContact CD1-CD1 3.73Å; I375-I437 HydrophobicContact CG1-CD1 4.37Å; I375-Y454 HydrophobicContact CD1-CD1 3.94Å; I375-Y454 HydrophobicContact CD1-CD2 4.24Å; I375-Y454 HydrophobicContact CD1-CG 3.73Å; I375-Y454 HydrophobicContact CG1-CD1 4.32Å; I375-Y454 HydrophobicContact CG1-CG 4.38Å; I375-Y454 HydrophobicContact CG2-CD2 3.62Å; I375-Y454 HydrophobicContact CG2-CE2 3.53Å; I375-Y454 HydrophobicContact CG2-CG 4.19Å
376	S	90.9	Very high	88.3	Confident	6 Å²	6	31.6 Å²	31.6	4%	0.042	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	93.8	-176.3	176.1	0	0	0	0	109.6	L349 Q350 R434	L349-S376 PolarHBondContact O-N 3.35Å; Q350-S376 WeakPolarHBondContact CA-O 3.13Å; S376-R434 PolarHBondContact OG-NH1 3.13Å
377	V	86.9	Confident	88.7	Confident	5 Å²	5	28.4 Å²	28.4	3%	0.03	15%	0.147	C	C	.	.			trans	-94.9	-170.5	179.5	-57.8	0	0	0	0	110	I375 E381 I383 S433 Y454 A456	I375-V377 HydrophobicContact CG2-CG1 4.03Å; V377-E381 HydrophobicContact CB-CB 4.4Å; V377-E381 HydrophobicContact CG2-CB 3.76Å; V377-I383 HydrophobicContact CB-CG1 4.33Å; V377-I383 HydrophobicContact CG1-CD1 4.33Å; V377-I383 HydrophobicContact CG1-CG1 3.8Å; V377-I383 HydrophobicContact CG2-CD1 4.02Å; V377-I383 HydrophobicContact CG2-CG1 3.54Å; V377-S433 WeakPolarHBondContact CG2-O 3.37Å; V377-S433 PolarHBondContact N-O 3.37Å; V377-Y454 HydrophobicContact CG1-CE2 4.32Å; V377-A456 HydrophobicContact CB-CB 3.93Å; V377-A456 HydrophobicContact CG1-CB 3.69Å; V377-A456 HydrophobicContact CG2-CB 4.33Å
378	T	81.6	Confident	89	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.012	15%	0.151	C	C	.	.			trans	-75.3	138.3	-175.2	-36.1	0	0	0	0	110.9	G380 E381 S433 Q470 S471 N473 Y474	T378-G380 PolarHBondContact O-N 3.07Å; T378-E381 WeakPolarHBondContact CA-OE2 3.14Å; T378-E381 WeakPolarHBondContact CB-OE2 2.88Å; T378-E381 PolarHBondContact N-OE2 2.91Å; T378-E381 WeakPolarHBondContact O-CB 3.33Å; T378-E381 PolarHBondContact O-N 3.45Å; T378-E381 PolarHBondContact OG1-OE2 2.78Å; T378-S433 VanDerWaalsContact O-CB 3.28Å; T378-S433 WeakPolarHBondContact O-CB 3.46Å; T378-Q470 HydrophobicContact CG2-CB 3.88Å; T378-Q470 VanDerWaalsContact CG2-OE1 3.23Å; T378-S471 WeakPolarHBondContact CG2-O 3.34Å; T378-N473 VanDerWaalsContact OG1-CA 3.25Å; T378-N473 WeakPolarHBondContact OG1-CA 3.34Å; T378-N473 PolarHBondContact OG1-N 2.74Å; T378-Y474 WeakPolarHBondContact CG2-O 3.33Å
379	P	77.6	Confident	89.4	Confident	40 Å²	40	25 Å²	25	26%	0.26	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	120.6	170.9	-30.2	35.3	0	0	0	113	Q470	P379-Q470 HydrophobicContact CB-CG 4.3Å; P379-Q470 PolarHBondContact O-N 3.27Å
380	G	69.2	Low	89.6	Confident	20 Å²	20	24.8 Å²	24.8	21%	0.206	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	99	-5.9	-173.6	0	0	0	0	0	115	T378 W486	T378-G380 PolarHBondContact O-N 3.07Å; G380-W486 PolarHBondContact O-NE1 3Å
381	E	81.9	Confident	89.6	Confident	4 Å²	4	23.4 Å²	23.4	2%	0.019	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	153.8	163.9	-59.7	-179.3	129	0	0	110.9	V377 T378 D432 S433 A456 I457 C458 P472	V377-E381 HydrophobicContact CB-CB 4.4Å; V377-E381 HydrophobicContact CG2-CB 3.76Å; T378-E381 WeakPolarHBondContact CA-OE2 3.14Å; T378-E381 WeakPolarHBondContact CB-OE2 2.88Å; T378-E381 PolarHBondContact N-OE2 2.91Å; T378-E381 WeakPolarHBondContact O-CB 3.33Å; T378-E381 PolarHBondContact O-N 3.45Å; T378-E381 PolarHBondContact OG1-OE2 2.78Å; E381-D432 CarbonylContact O-C 3.51Å; E381-S433 VanDerWaalsContact O-CA 3.27Å; E381-S433 WeakPolarHBondContact O-CA 3.12Å; E381-S433 PolarHBondContact O-N 3.22Å; E381-A456 HydrophobicContact CB-CB 4.33Å; E381-I457 CarbonylContact C-O 3.43Å; E381-I457 VanDerWaalsContact CA-O 3.28Å; E381-I457 WeakPolarHBondContact CA-O 3.43Å; E381-C458 HydrophobicContact CG-CB 4.2Å; E381-P472 WeakPolarHBondContact OE1-CA 3.27Å; E381-P472 WeakPolarHBondContact OE1-CB 3.5Å
382	K	86.8	Confident	89.6	Confident	64 Å²	64	23.6 Å²	23.6	28%	0.278	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	149.5	170.8	-63.1	175.7	-175.2	170.5	0	109.4	A456 I457	K382-A456 WeakPolarHBondContact O-CA 3.28Å; K382-I457 HydrophobicContact CB-CG1 4.02Å; K382-I457 PolarHBondContact N-O 2.77Å; K382-I457 WeakPolarHBondContact O-CG1 3.33Å; K382-I457 PolarHBondContact O-N 2.79Å
383	I	91.4	Very high	89.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	118	-177.1	-61	155.1	0	0	0	108.4	I375 V377 A429 S430 M435 Y454	I375-I383 HydrophobicContact CB-CD1 3.93Å; I375-I383 HydrophobicContact CB-CG2 4.41Å; I375-I383 HydrophobicContact CD1-CG2 4Å; I375-I383 HydrophobicContact CG2-CD1 3.58Å; I375-I383 HydrophobicContact CG2-CG1 3.88Å; I375-I383 HydrophobicContact CG2-CG2 3.89Å; V377-I383 HydrophobicContact CB-CG1 4.33Å; V377-I383 HydrophobicContact CG1-CD1 4.33Å; V377-I383 HydrophobicContact CG1-CG1 3.8Å; V377-I383 HydrophobicContact CG2-CD1 4.02Å; V377-I383 HydrophobicContact CG2-CG1 3.54Å; I383-A429 CarbonylContact O-C 3.59Å; I383-A429 WeakPolarHBondContact O-CA 3.29Å; I383-S430 WeakPolarHBondContact CB-OG 3.24Å; I383-S430 PolarHBondContact N-OG 2.03Å; I383-S430 PolarHBondContact O-N 3.31Å; I383-S430 PolarHBondContact O-OG 3.44Å; I383-M435 HydrophobicContact CB-CB 4.46Å; I383-M435 HydrophobicContact CB-CE 4.04Å; I383-M435 HydrophobicContact CD1-CB 3.69Å; I383-M435 HydrophobicContact CG2-CB 4.35Å; I383-M435 HydrophobicContact CG2-CE 3.86Å; I383-M435 HydrophobicContact CG2-SD 4.17Å; I383-M435 WeakPolarHBondContact O-CE 3.25Å; I383-Y454 HydrophobicContact CG2-CD2 4.26Å
384	V	90.7	Very high	89	Confident	37 Å²	37	33.4 Å²	33.4	22%	0.224	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.7	168.2	-179.5	0	0	0	0	108.2	V427 L428 Y454 E455 I457	V384-V427 HydrophobicContact CG1-CG1 3.33Å; V384-L428 CarbonylContact C-O 3.51Å; V384-L428 WeakPolarHBondContact CA-O 3.21Å; V384-Y454 CarbonylContact O-C 3.54Å; V384-Y454 WeakPolarHBondContact O-CA 3.43Å; V384-E455 PolarHBondContact N-O 3.42Å; V384-E455 PolarHBondContact O-N 2.9Å; V384-I457 HydrophobicContact CG2-CD1 3.59Å; V384-I457 HydrophobicContact CG2-CG1 3.91Å; V384-I457 HydrophobicContact CG2-CG2 4.06Å
385	L	93.9	Very high	88.8	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.3	179.6	178.5	70.7	0	0	0	110.2	F356 I375 F387 V405 L428 M435 I437 A452	F356-L385 HydrophobicContact CE1-CD1 3.74Å; F356-L385 HydrophobicContact CZ-CD1 3.88Å; I375-L385 HydrophobicContact CD1-CD1 4.34Å; L385-F387 HydrophobicContact CD2-CE2 3.8Å; L385-F387 HydrophobicContact CD2-CZ 3.91Å; L385-F387 HydrophobicContact CG-CE2 4.24Å; L385-V405 HydrophobicContact CD2-CG1 3.98Å; L385-V405 HydrophobicContact CD2-CG2 4.06Å; L385-L428 HydrophobicContact CB-CB 4.44Å; L385-L428 HydrophobicContact CD2-CD1 4.48Å; L385-L428 PolarHBondContact N-O 3.41Å; L385-L428 PolarHBondContact O-N 2.93Å; L385-M435 HydrophobicContact CB-CE 4.2Å; L385-M435 HydrophobicContact CB-SD 3.88Å; L385-M435 HydrophobicContact CD2-SD 3.8Å; L385-M435 HydrophobicContact CG-SD 4.42Å; L385-I437 HydrophobicContact CD1-CD1 4.24Å; L385-I437 HydrophobicContact CD2-CD1 3.65Å; L385-A452 HydrophobicContact CD1-CB 3.92Å
386	N	92.8	Very high	88.3	Confident	69 Å²	69	36.9 Å²	36.9	37%	0.369	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	125.6	179	-173.9	5.9	0	0	0	111	V427 A452 I453	N386-V427 HydrophobicContact CB-CG2 4.4Å; N386-A452 WeakPolarHBondContact O-CA 3.38Å; N386-I453 HydrophobicContact CB-CG2 4.03Å; N386-I453 PolarHBondContact N-O 3.39Å; N386-I453 PolarHBondContact O-N 2.77Å
387	F	94.9	Very high	88	Confident	3 Å²	3	43 Å²	43	1%	0.013	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113.4	175.7	-73.1	-81.7	0	0	0	110.2	L385 I403 V405 L424 P425 L428 F450 A452	L385-F387 HydrophobicContact CD2-CE2 3.8Å; L385-F387 HydrophobicContact CD2-CZ 3.91Å; L385-F387 HydrophobicContact CG-CE2 4.24Å; F387-I403 HydrophobicContact CE1-CD1 3.61Å; F387-I403 HydrophobicContact CZ-CD1 3.69Å; F387-I403 HydrophobicContact CZ-CG1 4.22Å; F387-I403 HydrophobicContact CZ-CG2 4.49Å; F387-V405 HydrophobicContact CE2-CG2 4.32Å; F387-V405 HydrophobicContact CZ-CG2 4.19Å; F387-L424 HydrophobicContact CB-CD2 4.13Å; F387-P425 HydrophobicContact CD2-CB 4.19Å; F387-P425 HydrophobicContact CD2-CG 3.73Å; F387-P425 HydrophobicContact CE2-CG 4.18Å; F387-P425 HydrophobicContact CG-CG 4.37Å; F387-L428 HydrophobicContact CE2-CD1 4.36Å; F387-F450 HydrophobicContact CD1-CD2 4.26Å; F387-F450 AromaticContact CE1-CD2 3.94Å; F387-F450 HydrophobicContact CE1-CD2 3.94Å; F387-F450 HydrophobicContact CE1-CE2 4.4Å; F387-A452 HydrophobicContact CD1-CB 3.76Å; F387-A452 HydrophobicContact CE1-CB 3.86Å; F387-A452 HydrophobicContact CG-CB 4.4Å
388	T	93.5	Very high	88.2	Confident	75 Å²	75	43.5 Å²	43.5	46%	0.46	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-32.8	178.1	65	0	0	0	0	112.2	A451 I453	T388-A451 PolarHBondContact N-O 2.94Å; T388-A451 PolarHBondContact OG1-O 3.22Å; T388-I453 HydrophobicContact CG2-CG2 4.01Å
389	T	93.6	Very high	88.4	Confident	56 Å²	56	51 Å²	51	34%	0.344	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	145.6	178.4	55.5	0	0	0	0	110.1	F361 F450 A451	F361-T389 WeakPolarHBondContact CE2-OG1 3.24Å; F361-T389 HydrophobicContact CZ-CG2 4.47Å; F361-T389 VanDerWaalsContact CZ-OG1 3.24Å; F361-T389 WeakPolarHBondContact CZ-OG1 3.4Å; T389-F450 VanDerWaalsContact O-CA 3.26Å; T389-F450 WeakPolarHBondContact O-CA 3.07Å; T389-F450 WeakPolarHBondContact O-CB 3.47Å; T389-A451 PolarHBondContact N-O 3.4Å; T389-A451 PolarHBondContact O-N 3.41Å; T389-A451 WeakPolarHBondContact OG1-CB 3.41Å; T389-A451 PolarHBondContact OG1-N 3.44Å
390	M	93.2	Very high	89	Confident	12 Å²	12	54.9 Å²	54.9	6%	0.059	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	130.9	172.4	-168.5	176.4	74.2	0	0	109.9	L392 I403 F419 K423 L424 G449 F450	M390-L392 HydrophobicContact CG-CD1 4.11Å; M390-L392 HydrophobicContact CG-CG 3.92Å; M390-L392 HydrophobicContact SD-CD1 4.16Å; M390-I403 HydrophobicContact SD-CG2 4.15Å; M390-F419 HydrophobicContact CE-CB 4.26Å; M390-F419 HydrophobicContact SD-CB 4.12Å; M390-K423 WeakPolarHBondContact CE-O 3.49Å; M390-L424 HydrophobicContact CB-CD2 3.85Å; M390-G449 CarbonylContact C-O 3.59Å; M390-G449 WeakPolarHBondContact CA-O 3.49Å; M390-F450 HydrophobicContact CB-CB 4.36Å; M390-F450 HydrophobicContact CG-CB 4.2Å
391	D	93.1	Very high	90.1	Very high	45 Å²	45	54 Å²	54	24%	0.241	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	86.3	176	175.5	26	0	0	0	107.9	G447 K448 G449	D391-G447 CarbonylContact O-C 3.52Å; D391-G447 WeakPolarHBondContact O-CA 3.43Å; D391-K448 HydrophobicContact CB-CB 4.12Å; D391-K448 PolarHBondContact O-N 3.42Å; D391-K448 WeakPolarHBondContact OD2-CB 3.26Å; D391-K448 WeakPolarHBondContact OD2-CG 3.22Å; D391-K448 PolarHBondContact OD2-N 3.04Å; D391-G449 PolarHBondContact N-O 3.09Å; D391-G449 PolarHBondContact O-N 3.38Å
392	L	91.8	Very high	90.7	Very high	3 Å²	3	54.4 Å²	54.4	2%	0.016	27%	0.268	C	S	.	.			trans	-117.1	154.9	-178.4	-59.4	-176.6	0	0	0	110.8	Y365 M390 K394 I403 G421 F439 F450	Y365-L392 HydrophobicContact CD1-CD2 4.11Å; Y365-L392 HydrophobicContact CE1-CD2 3.58Å; M390-L392 HydrophobicContact CG-CD1 4.11Å; M390-L392 HydrophobicContact CG-CG 3.92Å; M390-L392 HydrophobicContact SD-CD1 4.16Å; L392-K394 PolarHBondContact O-N 3.43Å; L392-I403 HydrophobicContact CD1-CB 4.41Å; L392-I403 HydrophobicContact CD1-CG2 4.09Å; L392-G421 PolarHBondContact N-O 2.74Å; L392-G421 WeakPolarHBondContact O-CA 3.29Å; L392-G421 PolarHBondContact O-N 2.75Å; L392-G421 VanDerWaalsContact O-N 3.12Å; L392-F439 HydrophobicContact CD1-CD2 4.39Å; L392-F439 HydrophobicContact CD1-CE2 3.98Å; L392-F439 HydrophobicContact CD2-CD2 4.49Å; L392-F439 HydrophobicContact CD2-CE2 3.53Å; L392-F439 HydrophobicContact CD2-CZ 3.95Å; L392-F439 HydrophobicContact CG-CE2 4.38Å; L392-F450 HydrophobicContact CD2-CD1 4.48Å
393	Y	89.8	Confident	91	Very high	85 Å²	85	51.3 Å²	51.3	33%	0.333	26%	0.255	S	S	.	.			trans	-57.5	113.9	177.8	-177.6	-106	0	0	0	112.6	Y365 S395 Y400 D401 W445	Y365-Y393 PolarHBondContact OH-N 3.25Å; Y365-Y393 VanDerWaalsContact OH-N 3.12Å; Y393-S395 PolarHBondContact O-N 2.9Å; Y393-Y400 HydrophobicContact CD1-CD2 4.38Å; Y393-Y400 HydrophobicContact CD1-CG 4.42Å; Y393-Y400 AromaticContact CE1-CD2 3.88Å; Y393-Y400 HydrophobicContact CE1-CD2 3.88Å; Y393-Y400 HydrophobicContact CE1-CG 4.24Å; Y393-D401 WeakPolarHBondContact CB-OD2 3.38Å; Y393-W445 HydrophobicContact CD2-CB 4.04Å; Y393-W445 HydrophobicContact CD2-CD2 4.04Å; Y393-W445 AromaticContact CD2-CE3 3.63Å; Y393-W445 HydrophobicContact CD2-CE3 3.63Å; Y393-W445 HydrophobicContact CD2-CG 4.25Å; Y393-W445 HydrophobicContact CD2-CZ3 4.39Å; Y393-W445 HydrophobicContact CE2-CB 4.37Å; Y393-W445 HydrophobicContact CG-CE3 4.23Å
394	K	88.1	Confident	91.2	Very high	145 Å²	145	52.1 Å²	52.1	63%	0.63	26%	0.259	S	S	*	.			trans	-73.5	121.7	-176.3	-167.2	169.8	-168.5	155.1	0	110.8	L392 D422	L392-K394 PolarHBondContact O-N 3.43Å; K394-D422 IonicContact NZ-OD1 3.16Å; K394-D422 PolarHBondContact NZ-OD1 3.02Å; K394-D422 VanDerWaalsContact NZ-OD1 3.16Å
395	S	88	Confident	91.5	Very high	21 Å²	21	50.4 Å²	50.4	15%	0.147	25%	0.248	C	C	.	.			trans	-143.8	154.6	179.5	55.5	0	0	0	0	112.3	Y393 L397 C398 W399 Y400	Y393-S395 PolarHBondContact O-N 2.9Å; S395-L397 PolarHBondContact O-N 3.15Å; S395-C398 PolarHBondContact O-N 2.83Å; S395-C398 VanDerWaalsContact O-N 3.08Å; S395-C398 WeakPolarHBondContact OG-CA 3.47Å; S395-W399 PolarHBondContact OG-N 3.2Å; S395-Y400 PolarHBondContact OG-N 2.8Å
396	S	84.6	Confident	91.7	Very high	82 Å²	82	52.5 Å²	52.5	57%	0.573	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-58	126.7	174.1	51.4	0	0	0	0	110.1	C398	S396-C398 PolarHBondContact O-N 2.95Å; S396-C398 VanDerWaalsContact O-N 3.1Å
397	L	84.4	Confident	91.7	Very high	135 Å²	135	50 Å²	50	71%	0.707	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	56.7	19.2	-176.8	-56.5	171.9	0	0	0	114.6	S395 W399	S395-L397 PolarHBondContact O-N 3.15Å; L397-W399 VanDerWaalsContact C-N 3.29Å; L397-W399 HydrophobicContact CD1-CZ2 3.74Å; L397-W399 PolarHBondContact O-N 2.92Å
398	C	90.8	Very high	91.5	Very high	16 Å²	16	50.4 Å²	50.4	11%	0.108	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	51.4	45.3	179.5	-57.9	0	0	0	0	113.2	S395 S396 Y402 R418 C420	S395-C398 PolarHBondContact O-N 2.83Å; S395-C398 VanDerWaalsContact O-N 3.08Å; S395-C398 WeakPolarHBondContact OG-CA 3.47Å; S396-C398 PolarHBondContact O-N 2.95Å; S396-C398 VanDerWaalsContact O-N 3.1Å; C398-Y402 WeakPolarHBondContact O-CB 3.36Å; C398-Y402 WeakPolarHBondContact O-CD1 3.5Å; C398-R418 HydrophobicContact CB-CG 4.21Å; C398-R418 PolarHBondContact O-NE 2.83Å; C398-R418 VanDerWaalsContact O-NE 3.1Å; C398-R418 PolarHBondContact O-NH2 2.68Å; C398-C420 WeakPolarHBondContact CA-SG 3.25Å; C398-C420 HydrophobicContact CB-CB 3.58Å; C398-C420 WeakPolarHBondContact CB-SG 3.22Å; C398-C420 WeakPolarHBondContact SG-CB 3.42Å; C398-C420 PolarHBondContact SG-N 2.78Å; C398-C420 CovalentContact SG-SG 2.04Å; C398-C420 PolarHBondContact SG-SG 3.23Å
399	W	87.3	Confident	91.3	Very high	160 Å²	160	50.8 Å²	50.8	61%	0.606	24%	0.241	S	C	*	.			trans	-71.1	-35.1	-176.7	-74.8	-24.1	0	0	0	114.4	S395 L397	S395-W399 PolarHBondContact OG-N 3.2Å; L397-W399 VanDerWaalsContact C-N 3.29Å; L397-W399 HydrophobicContact CD1-CZ2 3.74Å; L397-W399 PolarHBondContact O-N 2.92Å
400	Y	88.5	Confident	91	Very high	121 Å²	121	50.3 Å²	50.3	48%	0.475	23%	0.233	S	C	.	.	S	Bend	trans	-88.4	-72.2	-172.7	-69.1	-76.3	0	0	0	113.1	Y393 S395 S442	Y393-Y400 HydrophobicContact CD1-CD2 4.38Å; Y393-Y400 HydrophobicContact CD1-CG 4.42Å; Y393-Y400 AromaticContact CE1-CD2 3.88Å; Y393-Y400 HydrophobicContact CE1-CD2 3.88Å; Y393-Y400 HydrophobicContact CE1-CG 4.24Å; S395-Y400 PolarHBondContact OG-N 2.8Å; Y400-S442 VanDerWaalsContact C-OG 3.32Å; Y400-S442 WeakPolarHBondContact CA-OG 3.22Å; Y400-S442 PolarHBondContact O-N 3.45Å; Y400-S442 PolarHBondContact O-OG 2.54Å
401	D	92.7	Very high	90.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-112	126.1	178.5	-59.8	-3.7	0	0	0	108	Y365 Y393 C420 R440 S441 S442 S443	Y365-D401 VanDerWaalsContact CE2-OD2 3.31Å; Y365-D401 WeakPolarHBondContact CE2-OD2 3.17Å; Y365-D401 PolarHBondContact OH-OD2 2.93Å; Y393-D401 WeakPolarHBondContact CB-OD2 3.38Å; D401-C420 WeakPolarHBondContact O-CB 3.4Å; D401-R440 CarbonylContact C-O 3.57Å; D401-R440 VanDerWaalsContact CA-O 3.26Å; D401-R440 WeakPolarHBondContact CA-O 3.42Å; D401-S441 VanDerWaalsContact OD1-CA 3.22Å; D401-S441 WeakPolarHBondContact OD1-CA 3.4Å; D401-S441 PolarHBondContact OD1-OG 3.47Å; D401-S441 VanDerWaalsContact OD1-OG 3.09Å; D401-S441 PolarHBondContact OD2-OG 2.79Å; D401-S442 PolarHBondContact OD1-N 2.91Å; D401-S443 WeakPolarHBondContact OD1-CB 3.18Å; D401-S443 PolarHBondContact OD1-N 3.45Å; D401-S443 PolarHBondContact OD1-OG 2.8Å; D401-S443 PolarHBondContact OD2-OG 2.92Å
402	Y	93.9	Very high	90.4	Very high	13 Å²	13	63.9 Å²	63.9	5%	0.051	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	154.1	-175.1	66.9	-91.6	0	0	0	112.3	C398 E404 R418 F419 E438 F439 R440	C398-Y402 WeakPolarHBondContact O-CB 3.36Å; C398-Y402 WeakPolarHBondContact O-CD1 3.5Å; Y402-E404 HydrophobicContact CD2-CB 3.84Å; Y402-E404 HydrophobicContact CE2-CB 3.79Å; Y402-R418 HydrophobicContact CD2-CG 4.07Å; Y402-R418 HydrophobicContact CG-CG 4.28Å; Y402-F419 VanDerWaalsContact CA-O 3.32Å; Y402-F419 WeakPolarHBondContact CA-O 3.32Å; Y402-E438 HydrophobicContact CE2-CG 4.47Å; Y402-E438 WeakPolarHBondContact CE2-OE2 3.34Å; Y402-E438 PolarHBondContact OH-OE2 2.82Å; Y402-F439 VanDerWaalsContact O-CD2 3.24Å; Y402-F439 WeakPolarHBondContact O-CD2 3.21Å; Y402-R440 HydrophobicContact CD1-CB 4.28Å; Y402-R440 HydrophobicContact CE1-CB 3.72Å; Y402-R440 HydrophobicContact CE1-CG 4.2Å; Y402-R440 HydrophobicContact CE2-CB 4.18Å; Y402-R440 PolarHBondContact N-O 2.85Å; Y402-R440 PolarHBondContact O-N 3.47Å; Y402-R440 VanDerWaalsContact OH-CD 3.25Å; Y402-R440 WeakPolarHBondContact OH-CD 3.27Å
403	I	94.9	Very high	90.5	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.3	159.2	-177.4	150.5	0	0	0	109.2	F387 M390 L392 V405 R418 F419 I437 E438 F450	F387-I403 HydrophobicContact CE1-CD1 3.61Å; F387-I403 HydrophobicContact CZ-CD1 3.69Å; F387-I403 HydrophobicContact CZ-CG1 4.22Å; F387-I403 HydrophobicContact CZ-CG2 4.49Å; M390-I403 HydrophobicContact SD-CG2 4.15Å; L392-I403 HydrophobicContact CD1-CB 4.41Å; L392-I403 HydrophobicContact CD1-CG2 4.09Å; I403-V405 HydrophobicContact CG1-CG2 4.38Å; I403-R418 CarbonylContact O-C 3.58Å; I403-R418 WeakPolarHBondContact O-CA 3.19Å; I403-F419 HydrophobicContact CG2-CB 3.91Å; I403-F419 HydrophobicContact CG2-CD2 4.23Å; I403-F419 PolarHBondContact N-O 2.85Å; I403-F419 PolarHBondContact O-N 2.87Å; I403-I437 HydrophobicContact CD1-CG2 3.64Å; I403-I437 HydrophobicContact CG1-CG2 3.82Å; I403-E438 CarbonylContact C-O 3.46Å; I403-E438 WeakPolarHBondContact CA-O 3.32Å; I403-F450 HydrophobicContact CD1-CD1 4.17Å; I403-F450 HydrophobicContact CD1-CD2 4.15Å; I403-F450 HydrophobicContact CD1-CE1 3.77Å; I403-F450 HydrophobicContact CD1-CE2 3.77Å; I403-F450 HydrophobicContact CD1-CG 4.36Å; I403-F450 HydrophobicContact CD1-CZ 3.57Å
404	E	95.5	Very high	90.7	Very high	17 Å²	17	64.7 Å²	64.7	8%	0.079	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	120.8	-179	-168.5	174.1	105.7	0	0	109	Y402 R406 L415 R418 I437 E438	Y402-E404 HydrophobicContact CD2-CB 3.84Å; Y402-E404 HydrophobicContact CE2-CB 3.79Å; E404-R406 IonicContact OE1-CZ 3.68Å; E404-R406 IonicContact OE1-NE 2.94Å; E404-R406 PolarHBondContact OE1-NE 2.8Å; E404-R406 IonicContact OE1-NH2 2.74Å; E404-R406 PolarHBondContact OE1-NH2 3Å; E404-R406 IonicContact OE2-NH2 2.69Å; E404-L415 HydrophobicContact CG-CD1 3.42Å; E404-L415 VanDerWaalsContact CG-CD1 3.42Å; E404-R418 HydrophobicContact CG-CB 4.44Å; E404-R418 IonicContact OE2-NH1 3.73Å; E404-R418 PolarHBondContact OE2-NH1 3.2Å; E404-R418 VanDerWaalsContact OE2-NH1 3.14Å; E404-I437 WeakPolarHBondContact O-CA 3.45Å; E404-E438 PolarHBondContact N-O 2.9Å; E404-E438 PolarHBondContact O-N 3.44Å
405	V	97.2	Very high	91	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.5	-176.5	-175.4	0	0	0	0	108.9	L385 F387 I403 L416 G417 F419 L428 M435 I437	L385-V405 HydrophobicContact CD2-CG1 3.98Å; L385-V405 HydrophobicContact CD2-CG2 4.06Å; F387-V405 HydrophobicContact CE2-CG2 4.32Å; F387-V405 HydrophobicContact CZ-CG2 4.19Å; I403-V405 HydrophobicContact CG1-CG2 4.38Å; V405-L416 HydrophobicContact CB-CB 4.48Å; V405-L416 HydrophobicContact CG1-CB 4.32Å; V405-L416 HydrophobicContact CG1-CD1 4.1Å; V405-L416 PolarHBondContact O-N 2.73Å; V405-G417 PolarHBondContact N-O 3.05Å; V405-G417 PolarHBondContact O-N 2.83Å; V405-F419 HydrophobicContact CG2-CE2 4.17Å; V405-L428 HydrophobicContact CB-CD1 3.93Å; V405-L428 HydrophobicContact CG1-CD1 3.88Å; V405-L428 HydrophobicContact CG2-CD1 3.95Å; V405-M435 HydrophobicContact CG1-CG 3.96Å; V405-M435 HydrophobicContact CG1-SD 3.62Å; V405-I437 HydrophobicContact CG1-CG1 4.33Å; V405-I437 HydrophobicContact CG2-CG2 4.4Å
406	R	96.5	Very high	91.3	Very high	44 Å²	44	63.9 Å²	63.9	17%	0.166	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	142.8	-177.5	-64.7	-177	175.4	-88.3	-4.2	112.2	E404 G408 R411 S413 P414 L415 M435 W436	E404-R406 IonicContact OE1-CZ 3.68Å; E404-R406 IonicContact OE1-NE 2.94Å; E404-R406 PolarHBondContact OE1-NE 2.8Å; E404-R406 IonicContact OE1-NH2 2.74Å; E404-R406 PolarHBondContact OE1-NH2 3Å; E404-R406 IonicContact OE2-NH2 2.69Å; R406-G408 PolarHBondContact O-N 3.04Å; R406-R411 PolarHBondContact NE-O 2.88Å; R406-S413 WeakPolarHBondContact CD-O 3.3Å; R406-S413 PolarHBondContact NH1-O 2.64Å; R406-P414 CarbonylContact C-O 3.55Å; R406-P414 WeakPolarHBondContact CA-O 3.46Å; R406-P414 WeakPolarHBondContact CB-O 3.42Å; R406-L415 HydrophobicContact CG-CD1 4.21Å; R406-M435 WeakPolarHBondContact O-CG 3.18Å; R406-W436 HydrophobicContact CB-CB 4.37Å; R406-W436 HydrophobicContact CB-CE3 4.11Å; R406-W436 HydrophobicContact CG-CE3 3.94Å; R406-W436 HydrophobicContact CG-CZ3 4.29Å; R406-W436 PolarHBondContact N-O 3.49Å; R406-W436 PolarHBondContact O-N 3.28Å
407	D	93.7	Very high	91.7	Very high	18 Å²	18	60.5 Å²	60.5	10%	0.096	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	87.2	-178	-172.7	25.5	0	0	0	110.8	S413 P414 L416 S430 T431	D407-S413 WeakPolarHBondContact O-CB 3.36Å; D407-P414 HydrophobicContact CB-CB 4.36Å; D407-P414 PolarHBondContact N-O 3Å; D407-P414 WeakPolarHBondContact O-CD 3.49Å; D407-L416 HydrophobicContact CB-CD1 4.04Å; D407-L416 HydrophobicContact CB-CD2 3.95Å; D407-L416 HydrophobicContact CB-CG 3.85Å; D407-S430 WeakPolarHBondContact OD1-CA 3.48Å; D407-S430 WeakPolarHBondContact OD1-CB 3.36Å; D407-T431 PolarHBondContact OD1-N 2.87Å; D407-T431 PolarHBondContact OD1-OG1 2.69Å; D407-T431 WeakPolarHBondContact OD2-CB 3.23Å; D407-T431 WeakPolarHBondContact OD2-CG2 3.25Å; D407-T431 PolarHBondContact OD2-N 2.76Å; D407-T431 PolarHBondContact OD2-OG1 2.68Å
408	G	91.3	Very high	92.2	Very high	11 Å²	11	57.9 Å²	57.9	11%	0.113	26%	0.261	C	S	.	.	S	Bend	trans	142	-163.4	-176.4	0	0	0	0	0	113.2	R406 R434 M435 W436	R406-G408 PolarHBondContact O-N 3.04Å; G408-R434 VanDerWaalsContact CA-O 3.29Å; G408-R434 WeakPolarHBondContact CA-O 3.34Å; G408-R434 PolarHBondContact N-O 2.85Å; G408-R434 CarbonylContact O-C 3.5Å; G408-M435 CarbonylContact O-C 3.59Å; G408-M435 VanDerWaalsContact O-C 3.23Å; G408-M435 VanDerWaalsContact O-CA 3.31Å; G408-M435 WeakPolarHBondContact O-CA 3.24Å; G408-M435 PolarHBondContact O-N 3.27Å; G408-W436 WeakPolarHBondContact O-CB 3.28Å; G408-W436 PolarHBondContact O-N 2.85Å
409	Y	88.7	Confident	92.4	Very high	82 Å²	82	59.2 Å²	59.2	32%	0.322	26%	0.264	S	S	.	.	S	Bend	trans	-93.9	-7.1	-167.9	62.1	-92.5	0	0	0	115.5	V157 I190 S413	V157-Y409 HydrophobicContact CG1-CE2 4.34Å; V157-Y409 HydrophobicContact CG2-CD2 3.81Å; V157-Y409 HydrophobicContact CG2-CE2 3.74Å; I190-Y409 HydrophobicContact CD1-CE1 4.21Å; I190-Y409 HydrophobicContact CD1-CE2 3.98Å; I190-Y409 WeakPolarHBondContact CD1-OH 3.33Å; I190-Y409 HydrophobicContact CG2-CD1 4.06Å; I190-Y409 HydrophobicContact CG2-CD2 3.99Å; I190-Y409 HydrophobicContact CG2-CE1 4.19Å; I190-Y409 HydrophobicContact CG2-CE2 4.15Å; I190-Y409 HydrophobicContact CG2-CG 3.97Å; Y409-S413 PolarHBondContact N-OG 2.81Å
410	W	86.3	Confident	92.7	Very high	47 Å²	47	52.5 Å²	52.5	18%	0.178	24%	0.242	C	C	.	.	S	Bend	trans	-152.1	163	-169.3	-170	-81.2	0	0	0	114.7	P154 G155 V157 K412 S413	P154-W410 VanDerWaalsContact O-CH2 3.24Å; P154-W410 WeakPolarHBondContact O-CH2 3.02Å; G155-W410 WeakPolarHBondContact O-CH2 3.36Å; G155-W410 WeakPolarHBondContact O-CZ3 3.37Å; V157-W410 HydrophobicContact CB-CE3 4.17Å; V157-W410 HydrophobicContact CB-CH2 4.45Å; V157-W410 HydrophobicContact CB-CZ3 3.66Å; V157-W410 HydrophobicContact CG2-CE3 3.4Å; V157-W410 HydrophobicContact CG2-CZ3 3.36Å; W410-K412 PolarHBondContact O-N 2.8Å; W410-S413 PolarHBondContact N-OG 2.95Å; W410-S413 WeakPolarHBondContact O-CB 3.03Å; W410-S413 PolarHBondContact O-N 2.95Å; W410-S413 PolarHBondContact O-OG 3Å; W410-S413 VanDerWaalsContact O-OG 3.14Å
411	R	87	Confident	92.8	Very high	161 Å²	161	46.9 Å²	46.9	61%	0.608	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-7.8	175	96	-158.3	175	177.8	-4.1	117.7	R406 W436	R406-R411 PolarHBondContact NE-O 2.88Å; R411-W436 HydrophobicContact CB-CH2 3.5Å; R411-W436 HydrophobicContact CB-CZ2 3.5Å; R411-W436 HydrophobicContact CB-CZ3 4.16Å
412	K	88.4	Confident	92.7	Very high	181 Å²	181	51.7 Å²	51.7	79%	0.787	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-16.1	-179.8	-83.2	-168.1	173.9	-173.6	0	111.8	W410	W410-K412 PolarHBondContact O-N 2.8Å
413	S	92	Very high	92.6	Very high	16 Å²	16	59 Å²	59	11%	0.112	28%	0.278	C	S	.	.	S	Bend	trans	-60	155	176.1	-62	0	0	0	0	111.4	R406 D407 Y409 W410	R406-S413 WeakPolarHBondContact CD-O 3.3Å; R406-S413 PolarHBondContact NH1-O 2.64Å; D407-S413 WeakPolarHBondContact O-CB 3.36Å; Y409-S413 PolarHBondContact N-OG 2.81Å; W410-S413 PolarHBondContact N-OG 2.95Å; W410-S413 WeakPolarHBondContact O-CB 3.03Å; W410-S413 PolarHBondContact O-N 2.95Å; W410-S413 PolarHBondContact O-OG 3Å; W410-S413 VanDerWaalsContact O-OG 3.14Å
414	P	95	Very high	92.4	Very high	89 Å²	89	62.7 Å²	62.7	58%	0.578	30%	0.297	S	S	*	.	P	Polyproline II helix	trans	-48	140.4	178.9	-28.9	34.6	0	0	0	113.2	R406 D407	R406-P414 CarbonylContact C-O 3.55Å; R406-P414 WeakPolarHBondContact CA-O 3.46Å; R406-P414 WeakPolarHBondContact CB-O 3.42Å; D407-P414 HydrophobicContact CB-CB 4.36Å; D407-P414 PolarHBondContact N-O 3Å; D407-P414 WeakPolarHBondContact O-CD 3.49Å
415	L	94.7	Very high	92.2	Very high	90 Å²	90	62.7 Å²	62.7	47%	0.471	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.8	-179	179.7	67.6	0	0	0	109.8	E404 R406 G417	E404-L415 HydrophobicContact CG-CD1 3.42Å; E404-L415 VanDerWaalsContact CG-CD1 3.42Å; R406-L415 HydrophobicContact CG-CD1 4.21Å; L415-G417 WeakPolarHBondContact CD1-O 3.44Å
416	L	94.6	Very high	91.8	Very high	58 Å²	58	70.7 Å²	70.7	30%	0.304	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-37.6	170.3	-66.6	176.6	0	0	0	110.7	V405 D407 M435	V405-L416 HydrophobicContact CB-CB 4.48Å; V405-L416 HydrophobicContact CG1-CB 4.32Å; V405-L416 HydrophobicContact CG1-CD1 4.1Å; V405-L416 PolarHBondContact O-N 2.73Å; D407-L416 HydrophobicContact CB-CD1 4.04Å; D407-L416 HydrophobicContact CB-CD2 3.95Å; D407-L416 HydrophobicContact CB-CG 3.85Å; L416-M435 HydrophobicContact CD1-CE 3.98Å
417	G	92.9	Very high	91.4	Very high	11 Å²	11	72.7 Å²	72.7	11%	0.113	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174	168.4	170.1	0	0	0	0	0	114.2	V405 L415 F419	V405-G417 PolarHBondContact N-O 3.05Å; V405-G417 PolarHBondContact O-N 2.83Å; L415-G417 WeakPolarHBondContact CD1-O 3.44Å; G417-F419 VanDerWaalsContact C-CE2 3.48Å
418	R	94.9	Very high	91.3	Very high	81 Å²	81	73 Å²	73	31%	0.306	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	123.7	176.7	-179	177.2	174	141.1	-8.7	108.8	C398 Y402 I403 E404	C398-R418 HydrophobicContact CB-CG 4.21Å; C398-R418 PolarHBondContact O-NE 2.83Å; C398-R418 VanDerWaalsContact O-NE 3.1Å; C398-R418 PolarHBondContact O-NH2 2.68Å; Y402-R418 HydrophobicContact CD2-CG 4.07Å; Y402-R418 HydrophobicContact CG-CG 4.28Å; I403-R418 CarbonylContact O-C 3.58Å; I403-R418 WeakPolarHBondContact O-CA 3.19Å; E404-R418 HydrophobicContact CG-CB 4.44Å; E404-R418 IonicContact OE2-NH1 3.73Å; E404-R418 PolarHBondContact OE2-NH1 3.2Å; E404-R418 VanDerWaalsContact OE2-NH1 3.14Å
419	F	94.8	Very high	91.2	Very high	43 Å²	43	75.1 Å²	75.1	19%	0.189	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.9	-165.7	-43.2	-81.2	0	0	0	111.6	M390 Y402 I403 V405 G417 P425 L428	M390-F419 HydrophobicContact CE-CB 4.26Å; M390-F419 HydrophobicContact SD-CB 4.12Å; Y402-F419 VanDerWaalsContact CA-O 3.32Å; Y402-F419 WeakPolarHBondContact CA-O 3.32Å; I403-F419 HydrophobicContact CG2-CB 3.91Å; I403-F419 HydrophobicContact CG2-CD2 4.23Å; I403-F419 PolarHBondContact N-O 2.85Å; I403-F419 PolarHBondContact O-N 2.87Å; V405-F419 HydrophobicContact CG2-CE2 4.17Å; G417-F419 VanDerWaalsContact C-CE2 3.48Å; F419-P425 HydrophobicContact CB-CG 4.04Å; F419-P425 HydrophobicContact CD1-CB 3.95Å; F419-P425 HydrophobicContact CD1-CG 3.57Å; F419-P425 HydrophobicContact CD2-CB 4.49Å; F419-P425 HydrophobicContact CD2-CG 3.82Å; F419-P425 HydrophobicContact CE1-CB 3.74Å; F419-P425 HydrophobicContact CE1-CG 3.88Å; F419-P425 HydrophobicContact CE2-CB 4.33Å; F419-P425 HydrophobicContact CE2-CG 4.13Å; F419-P425 HydrophobicContact CG-CB 4.31Å; F419-P425 HydrophobicContact CG-CG 3.52Å; F419-P425 HydrophobicContact CZ-CB 3.93Å; F419-P425 HydrophobicContact CZ-CG 4.14Å; F419-L428 HydrophobicContact CE2-CD1 3.72Å; F419-L428 HydrophobicContact CZ-CD1 3.91Å; F419-L428 HydrophobicContact CZ-CD2 4.19Å
420	C	93	Very high	91.4	Very high	20 Å²	20	71.5 Å²	71.5	14%	0.135	36%	0.358	C	S	.	.			trans	-160.2	169.3	177.4	64.7	0	0	0	0	109.7	C398 D401	C398-C420 WeakPolarHBondContact CA-SG 3.25Å; C398-C420 HydrophobicContact CB-CB 3.58Å; C398-C420 WeakPolarHBondContact CB-SG 3.22Å; C398-C420 WeakPolarHBondContact SG-CB 3.42Å; C398-C420 PolarHBondContact SG-N 2.78Å; C398-C420 CovalentContact SG-SG 2.04Å; C398-C420 PolarHBondContact SG-SG 3.23Å; D401-C420 WeakPolarHBondContact O-CB 3.4Å
421	G	91.4	Very high	91.4	Very high	2 Å²	2	74.1 Å²	74.1	2%	0.021	38%	0.379	C	S	.	.	S	Bend	trans	80.9	-150.5	-171.3	0	0	0	0	0	112.5	L392	L392-G421 PolarHBondContact N-O 2.74Å; L392-G421 WeakPolarHBondContact O-CA 3.29Å; L392-G421 PolarHBondContact O-N 2.75Å; L392-G421 VanDerWaalsContact O-N 3.12Å
422	D	90.8	Very high	91.4	Very high	101 Å²	101	69.7 Å²	69.7	54%	0.54	37%	0.368	S	S	.	.	S	Bend	trans	-110.3	-13.6	-169.3	54.8	-28.4	0	0	0	113.9	K394 L424	K394-D422 IonicContact NZ-OD1 3.16Å; K394-D422 PolarHBondContact NZ-OD1 3.02Å; K394-D422 VanDerWaalsContact NZ-OD1 3.16Å; D422-L424 PolarHBondContact O-N 3.14Å
423	K	91.1	Very high	91.3	Very high	168 Å²	168	61.5 Å²	61.5	73%	0.73	33%	0.333	S	S	*	.			trans	-80.1	111.1	-178.7	-173.5	-168.6	173.8	-170.2	0	110.7	M390	M390-K423 WeakPolarHBondContact CE-O 3.49Å
424	L	90.3	Very high	91.3	Very high	76 Å²	76	63.1 Å²	63.1	40%	0.398	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-54.6	135.1	172.4	-62.3	179	0	0	0	111.7	F387 M390 D422	F387-L424 HydrophobicContact CB-CD2 4.13Å; M390-L424 HydrophobicContact CB-CD2 3.85Å; D422-L424 PolarHBondContact O-N 3.14Å
425	P	91.3	Very high	91.3	Very high	18 Å²	18	59 Å²	59	12%	0.117	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-62.1	160.3	167.4	-23.1	35.6	0	0	0	112.5	F387 F419	F387-P425 HydrophobicContact CD2-CB 4.19Å; F387-P425 HydrophobicContact CD2-CG 3.73Å; F387-P425 HydrophobicContact CE2-CG 4.18Å; F387-P425 HydrophobicContact CG-CG 4.37Å; F419-P425 HydrophobicContact CB-CG 4.04Å; F419-P425 HydrophobicContact CD1-CB 3.95Å; F419-P425 HydrophobicContact CD1-CG 3.57Å; F419-P425 HydrophobicContact CD2-CB 4.49Å; F419-P425 HydrophobicContact CD2-CG 3.82Å; F419-P425 HydrophobicContact CE1-CB 3.74Å; F419-P425 HydrophobicContact CE1-CG 3.88Å; F419-P425 HydrophobicContact CE2-CB 4.33Å; F419-P425 HydrophobicContact CE2-CG 4.13Å; F419-P425 HydrophobicContact CG-CB 4.31Å; F419-P425 HydrophobicContact CG-CG 3.52Å; F419-P425 HydrophobicContact CZ-CB 3.93Å; F419-P425 HydrophobicContact CZ-CG 4.14Å
426	E	88.5	Confident	91.3	Very high	168 Å²	168	55.1 Å²	55.1	79%	0.785	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-67.9	159.6	161	-70.6	174	-163.1	0	0	110.1	L428	E426-L428 PolarHBondContact O-N 3.21Å
427	V	88.3	Confident	91.4	Very high	86 Å²	86	52.4 Å²	52.4	52%	0.521	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-61	124.5	-179.1	178.3	0	0	0	0	109.7	V384 N386	V384-V427 HydrophobicContact CG1-CG1 3.33Å; N386-V427 HydrophobicContact CB-CG2 4.4Å
428	L	91.9	Very high	91.5	Very high	23 Å²	23	52.9 Å²	52.9	12%	0.12	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	138.5	-177.3	-56.3	176.9	0	0	0	109.6	V384 L385 F387 V405 F419 E426	V384-L428 CarbonylContact C-O 3.51Å; V384-L428 WeakPolarHBondContact CA-O 3.21Å; L385-L428 HydrophobicContact CB-CB 4.44Å; L385-L428 HydrophobicContact CD2-CD1 4.48Å; L385-L428 PolarHBondContact N-O 3.41Å; L385-L428 PolarHBondContact O-N 2.93Å; F387-L428 HydrophobicContact CE2-CD1 4.36Å; V405-L428 HydrophobicContact CB-CD1 3.93Å; V405-L428 HydrophobicContact CG1-CD1 3.88Å; V405-L428 HydrophobicContact CG2-CD1 3.95Å; F419-L428 HydrophobicContact CE2-CD1 3.72Å; F419-L428 HydrophobicContact CZ-CD1 3.91Å; F419-L428 HydrophobicContact CZ-CD2 4.19Å; E426-L428 PolarHBondContact O-N 3.21Å
429	A	89.9	Confident	91.5	Very high	57 Å²	57	49 Å²	49	47%	0.471	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.7	172.9	0	0	0	0	0	110	I383	I383-A429 CarbonylContact O-C 3.59Å; I383-A429 WeakPolarHBondContact O-CA 3.29Å
430	S	92.4	Very high	91.4	Very high	5 Å²	5	52.8 Å²	52.8	4%	0.035	27%	0.272	C	S	.	.			trans	-79.2	158.6	167.8	60.1	0	0	0	0	111.7	I383 D407 D432	I383-S430 WeakPolarHBondContact CB-OG 3.24Å; I383-S430 PolarHBondContact N-OG 2.03Å; I383-S430 PolarHBondContact O-N 3.31Å; I383-S430 PolarHBondContact O-OG 3.44Å; D407-S430 WeakPolarHBondContact OD1-CA 3.48Å; D407-S430 WeakPolarHBondContact OD1-CB 3.36Å; S430-D432 VanDerWaalsContact CB-O 3.26Å; S430-D432 WeakPolarHBondContact CB-O 3.48Å; S430-D432 PolarHBondContact OG-O 2.83Å
431	T	86.9	Confident	91.3	Very high	102 Å²	102	52 Å²	52	63%	0.626	27%	0.267	S	S	*	.	S	Bend	trans	-80.8	-23.6	170.4	56.6	0	0	0	0	112.6	D407	D407-T431 PolarHBondContact OD1-N 2.87Å; D407-T431 PolarHBondContact OD1-OG1 2.69Å; D407-T431 WeakPolarHBondContact OD2-CB 3.23Å; D407-T431 WeakPolarHBondContact OD2-CG2 3.25Å; D407-T431 PolarHBondContact OD2-N 2.76Å; D407-T431 PolarHBondContact OD2-OG1 2.68Å
432	D	85.6	Confident	91.1	Very high	68 Å²	68	53.8 Å²	53.8	36%	0.364	28%	0.28	S	S	.	.	S	Bend	trans	-138.7	-175.5	-176.1	-148.4	-47.1	0	0	0	111.5	E381 S430 R434 K464	E381-D432 CarbonylContact O-C 3.51Å; S430-D432 VanDerWaalsContact CB-O 3.26Å; S430-D432 WeakPolarHBondContact CB-O 3.48Å; S430-D432 PolarHBondContact OG-O 2.83Å; D432-R434 VanDerWaalsContact C-N 3.26Å; D432-R434 PolarHBondContact O-N 2.8Å; D432-K464 IonicContact OD2-NZ 3.17Å
433	S	87.1	Confident	90.6	Very high	9 Å²	9	49.4 Å²	49.4	6%	0.063	26%	0.257	C	S	.	.	S	Bend	trans	-73.1	6	-173.8	53.6	0	0	0	0	116.7	V377 T378 E381	V377-S433 WeakPolarHBondContact CG2-O 3.37Å; V377-S433 PolarHBondContact N-O 3.37Å; T378-S433 VanDerWaalsContact O-CB 3.28Å; T378-S433 WeakPolarHBondContact O-CB 3.46Å; E381-S433 VanDerWaalsContact O-CA 3.27Å; E381-S433 WeakPolarHBondContact O-CA 3.12Å; E381-S433 PolarHBondContact O-N 3.22Å
434	R	91.5	Very high	90	Very high	50 Å²	50	47.8 Å²	47.8	19%	0.189	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.8	-178	-56.2	-73.6	-164	152.2	11.9	110.8	E182 F189 I375 S376 G408 D432	E182-R434 IonicContact OE1-CZ 2.69Å; E182-R434 IonicContact OE1-NH1 2.68Å; E182-R434 PolarHBondContact OE1-NH1 2.82Å; E182-R434 VanDerWaalsContact OE1-NH1 3.09Å; E182-R434 IonicContact OE1-NH2 3.16Å; E182-R434 PolarHBondContact OE1-NH2 3.06Å; E182-R434 IonicContact OE2-CZ 3.72Å; E182-R434 IonicContact OE2-NH1 3.7Å; E182-R434 PolarHBondContact OE2-NH1 2.88Å; E182-R434 IonicContact OE2-NH2 2.77Å; F189-R434 PolarHBondContact O-NH2 3.33Å; I375-R434 WeakPolarHBondContact O-CA 3.45Å; S376-R434 PolarHBondContact OG-NH1 3.13Å; G408-R434 VanDerWaalsContact CA-O 3.29Å; G408-R434 WeakPolarHBondContact CA-O 3.34Å; G408-R434 PolarHBondContact N-O 2.85Å; G408-R434 CarbonylContact O-C 3.5Å; D432-R434 VanDerWaalsContact C-N 3.26Å; D432-R434 PolarHBondContact O-N 2.8Å
435	M	94.9	Very high	89.3	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	133.5	172.1	-171	-176.1	-73.1	0	0	110.5	I375 I383 L385 V405 R406 G408 L416 I437	I375-M435 HydrophobicContact CB-CB 4.3Å; I375-M435 HydrophobicContact CD1-SD 4.47Å; I375-M435 PolarHBondContact N-O 3.06Å; I375-M435 PolarHBondContact O-N 2.66Å; I383-M435 HydrophobicContact CB-CB 4.46Å; I383-M435 HydrophobicContact CB-CE 4.04Å; I383-M435 HydrophobicContact CD1-CB 3.69Å; I383-M435 HydrophobicContact CG2-CB 4.35Å; I383-M435 HydrophobicContact CG2-CE 3.86Å; I383-M435 HydrophobicContact CG2-SD 4.17Å; I383-M435 WeakPolarHBondContact O-CE 3.25Å; L385-M435 HydrophobicContact CB-CE 4.2Å; L385-M435 HydrophobicContact CB-SD 3.88Å; L385-M435 HydrophobicContact CD2-SD 3.8Å; L385-M435 HydrophobicContact CG-SD 4.42Å; V405-M435 HydrophobicContact CG1-CG 3.96Å; V405-M435 HydrophobicContact CG1-SD 3.62Å; R406-M435 WeakPolarHBondContact O-CG 3.18Å; G408-M435 CarbonylContact O-C 3.59Å; G408-M435 VanDerWaalsContact O-C 3.23Å; G408-M435 VanDerWaalsContact O-CA 3.31Å; G408-M435 WeakPolarHBondContact O-CA 3.24Å; G408-M435 PolarHBondContact O-N 3.27Å; L416-M435 HydrophobicContact CD1-CE 3.98Å; M435-I437 HydrophobicContact CG-CG1 4.3Å; M435-I437 HydrophobicContact SD-CD1 4.26Å; M435-I437 HydrophobicContact SD-CG1 4.5Å
436	W	95.4	Very high	88.7	Confident	10 Å²	10	52.9 Å²	52.9	4%	0.038	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	128.1	-176.8	-178.4	96.5	0	0	0	110	I372 R406 G408 R411 E438	I372-W436 HydrophobicContact CD1-CZ2 3.87Å; I372-W436 HydrophobicContact CG1-CZ2 4.42Å; I372-W436 HydrophobicContact CG2-CD2 4.45Å; I372-W436 HydrophobicContact CG2-CZ2 4.21Å; R406-W436 HydrophobicContact CB-CB 4.37Å; R406-W436 HydrophobicContact CB-CE3 4.11Å; R406-W436 HydrophobicContact CG-CE3 3.94Å; R406-W436 HydrophobicContact CG-CZ3 4.29Å; R406-W436 PolarHBondContact N-O 3.49Å; R406-W436 PolarHBondContact O-N 3.28Å; G408-W436 WeakPolarHBondContact O-CB 3.28Å; G408-W436 PolarHBondContact O-N 2.85Å; R411-W436 HydrophobicContact CB-CH2 3.5Å; R411-W436 HydrophobicContact CB-CZ2 3.5Å; R411-W436 HydrophobicContact CB-CZ3 4.16Å; W436-E438 HydrophobicContact CE3-CB 4.31Å; W436-E438 HydrophobicContact CH2-CB 3.35Å; W436-E438 HydrophobicContact CH2-CG 4.15Å; W436-E438 HydrophobicContact CZ2-CB 4.04Å; W436-E438 HydrophobicContact CZ3-CB 3.49Å; W436-E438 VanDerWaalsContact CZ3-CB 3.49Å
437	I	95.9	Very high	88.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.8	-171.7	-54.2	178.5	0	0	0	109	F356 I372 W373 I375 L385 I403 E404 V405 M435	F356-I437 HydrophobicContact CE1-CD1 4.33Å; F356-I437 HydrophobicContact CE2-CD1 4.26Å; F356-I437 HydrophobicContact CE2-CG2 4.47Å; F356-I437 HydrophobicContact CZ-CD1 3.54Å; I372-I437 CarbonylContact C-O 3.57Å; I372-I437 VanDerWaalsContact CA-O 3.29Å; I372-I437 WeakPolarHBondContact CA-O 3.41Å; W373-I437 HydrophobicContact CB-CB 4.36Å; W373-I437 HydrophobicContact CE3-CG2 4.46Å; W373-I437 PolarHBondContact N-O 2.93Å; W373-I437 PolarHBondContact O-N 3.45Å; I375-I437 HydrophobicContact CD1-CD1 3.73Å; I375-I437 HydrophobicContact CG1-CD1 4.37Å; L385-I437 HydrophobicContact CD1-CD1 4.24Å; L385-I437 HydrophobicContact CD2-CD1 3.65Å; I403-I437 HydrophobicContact CD1-CG2 3.64Å; I403-I437 HydrophobicContact CG1-CG2 3.82Å; E404-I437 WeakPolarHBondContact O-CA 3.45Å; V405-I437 HydrophobicContact CG1-CG1 4.33Å; V405-I437 HydrophobicContact CG2-CG2 4.4Å; M435-I437 HydrophobicContact CG-CG1 4.3Å; M435-I437 HydrophobicContact SD-CD1 4.26Å; M435-I437 HydrophobicContact SD-CG1 4.5Å
438	E	95.1	Very high	88.6	Confident	21 Å²	21	47.2 Å²	47.2	10%	0.098	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	126.4	172.9	172.3	176	-88.6	0	0	110.2	H370 Y402 I403 E404 W436	H370-E438 IonicContact CD2-OE1 2.98Å; H370-E438 IonicContact CE1-OE1 2.63Å; H370-E438 IonicContact NE2-OE1 3.07Å; H370-E438 PolarHBondContact NE2-OE1 3.05Å; Y402-E438 HydrophobicContact CE2-CG 4.47Å; Y402-E438 WeakPolarHBondContact CE2-OE2 3.34Å; Y402-E438 PolarHBondContact OH-OE2 2.82Å; I403-E438 CarbonylContact C-O 3.46Å; I403-E438 WeakPolarHBondContact CA-O 3.32Å; E404-E438 PolarHBondContact N-O 2.9Å; E404-E438 PolarHBondContact O-N 3.44Å; W436-E438 HydrophobicContact CE3-CB 4.31Å; W436-E438 HydrophobicContact CH2-CB 3.35Å; W436-E438 HydrophobicContact CH2-CG 4.15Å; W436-E438 HydrophobicContact CZ2-CB 4.04Å; W436-E438 HydrophobicContact CZ3-CB 3.49Å; W436-E438 VanDerWaalsContact CZ3-CB 3.49Å
439	F	94.7	Very high	88.6	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129	161.2	175.9	-117.9	0	0	0	109.2	Y365 T369 C371 W373 L392 Y402 F450	Y365-F439 HydrophobicContact CD1-CZ 4.17Å; Y365-F439 HydrophobicContact CD2-CE1 4.05Å; Y365-F439 AromaticContact CD2-CZ 3.67Å; Y365-F439 HydrophobicContact CD2-CZ 3.67Å; Y365-F439 HydrophobicContact CE1-CZ 4.38Å; Y365-F439 AromaticContact CE2-CZ 3.93Å; Y365-F439 HydrophobicContact CE2-CZ 3.93Å; Y365-F439 HydrophobicContact CG-CE1 4.1Å; Y365-F439 AromaticContact CG-CZ 3.8Å; Y365-F439 HydrophobicContact CG-CZ 3.8Å; T369-F439 HydrophobicContact CG2-CD1 4.28Å; T369-F439 HydrophobicContact CG2-CE1 4.29Å; C371-F439 HydrophobicContact CB-CB 4.43Å; C371-F439 PolarHBondContact N-O 2.82Å; C371-F439 PolarHBondContact O-N 3.05Å; W373-F439 HydrophobicContact CH2-CB 4.27Å; W373-F439 HydrophobicContact CZ3-CB 3.66Å; L392-F439 HydrophobicContact CD1-CD2 4.39Å; L392-F439 HydrophobicContact CD1-CE2 3.98Å; L392-F439 HydrophobicContact CD2-CD2 4.49Å; L392-F439 HydrophobicContact CD2-CE2 3.53Å; L392-F439 HydrophobicContact CD2-CZ 3.95Å; L392-F439 HydrophobicContact CG-CE2 4.38Å; Y402-F439 VanDerWaalsContact O-CD2 3.24Å; Y402-F439 WeakPolarHBondContact O-CD2 3.21Å; F439-F450 HydrophobicContact CB-CE1 3.92Å; F439-F450 HydrophobicContact CB-CZ 4.4Å; F439-F450 HydrophobicContact CD1-CE1 4.31Å; F439-F450 HydrophobicContact CD2-CD1 4.31Å; F439-F450 AromaticContact CD2-CE1 3.89Å; F439-F450 HydrophobicContact CD2-CE1 3.89Å; F439-F450 AromaticContact CG-CE1 3.77Å; F439-F450 HydrophobicContact CG-CE1 3.77Å
440	R	92.5	Very high	88.8	Confident	122 Å²	122	43.5 Å²	43.5	46%	0.46	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	128.6	175.1	-169	174.4	-179	173.4	-2.3	109.7	T369 D401 Y402	T369-R440 WeakPolarHBondContact O-CA 3.49Å; D401-R440 CarbonylContact C-O 3.57Å; D401-R440 VanDerWaalsContact CA-O 3.26Å; D401-R440 WeakPolarHBondContact CA-O 3.42Å; Y402-R440 HydrophobicContact CD1-CB 4.28Å; Y402-R440 HydrophobicContact CE1-CB 3.72Å; Y402-R440 HydrophobicContact CE1-CG 4.2Å; Y402-R440 HydrophobicContact CE2-CB 4.18Å; Y402-R440 PolarHBondContact N-O 2.85Å; Y402-R440 PolarHBondContact O-N 3.47Å; Y402-R440 VanDerWaalsContact OH-CD 3.25Å; Y402-R440 WeakPolarHBondContact OH-CD 3.27Å
441	S	91.3	Very high	88.9	Confident	4 Å²	4	44 Å²	44	3%	0.028	22%	0.219	C	C	.	.			trans	-107.9	142.6	164.8	171.7	0	0	0	0	109.4	Y368 T369 D401	Y368-S441 CarbonylContact C-O 3.57Å; Y368-S441 VanDerWaalsContact CA-O 3.27Å; Y368-S441 WeakPolarHBondContact CA-O 3.47Å; T369-S441 PolarHBondContact O-N 2.87Å; D401-S441 VanDerWaalsContact OD1-CA 3.22Å; D401-S441 WeakPolarHBondContact OD1-CA 3.4Å; D401-S441 PolarHBondContact OD1-OG 3.47Å; D401-S441 VanDerWaalsContact OD1-OG 3.09Å; D401-S441 PolarHBondContact OD2-OG 2.79Å
442	S	86.9	Confident	89.3	Confident	40 Å²	40	39.2 Å²	39.2	28%	0.28	19%	0.19	S	C	.	.			trans	-142.4	-0.6	171.1	62.4	0	0	0	0	113.3	Y368 Y400 D401	Y368-S442 VanDerWaalsContact CE1-O 3.25Å; Y368-S442 WeakPolarHBondContact CE1-O 3.22Å; Y400-S442 VanDerWaalsContact C-OG 3.32Å; Y400-S442 WeakPolarHBondContact CA-OG 3.22Å; Y400-S442 PolarHBondContact O-N 3.45Å; Y400-S442 PolarHBondContact O-OG 2.54Å; D401-S442 PolarHBondContact OD1-N 2.91Å
443	S	80.2	Confident	89.8	Confident	9 Å²	9	39.8 Å²	39.8	6%	0.063	19%	0.192	C	C	.	.	S	Bend	trans	-85.1	160.4	174.7	95.1	0	0	0	0	112.3	S367 D401 W445	S367-S443 WeakPolarHBondContact CB-O 3.39Å; D401-S443 WeakPolarHBondContact OD1-CB 3.18Å; D401-S443 PolarHBondContact OD1-N 3.45Å; D401-S443 PolarHBondContact OD1-OG 2.8Å; D401-S443 PolarHBondContact OD2-OG 2.92Å; S443-W445 VanDerWaalsContact C-N 3.32Å; S443-W445 PolarHBondContact OG-N 3.43Å; S443-W445 PolarHBondContact OG-O 3.1Å
444	N	79.4	Confident	90.1	Very high	134 Å²	134	39.5 Å²	39.5	72%	0.717	19%	0.19	S	C	*	.	S	Bend	trans	-86	-2.6	172.6	-73.6	-30.1	0	0	0	113.1	Y368	Y368-N444 WeakPolarHBondContact CE2-OD1 3.4Å; Y368-N444 PolarHBondContact OH-OD1 2.76Å
445	W	74.8	Confident	90	Very high	133 Å²	133	41.4 Å²	41.4	50%	0.504	20%	0.201	S	C	.	.			trans	-108.3	133.8	-179.6	-176.9	92.9	0	0	0	109.3	Y393 S443	Y393-W445 HydrophobicContact CD2-CB 4.04Å; Y393-W445 HydrophobicContact CD2-CD2 4.04Å; Y393-W445 AromaticContact CD2-CE3 3.63Å; Y393-W445 HydrophobicContact CD2-CE3 3.63Å; Y393-W445 HydrophobicContact CD2-CG 4.25Å; Y393-W445 HydrophobicContact CD2-CZ3 4.39Å; Y393-W445 HydrophobicContact CE2-CB 4.37Å; Y393-W445 HydrophobicContact CG-CE3 4.23Å; S443-W445 VanDerWaalsContact C-N 3.32Å; S443-W445 PolarHBondContact OG-N 3.43Å; S443-W445 PolarHBondContact OG-O 3.1Å
446	V	78.6	Confident	89.6	Confident	68 Å²	68	41.3 Å²	41.3	41%	0.412	20%	0.2	S	C	.	.			trans	-119.5	118.9	-172.4	-63.3	0	0	0	0	109.8	Y365	Y365-V446 HydrophobicContact CD2-CG1 4.36Å; Y365-V446 HydrophobicContact CE2-CB 4.49Å; Y365-V446 HydrophobicContact CE2-CG1 4.29Å; Y365-V446 WeakPolarHBondContact O-CB 3.46Å; Y365-V446 WeakPolarHBondContact O-CG1 3.08Å
447	G	84.9	Confident	89	Confident	3 Å²	3	44.4 Å²	44.4	3%	0.031	22%	0.217	C	C	.	.			trans	-80.9	177.6	168.3	0	0	0	0	0	111	G364 Y365 D391 G449	G364-G447 WeakPolarHBondContact CA-O 3.45Å; Y365-G447 WeakPolarHBondContact CD1-O 3.33Å; Y365-G447 WeakPolarHBondContact CE1-O 3.49Å; Y365-G447 PolarHBondContact N-O 2.74Å; D391-G447 CarbonylContact O-C 3.52Å; D391-G447 WeakPolarHBondContact O-CA 3.43Å; G447-G449 PolarHBondContact O-N 2.67Å
448	K	90.1	Very high	88.3	Confident	132 Å²	132	45.5 Å²	45.5	57%	0.574	22%	0.224	S	C	*	.			trans	-62.2	-23.2	177.8	-66.1	170.7	-176.1	172	0	113.1	F361 D391	F361-K448 WeakPolarHBondContact CD2-O 3.35Å; D391-K448 HydrophobicContact CB-CB 4.12Å; D391-K448 PolarHBondContact O-N 3.42Å; D391-K448 WeakPolarHBondContact OD2-CB 3.26Å; D391-K448 WeakPolarHBondContact OD2-CG 3.22Å; D391-K448 PolarHBondContact OD2-N 3.04Å
449	G	92	Very high	87.6	Confident	1 Å²	1	45 Å²	45	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.5	-151.7	-178.6	0	0	0	0	0	112.9	S358 M390 D391 G447	S358-G449 VanDerWaalsContact OG-CA 3.24Å; S358-G449 WeakPolarHBondContact OG-CA 3.35Å; M390-G449 CarbonylContact C-O 3.59Å; M390-G449 WeakPolarHBondContact CA-O 3.49Å; D391-G449 PolarHBondContact N-O 3.09Å; D391-G449 PolarHBondContact O-N 3.38Å; G447-G449 PolarHBondContact O-N 2.67Å
450	F	94.6	Very high	87.1	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	156.4	-179.1	72.4	-93.1	0	0	0	111.6	F356 S357 S358 W373 F387 T389 M390 L392 I403 F439	F356-F450 AromaticContact CD2-CE2 3.97Å; F356-F450 HydrophobicContact CD2-CE2 3.97Å; F356-F450 AromaticContact CE2-CE2 3.71Å; F356-F450 HydrophobicContact CE2-CE2 3.71Å; F356-F450 HydrophobicContact CE2-CZ 4.28Å; S357-F450 CarbonylContact C-O 3.4Å; S357-F450 WeakPolarHBondContact CA-O 3.5Å; S357-F450 WeakPolarHBondContact CB-O 3.5Å; S358-F450 PolarHBondContact N-O 3.48Å; S358-F450 PolarHBondContact OG-N 3Å; S358-F450 PolarHBondContact OG-O 2.94Å; W373-F450 HydrophobicContact CE3-CZ 4.42Å; W373-F450 HydrophobicContact CH2-CE1 4.32Å; W373-F450 AromaticContact CH2-CZ 3.7Å; W373-F450 HydrophobicContact CH2-CZ 3.7Å; W373-F450 HydrophobicContact CZ2-CZ 4.45Å; W373-F450 HydrophobicContact CZ3-CE1 4.36Å; W373-F450 AromaticContact CZ3-CZ 3.69Å; W373-F450 HydrophobicContact CZ3-CZ 3.69Å; F387-F450 HydrophobicContact CD1-CD2 4.26Å; F387-F450 AromaticContact CE1-CD2 3.94Å; F387-F450 HydrophobicContact CE1-CD2 3.94Å; F387-F450 HydrophobicContact CE1-CE2 4.4Å; T389-F450 VanDerWaalsContact O-CA 3.26Å; T389-F450 WeakPolarHBondContact O-CA 3.07Å; T389-F450 WeakPolarHBondContact O-CB 3.47Å; M390-F450 HydrophobicContact CB-CB 4.36Å; M390-F450 HydrophobicContact CG-CB 4.2Å; L392-F450 HydrophobicContact CD2-CD1 4.48Å; I403-F450 HydrophobicContact CD1-CD1 4.17Å; I403-F450 HydrophobicContact CD1-CD2 4.15Å; I403-F450 HydrophobicContact CD1-CE1 3.77Å; I403-F450 HydrophobicContact CD1-CE2 3.77Å; I403-F450 HydrophobicContact CD1-CG 4.36Å; I403-F450 HydrophobicContact CD1-CZ 3.57Å; F439-F450 HydrophobicContact CB-CE1 3.92Å; F439-F450 HydrophobicContact CB-CZ 4.4Å; F439-F450 HydrophobicContact CD1-CE1 4.31Å; F439-F450 HydrophobicContact CD2-CD1 4.31Å; F439-F450 AromaticContact CD2-CE1 3.89Å; F439-F450 HydrophobicContact CD2-CE1 3.89Å; F439-F450 AromaticContact CG-CE1 3.77Å; F439-F450 HydrophobicContact CG-CE1 3.77Å
451	A	95.7	Very high	86.7	Confident	15 Å²	15	45.9 Å²	45.9	12%	0.124	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	131.1	165.2	0	0	0	0	0	110.2	F356 F361 T388 T389	F356-A451 WeakPolarHBondContact O-CA 3.46Å; F361-A451 HydrophobicContact CD1-CB 4.27Å; F361-A451 HydrophobicContact CE1-CB 3.8Å; F361-A451 HydrophobicContact CE2-CB 4.27Å; F361-A451 HydrophobicContact CZ-CB 3.8Å; T388-A451 PolarHBondContact N-O 2.94Å; T388-A451 PolarHBondContact OG1-O 3.22Å; T389-A451 PolarHBondContact N-O 3.4Å; T389-A451 PolarHBondContact O-N 3.41Å; T389-A451 WeakPolarHBondContact OG1-CB 3.41Å; T389-A451 PolarHBondContact OG1-N 3.44Å
452	A	95.3	Very high	86.4	Confident	2 Å²	2	47 Å²	47	2%	0.017	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.4	-179.4	0	0	0	0	0	111	N355 F356 L385 N386 F387	N355-A452 VanDerWaalsContact CA-O 3.31Å; N355-A452 WeakPolarHBondContact CA-O 3.32Å; F356-A452 HydrophobicContact CD1-CB 4.38Å; F356-A452 HydrophobicContact CE1-CB 3.79Å; F356-A452 HydrophobicContact CE2-CB 4.39Å; F356-A452 HydrophobicContact CZ-CB 3.79Å; F356-A452 PolarHBondContact N-O 2.8Å; F356-A452 PolarHBondContact O-N 3.1Å; L385-A452 HydrophobicContact CD1-CB 3.92Å; N386-A452 WeakPolarHBondContact O-CA 3.38Å; F387-A452 HydrophobicContact CD1-CB 3.76Å; F387-A452 HydrophobicContact CE1-CB 3.86Å; F387-A452 HydrophobicContact CG-CB 4.4Å
453	I	94.6	Very high	86.4	Confident	80 Å²	80	51.5 Å²	51.5	41%	0.41	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	141.7	168.2	-171.2	170.8	0	0	0	107.9	G354 N386 T388	G354-I453 WeakPolarHBondContact O-CA 3.48Å; N386-I453 HydrophobicContact CB-CG2 4.03Å; N386-I453 PolarHBondContact N-O 3.39Å; N386-I453 PolarHBondContact O-N 2.77Å; T388-I453 HydrophobicContact CG2-CG2 4.01Å
454	Y	94.3	Very high	86.6	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.016	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.2	172.3	80.1	-89.2	0	0	0	111	L349 E351 T353 G354 F356 I375 V377 I383 V384	L349-Y454 HydrophobicContact CB-CE1 3.88Å; L349-Y454 HydrophobicContact CD1-CD1 4.33Å; L349-Y454 HydrophobicContact CD1-CE1 3.87Å; L349-Y454 HydrophobicContact CG-CE1 4.36Å; E351-Y454 PolarHBondContact N-OH 2.9Å; E351-Y454 WeakPolarHBondContact O-CE2 3.29Å; E351-Y454 VanDerWaalsContact O-CZ 3.31Å; E351-Y454 PolarHBondContact O-OH 3.02Å; T353-Y454 WeakPolarHBondContact CA-O 3.24Å; G354-Y454 VanDerWaalsContact CA-CE1 3.48Å; G354-Y454 PolarHBondContact N-O 3.01Å; G354-Y454 VanDerWaalsContact N-O 3.08Å; G354-Y454 VanDerWaalsContact O-CD1 3.25Å; G354-Y454 WeakPolarHBondContact O-CD1 3.09Å; G354-Y454 PolarHBondContact O-N 2.88Å; F356-Y454 HydrophobicContact CD1-CD1 4.31Å; F356-Y454 HydrophobicContact CE1-CD1 4.36Å; I375-Y454 HydrophobicContact CD1-CD1 3.94Å; I375-Y454 HydrophobicContact CD1-CD2 4.24Å; I375-Y454 HydrophobicContact CD1-CG 3.73Å; I375-Y454 HydrophobicContact CG1-CD1 4.32Å; I375-Y454 HydrophobicContact CG1-CG 4.38Å; I375-Y454 HydrophobicContact CG2-CD2 3.62Å; I375-Y454 HydrophobicContact CG2-CE2 3.53Å; I375-Y454 HydrophobicContact CG2-CG 4.19Å; V377-Y454 HydrophobicContact CG1-CE2 4.32Å; I383-Y454 HydrophobicContact CG2-CD2 4.26Å; V384-Y454 CarbonylContact O-C 3.54Å; V384-Y454 WeakPolarHBondContact O-CA 3.43Å
455	E	89.1	Confident	86.9	Confident	90 Å²	90	53 Å²	53	42%	0.421	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.1	174.9	175.9	163.3	-153.7	0	0	110.6	S352 T353 V384 I457 K482	S352-E455 CarbonylContact O-C 3.48Å; T353-E455 HydrophobicContact CG2-CB 4Å; T353-E455 HydrophobicContact CG2-CG 3.81Å; V384-E455 PolarHBondContact N-O 3.42Å; V384-E455 PolarHBondContact O-N 2.9Å; E455-I457 HydrophobicContact CG-CG2 4.23Å; E455-K482 IonicContact OE1-NZ 3.39Å
456	A	85.9	Confident	87.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	115.1	167.1	0	0	0	0	0	108.7	S352 V377 E381 K382	S352-A456 VanDerWaalsContact O-CB 3.26Å; S352-A456 WeakPolarHBondContact O-CB 3.29Å; S352-A456 PolarHBondContact O-N 3.06Å; V377-A456 HydrophobicContact CB-CB 3.93Å; V377-A456 HydrophobicContact CG1-CB 3.69Å; V377-A456 HydrophobicContact CG2-CB 4.33Å; E381-A456 HydrophobicContact CB-CB 4.33Å; K382-A456 WeakPolarHBondContact O-CA 3.28Å
457	I	82.9	Confident	87.6	Confident	75 Å²	75	51.8 Å²	51.8	39%	0.385	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.6	170	62	171.1	0	0	0	108.8	E381 K382 V384 E455	E381-I457 CarbonylContact C-O 3.43Å; E381-I457 VanDerWaalsContact CA-O 3.28Å; E381-I457 WeakPolarHBondContact CA-O 3.43Å; K382-I457 HydrophobicContact CB-CG1 4.02Å; K382-I457 PolarHBondContact N-O 2.77Å; K382-I457 WeakPolarHBondContact O-CG1 3.33Å; K382-I457 PolarHBondContact O-N 2.79Å; V384-I457 HydrophobicContact CG2-CD1 3.59Å; V384-I457 HydrophobicContact CG2-CG1 3.91Å; V384-I457 HydrophobicContact CG2-CG2 4.06Å; E455-I457 HydrophobicContact CG-CG2 4.23Å
458	C	82.5	Confident	87.5	Confident	23 Å²	23	53 Å²	53	16%	0.155	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	152.6	174.7	54.2	0	0	0	0	110.5	E381 P472 C484 W486	E381-C458 HydrophobicContact CG-CB 4.2Å; C458-P472 HydrophobicContact CB-CG 4.07Å; C458-C484 HydrophobicContact CB-CB 3.6Å; C458-C484 WeakPolarHBondContact CB-SG 3.48Å; C458-C484 WeakPolarHBondContact SG-CA 3.47Å; C458-C484 WeakPolarHBondContact SG-CB 3.42Å; C458-C484 CovalentContact SG-SG 2.02Å; C458-C484 PolarHBondContact SG-SG 3.38Å; C458-W486 HydrophobicContact CB-CZ2 4.23Å
459	G	80.1	Confident	87.4	Confident	10 Å²	10	46.8 Å²	46.8	10%	0.103	25%	0.247	C	C	.	.			trans	93.3	-162.2	177.1	0	0	0	0	0	115.6	V485 W486	G459-V485 CarbonylContact C-O 3.51Å; G459-V485 WeakPolarHBondContact CA-O 3.46Å; G459-W486 VanDerWaalsContact CA-CD1 3.47Å
460	G	82.7	Confident	87.2	Confident	33 Å²	33	46.8 Å²	46.8	34%	0.34	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	99.2	-172.6	-174.6	0	0	0	0	0	113.7	V485 W486 K487	G460-V485 PolarHBondContact N-O 2.93Å; G460-W486 WeakPolarHBondContact O-CA 3.25Å; G460-K487 PolarHBondContact O-N 2.91Å
461	E	85.1	Confident	86.9	Confident	107 Å²	107	46.8 Å²	46.8	50%	0.5	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.5	-176.1	-49.3	-167.7	151.5	0	0	110.8	K487	E461-K487 HydrophobicContact CG-CB 4.31Å; E461-K487 HydrophobicContact CG-CD 4.03Å; E461-K487 HydrophobicContact CG-CG 4.39Å; E461-K487 WeakPolarHBondContact OE1-CD 3.49Å; E461-K487 WeakPolarHBondContact OE1-CE 3.37Å; E461-K487 IonicContact OE1-NZ 2.67Å; E461-K487 PolarHBondContact OE1-NZ 3.28Å
462	I	84.9	Confident	86.4	Confident	29 Å²	29	46.2 Å²	46.2	15%	0.149	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	108.2	-175.2	-58.9	177	0	0	0	108.7	K464 I469 K487 T489 F567	I462-K464 HydrophobicContact CG2-CB 4.21Å; I462-K464 HydrophobicContact CG2-CG 4.3Å; I462-I469 HydrophobicContact CD1-CD1 4Å; I462-I469 HydrophobicContact CD1-CG1 4.16Å; I462-K487 PolarHBondContact N-O 2.83Å; I462-T489 PolarHBondContact O-N 3.27Å; I462-F567 HydrophobicContact CG2-CE1 4.18Å; I462-F567 HydrophobicContact CG2-CE2 4.2Å; I462-F567 HydrophobicContact CG2-CZ 3.54Å
463	H	87.8	Confident	85.6	Confident	133 Å²	133	46.9 Å²	46.9	62%	0.616	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.2	78	174.7	-58.9	-75.2	0	0	0	109.7	T489	H463-T489 WeakPolarHBondContact CA-O 3.41Å
464	K	84	Confident	85	Confident	111 Å²	111	43.5 Å²	43.5	48%	0.483	23%	0.227	S	C	.	.			trans	-141.7	149	179.6	-66.6	-175.4	178.6	178.3	0	109.1	D432 I462 E466 T489 F567	D432-K464 IonicContact OD2-NZ 3.17Å; I462-K464 HydrophobicContact CG2-CB 4.21Å; I462-K464 HydrophobicContact CG2-CG 4.3Å; K464-E466 VanDerWaalsContact C-N 3.29Å; K464-E466 WeakPolarHBondContact CB-O 3.23Å; K464-T489 PolarHBondContact N-O 3.18Å; K464-F567 HydrophobicContact CB-CE2 4.22Å; K464-F567 HydrophobicContact CB-CZ 4.19Å
465	N	85.4	Confident	84.2	Confident	65 Å²	65	44 Å²	44	35%	0.348	23%	0.231	S	C	.	.	S	Bend	trans	-80.2	-10.6	174.9	-75.6	-25.4	0	0	0	113.3	S491 F568 K569	N465-S491 VanDerWaalsContact CG-OG 3.27Å; N465-S491 PolarHBondContact ND2-OG 2.99Å; N465-S491 WeakPolarHBondContact OD1-CB 3.32Å; N465-S491 PolarHBondContact OD1-N 3.04Å; N465-S491 PolarHBondContact OD1-OG 2.73Å; N465-F568 CarbonylContact O-C 3.45Å; N465-F568 WeakPolarHBondContact O-CA 3.12Å; N465-K569 HydrophobicContact CB-CB 4.4Å; N465-K569 HydrophobicContact CB-CD 4.29Å; N465-K569 HydrophobicContact CB-CG 4.15Å; N465-K569 PolarHBondContact O-N 3.48Å
466	E	86.1	Confident	83.7	Confident	145 Å²	145	42.2 Å²	42.2	68%	0.678	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-160.2	158.3	177	59.4	-176.1	-161.9	0	0	110.6	K464 F567 F568	K464-E466 VanDerWaalsContact C-N 3.29Å; K464-E466 WeakPolarHBondContact CB-O 3.23Å; E466-F567 VanDerWaalsContact C-CE2 3.44Å; E466-F567 CarbonylContact C-O 3.53Å; E466-F567 WeakPolarHBondContact CA-O 3.4Å; E466-F567 WeakPolarHBondContact O-CZ 3.32Å; E466-F568 HydrophobicContact CB-CB 4.31Å
467	G	81.8	Confident	83.5	Confident	29 Å²	29	46.6 Å²	46.6	30%	0.299	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	167.4	-175.6	173.1	0	0	0	0	0	113.2	N566 F567	G467-N566 WeakPolarHBondContact O-CA 3.17Å; G467-F567 VanDerWaalsContact C-CE1 3.46Å; G467-F567 VanDerWaalsContact CA-CE1 3.45Å; G467-F567 PolarHBondContact N-O 2.85Å; G467-F567 WeakPolarHBondContact O-CD1 3.19Å; G467-F567 PolarHBondContact O-N 2.88Å; G467-F567 VanDerWaalsContact O-O 3.13Å
468	Q	83.3	Confident	83.6	Confident	30 Å²	30	43.1 Å²	43.1	14%	0.14	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140	177.6	178.4	162.4	96.5	0	0	109.6	Q470 Q501 A565 N566	Q468-Q470 HydrophobicContact CG-CG 4.07Å; Q468-Q501 VanDerWaalsContact NE2-CD 3.34Å; Q468-A565 CarbonylContact C-O 3.57Å; Q468-A565 WeakPolarHBondContact CA-O 3.34Å; Q468-N566 PolarHBondContact NE2-OD1 2.99Å
469	I	87.7	Confident	83.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	134.3	172.7	-60.8	167.2	0	0	0	107.2	I462 W486 I488 M550 F563 A565 F567	I462-I469 HydrophobicContact CD1-CD1 4Å; I462-I469 HydrophobicContact CD1-CG1 4.16Å; I469-W486 HydrophobicContact CD1-CB 4.3Å; I469-W486 HydrophobicContact CD1-CG 4.25Å; I469-W486 HydrophobicContact CG2-CD2 3.75Å; I469-W486 HydrophobicContact CG2-CE3 4.3Å; I469-W486 HydrophobicContact CG2-CG 4.12Å; I469-W486 HydrophobicContact CG2-CH2 4.22Å; I469-W486 HydrophobicContact CG2-CZ2 3.67Å; I469-I488 HydrophobicContact CD1-CD1 3.5Å; I469-I488 HydrophobicContact CD1-CG1 3.91Å; I469-M550 HydrophobicContact CB-CE 3.97Å; I469-M550 HydrophobicContact CD1-CE 3.64Å; I469-M550 HydrophobicContact CG1-CE 4.41Å; I469-M550 HydrophobicContact CG2-CE 3.51Å; I469-F563 HydrophobicContact CG2-CE2 4.44Å; I469-A565 PolarHBondContact N-O 3.3Å; I469-A565 PolarHBondContact O-N 3.4Å; I469-A565 VanDerWaalsContact O-O 3.14Å; I469-F567 HydrophobicContact CD1-CD1 3.84Å; I469-F567 HydrophobicContact CD1-CE1 4.2Å; I469-F567 HydrophobicContact CG1-CD1 3.95Å; I469-F567 HydrophobicContact CG1-CE1 4.08Å
470	Q	86.6	Confident	83.7	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	155.3	176.3	-54.2	179.9	-3.7	0	0	109.7	T378 P379 Q468 Y474 F563 A564	T378-Q470 HydrophobicContact CG2-CB 3.88Å; T378-Q470 VanDerWaalsContact CG2-OE1 3.23Å; P379-Q470 HydrophobicContact CB-CG 4.3Å; P379-Q470 PolarHBondContact O-N 3.27Å; Q468-Q470 HydrophobicContact CG-CG 4.07Å; Q470-Y474 HydrophobicContact CB-CD1 4.46Å; Q470-Y474 HydrophobicContact CB-CG 4.26Å; Q470-Y474 HydrophobicContact CG-CD1 4.3Å; Q470-Y474 VanDerWaalsContact OE1-CD1 3.22Å; Q470-F563 CarbonylContact C-O 3.58Å; Q470-F563 VanDerWaalsContact CA-O 3.24Å; Q470-F563 WeakPolarHBondContact CA-O 3.35Å; Q470-A564 HydrophobicContact CG-CB 3.95Å
471	S	88.7	Confident	83.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.272	C	S	.	.			trans	-60	150.3	165	50.8	0	0	0	0	110.4	T378 N473 Y474 G562 F563	T378-S471 WeakPolarHBondContact CG2-O 3.34Å; S471-N473 PolarHBondContact O-N 2.69Å; S471-Y474 WeakPolarHBondContact O-CB 3.21Å; S471-Y474 PolarHBondContact O-N 3.08Å; S471-G562 VanDerWaalsContact OG-CA 3.3Å; S471-G562 WeakPolarHBondContact OG-CA 3.47Å; S471-F563 PolarHBondContact N-O 3.13Å; S471-F563 PolarHBondContact OG-N 3.14Å; S471-F563 PolarHBondContact OG-O 3.11Å
472	P	84.8	Confident	83.7	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.013	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-47.9	139.1	173.1	-28.7	36	0	0	0	112.6	E381 C458 Y474 Y478 K482 C484 F552	E381-P472 WeakPolarHBondContact OE1-CA 3.27Å; E381-P472 WeakPolarHBondContact OE1-CB 3.5Å; C458-P472 HydrophobicContact CB-CG 4.07Å; P472-Y474 VanDerWaalsContact C-N 3.27Å; P472-Y474 PolarHBondContact O-N 3.26Å; P472-Y478 VanDerWaalsContact O-CA 3.25Å; P472-Y478 WeakPolarHBondContact O-CA 3.14Å; P472-Y478 VanDerWaalsContact O-CB 3.24Å; P472-Y478 WeakPolarHBondContact O-CB 3.02Å; P472-K482 HydrophobicContact CG-CB 4.5Å; P472-C484 WeakPolarHBondContact CG-SG 3.47Å; P472-F552 HydrophobicContact CG-CD1 4.49Å
473	N	80.1	Confident	84	Confident	17 Å²	17	56 Å²	56	9%	0.091	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	70	-4.6	177.8	-154.3	54.1	0	0	0	117.8	T378 S471 D476 D477	T378-N473 VanDerWaalsContact OG1-CA 3.25Å; T378-N473 WeakPolarHBondContact OG1-CA 3.34Å; T378-N473 PolarHBondContact OG1-N 2.74Å; S471-N473 PolarHBondContact O-N 2.69Å; N473-D476 CarbonylContact C-O 3.26Å; N473-D476 PolarHBondContact O-N 3.44Å; N473-D476 VanDerWaalsContact O-N 3.12Å; N473-D477 PolarHBondContact ND2-O 2.91Å
474	Y	80.4	Confident	84.1	Confident	8 Å²	8	49.7 Å²	49.7	3%	0.031	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	140.1	178.1	-173.1	-81.4	0	0	0	112.5	R179 T378 Q470 S471 P472 A502 A561 A564	R179-Y474 PolarHBondContact NH1-O 3.43Å; T378-Y474 WeakPolarHBondContact CG2-O 3.33Å; Q470-Y474 HydrophobicContact CB-CD1 4.46Å; Q470-Y474 HydrophobicContact CB-CG 4.26Å; Q470-Y474 HydrophobicContact CG-CD1 4.3Å; Q470-Y474 VanDerWaalsContact OE1-CD1 3.22Å; S471-Y474 WeakPolarHBondContact O-CB 3.21Å; S471-Y474 PolarHBondContact O-N 3.08Å; P472-Y474 VanDerWaalsContact C-N 3.27Å; P472-Y474 PolarHBondContact O-N 3.26Å; Y474-A502 HydrophobicContact CE2-CB 4.11Å; Y474-A502 VanDerWaalsContact OH-CB 3.26Å; Y474-A502 WeakPolarHBondContact OH-CB 3.42Å; Y474-A561 VanDerWaalsContact CD2-O 3.23Å; Y474-A561 WeakPolarHBondContact CD2-O 3.49Å; Y474-A564 HydrophobicContact CD1-CB 4.34Å; Y474-A564 HydrophobicContact CD2-CB 4.5Å; Y474-A564 HydrophobicContact CE1-CB 3.85Å; Y474-A564 HydrophobicContact CE2-CB 4.04Å
475	P	78.1	Confident	84.4	Confident	15 Å²	15	46.3 Å²	46.3	10%	0.097	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	cis	-83.9	0.5	5.1	35.7	-37.4	0	0	0	115.3	A172 Q176	A172-P475 HydrophobicContact CB-CB 3.65Å; Q176-P475 HydrophobicContact CB-CG 4.12Å
476	D	79.4	Confident	84.7	Confident	52 Å²	52	43.3 Å²	43.3	28%	0.278	22%	0.22	S	C	.	.	S	Bend	trans	-81.8	161.8	175.4	-55.1	-55.4	0	0	0	109.6	Q176 N473 Y478	Q176-D476 PolarHBondContact NE2-OD1 2.72Å; N473-D476 CarbonylContact C-O 3.26Å; N473-D476 PolarHBondContact O-N 3.44Å; N473-D476 VanDerWaalsContact O-N 3.12Å; D476-Y478 PolarHBondContact O-N 2.83Å
477	D	81.7	Confident	85	Confident	93 Å²	93	39.8 Å²	39.8	50%	0.497	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-54.8	136	-173	-65.5	-37.2	0	0	0	112.9	N473 N559 K560 A561	N473-D477 PolarHBondContact ND2-O 2.91Å; D477-N559 HydrophobicContact CB-CB 4.18Å; D477-K560 CarbonylContact C-O 3.55Å; D477-K560 WeakPolarHBondContact CA-O 3.42Å; D477-K560 VanDerWaalsContact OD1-CA 3.3Å; D477-K560 WeakPolarHBondContact OD1-CA 3.04Å; D477-A561 PolarHBondContact OD1-N 2.05Å
478	Y	84.8	Confident	85.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.008	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-63.6	158.9	178.8	56	-105.3	0	0	0	112.2	P472 D476 E506 D514 F552 N559 K560	P472-Y478 VanDerWaalsContact O-CA 3.25Å; P472-Y478 WeakPolarHBondContact O-CA 3.14Å; P472-Y478 VanDerWaalsContact O-CB 3.24Å; P472-Y478 WeakPolarHBondContact O-CB 3.02Å; D476-Y478 PolarHBondContact O-N 2.83Å; Y478-E506 PolarHBondContact OH-N 3.13Å; Y478-D514 HydrophobicContact CE2-CB 4.43Å; Y478-D514 WeakPolarHBondContact CE2-OD2 3.35Å; Y478-D514 PolarHBondContact OH-OD2 2.85Å; Y478-F552 AromaticContact CD1-CZ 3.93Å; Y478-F552 HydrophobicContact CD1-CZ 3.93Å; Y478-F552 HydrophobicContact CD2-CE1 4.38Å; Y478-F552 AromaticContact CD2-CZ 3.84Å; Y478-F552 HydrophobicContact CD2-CZ 3.84Å; Y478-F552 HydrophobicContact CE1-CZ 4.15Å; Y478-F552 HydrophobicContact CE2-CZ 4.06Å; Y478-F552 HydrophobicContact CG-CE1 4.27Å; Y478-F552 AromaticContact CG-CZ 3.79Å; Y478-F552 HydrophobicContact CG-CZ 3.79Å; Y478-N559 HydrophobicContact CD2-CB 4.03Å; Y478-N559 HydrophobicContact CE2-CB 3.98Å; Y478-N559 WeakPolarHBondContact CE2-ND2 3.4Å; Y478-N559 WeakPolarHBondContact O-CB 3.43Å; Y478-K560 WeakPolarHBondContact CD1-O 3.25Å; Y478-K560 HydrophobicContact CE1-CB 3.79Å; Y478-K560 VanDerWaalsContact CE1-O 3.22Å; Y478-K560 WeakPolarHBondContact CE1-O 3.08Å; Y478-K560 PolarHBondContact N-O 3.2Å
479	R	79.9	Confident	86	Confident	100 Å²	100	38.7 Å²	38.7	38%	0.377	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-81.2	144.9	179.5	-61.3	-58.9	-174.6	152.4	1.2	111	K482 S554	R479-K482 HydrophobicContact CB-CG 3.98Å; R479-S554 PolarHBondContact O-OG 2.82Å
480	P	84.5	Confident	86.2	Confident	51 Å²	51	39 Å²	39	33%	0.331	20%	0.195	S	C	.	.	S	Bend	trans	-68.1	158.4	171.6	29.8	-34.2	0	0	0	110.8	K482 D555 N559	P480-K482 VanDerWaalsContact C-N 3.33Å; P480-K482 PolarHBondContact O-N 2.9Å; P480-D555 CarbonylContact C-O 3.51Å; P480-D555 WeakPolarHBondContact CA-O 3.39Å; P480-D555 WeakPolarHBondContact CB-O 3.45Å; P480-N559 WeakPolarHBondContact CD-OD1 3.21Å
481	M	83.3	Confident	86.5	Confident	156 Å²	156	41.3 Å²	41.3	77%	0.768	21%	0.211	S	C	*	.	S	Bend	trans	56.3	40.4	177.6	-55.4	-177.9	176.4	0	0	113.8	S554 D555	M481-S554 VanDerWaalsContact CA-O 3.24Å; M481-S554 WeakPolarHBondContact CA-O 3.13Å; M481-S554 PolarHBondContact N-O 2.63Å; M481-S554 PolarHBondContact N-OG 3.07Å; M481-D555 PolarHBondContact N-O 2.73Å
482	K	85	Confident	86.4	Confident	44 Å²	44	48.6 Å²	48.6	19%	0.191	25%	0.245	C	C	.	.			trans	-106.4	136.6	175.1	-74.7	-66.5	-174.4	175.5	0	110.9	E455 P472 R479 P480 V553 S554	E455-K482 IonicContact OE1-NZ 3.39Å; P472-K482 HydrophobicContact CG-CB 4.5Å; R479-K482 HydrophobicContact CB-CG 3.98Å; P480-K482 VanDerWaalsContact C-N 3.33Å; P480-K482 PolarHBondContact O-N 2.9Å; K482-V553 CarbonylContact O-C 3.54Å; K482-V553 WeakPolarHBondContact O-CA 3.41Å; K482-S554 PolarHBondContact N-OG 3.08Å; K482-S554 PolarHBondContact O-N 3.5Å
483	E	90.2	Very high	86.3	Confident	121 Å²	121	56.1 Å²	56.1	57%	0.565	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	121.4	171.3	-179.6	174.9	177.7	0	0	107.8	K551 F552 V553	E483-K551 WeakPolarHBondContact OE1-CE 3.3Å; E483-K551 IonicContact OE1-NZ 3.93Å; E483-K551 PolarHBondContact OE1-NZ 2.91Å; E483-F552 WeakPolarHBondContact CA-O 3.38Å; E483-V553 HydrophobicContact CG-CG2 4.4Å
484	C	89.6	Confident	86.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.2	-174.7	-55.3	0	0	0	0	109.3	C458 P472 W486 K551 F552	C458-C484 HydrophobicContact CB-CB 3.6Å; C458-C484 WeakPolarHBondContact CB-SG 3.48Å; C458-C484 WeakPolarHBondContact SG-CA 3.47Å; C458-C484 WeakPolarHBondContact SG-CB 3.42Å; C458-C484 CovalentContact SG-SG 2.02Å; C458-C484 PolarHBondContact SG-SG 3.38Å; P472-C484 WeakPolarHBondContact CG-SG 3.47Å; C484-W486 HydrophobicContact CB-CE3 4.28Å; C484-W486 HydrophobicContact CB-CH2 3.33Å; C484-W486 HydrophobicContact CB-CZ2 3.75Å; C484-W486 HydrophobicContact CB-CZ3 3.63Å; C484-K551 CarbonylContact O-C 3.23Å; C484-K551 VanDerWaalsContact O-CA 3.24Å; C484-K551 WeakPolarHBondContact O-CA 3.47Å; C484-F552 HydrophobicContact CB-CB 4.25Å; C484-F552 PolarHBondContact N-O 3.22Å; C484-F552 PolarHBondContact O-N 2.97Å
485	V	91.4	Very high	87.2	Confident	41 Å²	41	59.9 Å²	59.9	25%	0.248	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	113.9	-178.8	179.3	0	0	0	0	110.1	G459 G460 W549 M550 K551	G459-V485 CarbonylContact C-O 3.51Å; G459-V485 WeakPolarHBondContact CA-O 3.46Å; G460-V485 PolarHBondContact N-O 2.93Å; V485-W549 HydrophobicContact CG1-CZ2 3.75Å; V485-W549 HydrophobicContact CG2-CZ2 4.34Å; V485-M550 CarbonylContact C-O 3.58Å; V485-M550 WeakPolarHBondContact CA-O 3.21Å; V485-K551 HydrophobicContact CG2-CB 4.21Å; V485-K551 HydrophobicContact CG2-CD 4.07Å; V485-K551 HydrophobicContact CG2-CG 3.94Å
486	W	91.6	Very high	87.9	Confident	1 Å²	1	59.1 Å²	59.1	0%	0.004	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.1	176.4	-58.3	-91.9	0	0	0	110.6	G380 C458 G459 G460 I469 C484 M550 F552 F563	G380-W486 PolarHBondContact O-NE1 3Å; C458-W486 HydrophobicContact CB-CZ2 4.23Å; G459-W486 VanDerWaalsContact CA-CD1 3.47Å; G460-W486 WeakPolarHBondContact O-CA 3.25Å; I469-W486 HydrophobicContact CD1-CB 4.3Å; I469-W486 HydrophobicContact CD1-CG 4.25Å; I469-W486 HydrophobicContact CG2-CD2 3.75Å; I469-W486 HydrophobicContact CG2-CE3 4.3Å; I469-W486 HydrophobicContact CG2-CG 4.12Å; I469-W486 HydrophobicContact CG2-CH2 4.22Å; I469-W486 HydrophobicContact CG2-CZ2 3.67Å; C484-W486 HydrophobicContact CB-CE3 4.28Å; C484-W486 HydrophobicContact CB-CH2 3.33Å; C484-W486 HydrophobicContact CB-CZ2 3.75Å; C484-W486 HydrophobicContact CB-CZ3 3.63Å; W486-M550 HydrophobicContact CD2-CE 4.11Å; W486-M550 HydrophobicContact CE3-CB 4.43Å; W486-M550 HydrophobicContact CE3-CE 3.74Å; W486-M550 HydrophobicContact CE3-CG 4.13Å; W486-M550 HydrophobicContact CG-CE 4.49Å; W486-M550 HydrophobicContact CZ3-CE 4.21Å; W486-M550 PolarHBondContact N-O 3.12Å; W486-M550 PolarHBondContact O-N 3.28Å; W486-F552 HydrophobicContact CH2-CB 3.96Å; W486-F552 HydrophobicContact CZ3-CB 3.71Å; W486-F563 AromaticContact CH2-CZ 3.88Å; W486-F563 HydrophobicContact CH2-CZ 3.88Å; W486-F563 HydrophobicContact CZ3-CZ 4.02Å
487	K	92.5	Very high	88.5	Confident	72 Å²	72	56.7 Å²	56.7	31%	0.313	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.8	167.6	-49	-171.4	-163.8	162.6	0	108.7	G460 E461 I462 T522	G460-K487 PolarHBondContact O-N 2.91Å; E461-K487 HydrophobicContact CG-CB 4.31Å; E461-K487 HydrophobicContact CG-CD 4.03Å; E461-K487 HydrophobicContact CG-CG 4.39Å; E461-K487 WeakPolarHBondContact OE1-CD 3.49Å; E461-K487 WeakPolarHBondContact OE1-CE 3.37Å; E461-K487 IonicContact OE1-NZ 2.67Å; E461-K487 PolarHBondContact OE1-NZ 3.28Å; I462-K487 PolarHBondContact N-O 2.83Å; K487-T522 WeakPolarHBondContact CD-O 2.95Å
488	I	92.9	Very high	89	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.1	-178.9	-52.9	168.4	0	0	0	108	I469 V496 T547 L548 F567	I469-I488 HydrophobicContact CD1-CD1 3.5Å; I469-I488 HydrophobicContact CD1-CG1 3.91Å; I488-V496 HydrophobicContact CB-CG1 4.49Å; I488-V496 HydrophobicContact CG2-CG1 3.89Å; I488-V496 HydrophobicContact CG2-CG2 4.5Å; I488-T547 CarbonylContact O-C 3.49Å; I488-T547 VanDerWaalsContact O-CA 3.26Å; I488-T547 WeakPolarHBondContact O-CA 3.08Å; I488-L548 HydrophobicContact CB-CB 4.34Å; I488-L548 HydrophobicContact CD1-CD2 4.19Å; I488-L548 PolarHBondContact N-O 3.35Å; I488-L548 PolarHBondContact O-N 3.48Å; I488-F567 HydrophobicContact CD1-CB 4.1Å; I488-F567 HydrophobicContact CD1-CD1 4.35Å; I488-F567 HydrophobicContact CD1-CG 4.17Å; I488-F567 HydrophobicContact CG2-CB 4.49Å; I488-F567 HydrophobicContact CG2-CD2 3.56Å; I488-F567 HydrophobicContact CG2-CE2 3.91Å; I488-F567 HydrophobicContact CG2-CG 4Å
489	T	93.1	Very high	89.3	Confident	34 Å²	34	53.4 Å²	53.4	21%	0.209	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	116.9	175.5	-58.1	0	0	0	0	109.2	I462 H463 K464 N546 T547	I462-T489 PolarHBondContact O-N 3.27Å; H463-T489 WeakPolarHBondContact CA-O 3.41Å; K464-T489 PolarHBondContact N-O 3.18Å; T489-N546 WeakPolarHBondContact CA-O 3.38Å; T489-T547 HydrophobicContact CG2-CG2 4.12Å
490	V	92.6	Very high	89.7	Confident	8 Å²	8	49 Å²	49	5%	0.048	25%	0.25	C	S	.	.			trans	-95.3	175.7	172.7	-59.2	0	0	0	0	110.5	N495 V496 N546 K569	V490-N495 WeakPolarHBondContact CG2-O 3.26Å; V490-V496 HydrophobicContact CG1-CG2 4.08Å; V490-V496 HydrophobicContact CG2-CG2 3.99Å; V490-N546 HydrophobicContact CG2-CB 3.91Å; V490-N546 PolarHBondContact N-O 3.47Å; V490-N546 PolarHBondContact O-ND2 2.03Å; V490-K569 HydrophobicContact CB-CB 4.24Å; V490-K569 HydrophobicContact CG1-CB 4.35Å
491	S	91.8	Very high	89.8	Confident	50 Å²	50	48.7 Å²	48.7	35%	0.35	24%	0.244	S	C	.	.			trans	-53.3	148.5	176.1	-61.9	0	0	0	0	112.7	N465 Y494	N465-S491 VanDerWaalsContact CG-OG 3.27Å; N465-S491 PolarHBondContact ND2-OG 2.99Å; N465-S491 WeakPolarHBondContact OD1-CB 3.32Å; N465-S491 PolarHBondContact OD1-N 3.04Å; N465-S491 PolarHBondContact OD1-OG 2.73Å; S491-Y494 PolarHBondContact O-N 3.19Å
492	E	86.5	Confident	89.9	Confident	153 Å²	153	42 Å²	42	72%	0.715	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	145.1	176.5	-62.4	-179.9	176.3	0	0	111.8	Y494	E492-Y494 VanDerWaalsContact C-N 3.28Å; E492-Y494 WeakPolarHBondContact O-CD2 3.47Å; E492-Y494 PolarHBondContact O-N 2.95Å
493	N	83.4	Confident	90.2	Very high	159 Å²	159	40.3 Å²	40.3	85%	0.85	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.4	9.6	-175	-42.8	-70.9	0	0	0	116.4
494	Y	88.1	Confident	90.3	Very high	63 Å²	63	38.4 Å²	38.4	25%	0.247	20%	0.198	C	C	.	.			trans	-111.8	160	169.3	-65.4	-89.9	0	0	0	111	S491 E492 N546 K569 E571	S491-Y494 PolarHBondContact O-N 3.19Å; E492-Y494 VanDerWaalsContact C-N 3.28Å; E492-Y494 WeakPolarHBondContact O-CD2 3.47Å; E492-Y494 PolarHBondContact O-N 2.95Å; Y494-N546 WeakPolarHBondContact O-CA 3.3Å; Y494-N546 WeakPolarHBondContact O-CB 3.48Å; Y494-N546 PolarHBondContact O-N 3.15Å; Y494-K569 HydrophobicContact CD1-CB 4.38Å; Y494-K569 HydrophobicContact CD1-CD 4.1Å; Y494-K569 HydrophobicContact CE1-CD 4.17Å; Y494-K569 HydrophobicContact CG-CB 4.32Å; Y494-K569 HydrophobicContact CG-CD 4.37Å; Y494-E571 HydrophobicContact CD1-CB 3.91Å; Y494-E571 HydrophobicContact CD1-CG 4.19Å; Y494-E571 HydrophobicContact CE1-CB 3.92Å; Y494-E571 HydrophobicContact CE1-CG 3.93Å
495	N	91.4	Very high	90.4	Very high	41 Å²	41	38.4 Å²	38.4	22%	0.219	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	166.2	170.2	-65.9	100.4	0	0	0	110.4	V490 R542 S543 T544 E570	V490-N495 WeakPolarHBondContact CG2-O 3.26Å; N495-R542 HydrophobicContact CB-CG 4.22Å; N495-S543 WeakPolarHBondContact CB-O 3.23Å; N495-S543 PolarHBondContact ND2-O 3.44Å; N495-T544 PolarHBondContact ND2-O 3.5Å; N495-E570 HydrophobicContact CB-CB 3.95Å; N495-E570 HydrophobicContact CB-CG 4.17Å; N495-E570 PolarHBondContact N-O 2.01Å; N495-E570 PolarHBondContact O-N 3.22Å
496	V	92.2	Very high	90.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	114.3	169.8	-170.1	0	0	0	0	107.9	I488 V490 R542 S543 L548 F567	I488-V496 HydrophobicContact CB-CG1 4.49Å; I488-V496 HydrophobicContact CG2-CG1 3.89Å; I488-V496 HydrophobicContact CG2-CG2 4.5Å; V490-V496 HydrophobicContact CG1-CG2 4.08Å; V490-V496 HydrophobicContact CG2-CG2 3.99Å; V496-R542 WeakPolarHBondContact O-CA 3.34Å; V496-S543 WeakPolarHBondContact CA-OG 3.36Å; V496-S543 WeakPolarHBondContact CB-OG 3.37Å; V496-S543 PolarHBondContact N-OG 3.07Å; V496-S543 PolarHBondContact O-N 3.47Å; V496-S543 PolarHBondContact O-OG 3.33Å; V496-L548 HydrophobicContact CB-CB 3.94Å; V496-L548 HydrophobicContact CG1-CB 3.93Å; V496-L548 HydrophobicContact CG1-CD2 4.18Å; V496-L548 HydrophobicContact CG2-CB 4.04Å; V496-F567 HydrophobicContact CG1-CB 4.38Å
497	G	92.4	Very high	90.5	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	137.6	164.4	0	0	0	0	0	110.1	I541 F567 F568	G497-I541 CarbonylContact C-O 3.6Å; G497-I541 WeakPolarHBondContact CA-O 3.22Å; G497-F567 CarbonylContact O-C 3.56Å; G497-F567 WeakPolarHBondContact O-CA 3.45Å; G497-F568 PolarHBondContact N-O 3.07Å; G497-F568 PolarHBondContact O-N 2.86Å
498	L	91.6	Very high	90.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	127.3	175.3	-174.4	78.2	0	0	0	110.2	F500 I518 I541 L548 M550 A565 N566 F567	L498-F500 HydrophobicContact CD2-CE2 4.08Å; L498-F500 HydrophobicContact CD2-CZ 4.08Å; L498-I518 HydrophobicContact CD2-CD1 3.66Å; L498-I541 HydrophobicContact CB-CB 4.25Å; L498-I541 PolarHBondContact N-O 2.83Å; L498-I541 PolarHBondContact O-N 3.35Å; L498-L548 HydrophobicContact CB-CD2 4.16Å; L498-L548 HydrophobicContact CD2-CD2 4.07Å; L498-M550 HydrophobicContact CD2-SD 4.16Å; L498-A565 HydrophobicContact CD1-CB 3.91Å; L498-A565 HydrophobicContact CG-CB 4.37Å; L498-N566 CarbonylContact C-O 3.49Å; L498-N566 WeakPolarHBondContact CA-O 3.48Å; L498-F567 HydrophobicContact CD1-CB 3.93Å
499	T	90.8	Very high	90.1	Very high	26 Å²	26	51.6 Å²	51.6	16%	0.16	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	135.4	-179.4	56.4	0	0	0	0	110.7	D540 A565 N566 F568 L590	T499-D540 HydrophobicContact CG2-CB 4.12Å; T499-A565 CarbonylContact O-C 3.13Å; T499-A565 WeakPolarHBondContact O-CA 3.43Å; T499-N566 PolarHBondContact N-O 2.97Å; T499-N566 PolarHBondContact O-N 2.74Å; T499-N566 PolarHBondContact OG1-O 2.96Å; T499-F568 HydrophobicContact CG2-CE1 3.75Å; T499-F568 HydrophobicContact CG2-CZ 3.83Å; T499-L590 HydrophobicContact CG2-CD2 3.73Å
500	F	89.9	Confident	89.8	Confident	7 Å²	7	56.1 Å²	56.1	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.5	176.4	-70.4	-89.3	0	0	0	111.6	L498 F503 L516 I518 K537 P538 I541 F563 A565	L498-F500 HydrophobicContact CD2-CE2 4.08Å; L498-F500 HydrophobicContact CD2-CZ 4.08Å; F500-F503 AromaticContact CD1-CD2 3.8Å; F500-F503 HydrophobicContact CD1-CD2 3.8Å; F500-F503 AromaticContact CE1-CD2 3.8Å; F500-F503 HydrophobicContact CE1-CD2 3.8Å; F500-F503 HydrophobicContact CE1-CE2 4.18Å; F500-L516 HydrophobicContact CE1-CD2 3.52Å; F500-L516 HydrophobicContact CZ-CD2 3.54Å; F500-I518 HydrophobicContact CE2-CD1 4.25Å; F500-I518 HydrophobicContact CZ-CD1 3.88Å; F500-K537 HydrophobicContact CB-CD 3.89Å; F500-K537 HydrophobicContact CB-CG 3.65Å; F500-K537 WeakPolarHBondContact O-CD 3.34Å; F500-K537 WeakPolarHBondContact O-CE 3.09Å; F500-K537 PolarHBondContact O-NZ 3.03Å; F500-P538 HydrophobicContact CD2-CB 3.77Å; F500-P538 HydrophobicContact CD2-CG 3.98Å; F500-P538 HydrophobicContact CE2-CB 3.75Å; F500-P538 HydrophobicContact CE2-CG 3.9Å; F500-P538 HydrophobicContact CG-CG 4.4Å; F500-P538 HydrophobicContact CZ-CG 4.24Å; F500-I541 HydrophobicContact CE2-CD1 4.38Å; F500-F563 HydrophobicContact CD1-CB 4.38Å; F500-F563 HydrophobicContact CE1-CB 4.4Å; F500-F563 HydrophobicContact CE1-CD2 4.04Å; F500-F563 HydrophobicContact CE1-CG 4.4Å; F500-A565 HydrophobicContact CD1-CB 3.79Å; F500-A565 HydrophobicContact CE1-CB 3.78Å; F500-A565 HydrophobicContact CG-CB 4.37Å; F500-A565 HydrophobicContact CZ-CB 4.33Å
501	Q	85.3	Confident	89.6	Confident	45 Å²	45	56.4 Å²	56.4	21%	0.21	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	-35.7	169.7	-62	-167.6	-2.7	0	0	111.9	G168 Q468 A564 N566	G168-Q501 WeakPolarHBondContact CA-O 3.2Å; Q468-Q501 VanDerWaalsContact NE2-CD 3.34Å; Q501-A564 HydrophobicContact CB-CB 4.43Å; Q501-A564 PolarHBondContact N-O 2.77Å; Q501-N566 VanDerWaalsContact NE2-CG 3.32Å; Q501-N566 PolarHBondContact NE2-ND2 3.38Å; Q501-N566 PolarHBondContact NE2-OD1 3.01Å
502	A	86.1	Confident	89.5	Confident	16 Å²	16	57.2 Å²	57.2	13%	0.132	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	150.2	176.3	0	0	0	0	0	109.4	Y474 F563 A564	Y474-A502 HydrophobicContact CE2-CB 4.11Å; Y474-A502 VanDerWaalsContact OH-CB 3.26Å; Y474-A502 WeakPolarHBondContact OH-CB 3.42Å; A502-F563 VanDerWaalsContact O-CA 3.28Å; A502-F563 WeakPolarHBondContact O-CA 3.48Å; A502-F563 WeakPolarHBondContact O-CB 3.25Å; A502-A564 PolarHBondContact N-O 3.19Å; A502-A564 PolarHBondContact O-N 2.96Å
503	F	91.9	Very high	89.6	Confident	8 Å²	8	54.9 Å²	54.9	4%	0.035	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	106.2	179.7	-168.7	-90.1	0	0	0	110.8	F500 I505 L516 F532 K537 P538 F563	F500-F503 AromaticContact CD1-CD2 3.8Å; F500-F503 HydrophobicContact CD1-CD2 3.8Å; F500-F503 AromaticContact CE1-CD2 3.8Å; F500-F503 HydrophobicContact CE1-CD2 3.8Å; F500-F503 HydrophobicContact CE1-CE2 4.18Å; F503-I505 HydrophobicContact CD2-CD1 4.44Å; F503-I505 HydrophobicContact CE1-CB 4.47Å; F503-I505 HydrophobicContact CE1-CD1 4.22Å; F503-I505 HydrophobicContact CE1-CG1 4.28Å; F503-I505 HydrophobicContact CE2-CD1 3.58Å; F503-I505 HydrophobicContact CE2-CG1 4.25Å; F503-I505 HydrophobicContact CZ-CB 4.47Å; F503-I505 HydrophobicContact CZ-CD1 3.45Å; F503-I505 VanDerWaalsContact CZ-CD1 3.45Å; F503-I505 HydrophobicContact CZ-CG1 3.99Å; F503-L516 HydrophobicContact CE2-CB 4.11Å; F503-L516 HydrophobicContact CE2-CD2 3.85Å; F503-L516 HydrophobicContact CZ-CB 4.41Å; F503-F532 HydrophobicContact CE1-CB 4.23Å; F503-F532 HydrophobicContact CE2-CB 4.18Å; F503-F532 HydrophobicContact CZ-CB 3.51Å; F503-K537 HydrophobicContact CB-CG 4.43Å; F503-P538 HydrophobicContact CD1-CG 4.39Å; F503-P538 HydrophobicContact CD2-CG 3.95Å; F503-P538 HydrophobicContact CE1-CG 4.37Å; F503-P538 HydrophobicContact CE2-CG 3.95Å; F503-P538 VanDerWaalsContact CG-CD 3.48Å; F503-P538 HydrophobicContact CG-CG 4.18Å; F503-P538 HydrophobicContact CZ-CG 4.16Å; F503-F563 HydrophobicContact CD2-CB 3.69Å; F503-F563 HydrophobicContact CD2-CG 4.43Å; F503-F563 HydrophobicContact CE2-CB 4.32Å; F503-F563 HydrophobicContact CG-CB 4.45Å
504	E	90.8	Very high	90.2	Very high	81 Å²	81	47.4 Å²	47.4	38%	0.379	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	95.3	176.2	-63.2	-170	-144.6	0	0	109.2	Y535 K560 G562	E504-Y535 HydrophobicContact CB-CD1 4.19Å; E504-Y535 HydrophobicContact CG-CD1 4.03Å; E504-K560 HydrophobicContact CB-CB 4.45Å; E504-K560 WeakPolarHBondContact O-CB 3.1Å; E504-G562 PolarHBondContact N-O 3.4Å; E504-G562 WeakPolarHBondContact O-CA 3.44Å; E504-G562 PolarHBondContact O-N 3.19Å
505	I	93	Very high	90.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.			trans	-114.6	159.6	176.2	-60.6	-177.4	0	0	0	108	F503 R507 D514 L516 C533 G534 F552 F563	F503-I505 HydrophobicContact CD2-CD1 4.44Å; F503-I505 HydrophobicContact CE1-CB 4.47Å; F503-I505 HydrophobicContact CE1-CD1 4.22Å; F503-I505 HydrophobicContact CE1-CG1 4.28Å; F503-I505 HydrophobicContact CE2-CD1 3.58Å; F503-I505 HydrophobicContact CE2-CG1 4.25Å; F503-I505 HydrophobicContact CZ-CB 4.47Å; F503-I505 HydrophobicContact CZ-CD1 3.45Å; F503-I505 VanDerWaalsContact CZ-CD1 3.45Å; F503-I505 HydrophobicContact CZ-CG1 3.99Å; I505-R507 PolarHBondContact O-N 2.86Å; I505-D514 HydrophobicContact CG2-CB 3.46Å; I505-D514 VanDerWaalsContact CG2-CB 3.46Å; I505-D514 WeakPolarHBondContact CG2-O 3.34Å; I505-L516 HydrophobicContact CD1-CB 3.87Å; I505-C533 HydrophobicContact CG2-CB 4.19Å; I505-G534 PolarHBondContact N-O 3.07Å; I505-G534 CarbonylContact O-C 3.53Å; I505-G534 WeakPolarHBondContact O-CA 3.47Å; I505-G534 PolarHBondContact O-N 2.97Å; I505-G534 VanDerWaalsContact O-N 3.17Å; I505-F552 HydrophobicContact CD1-CD2 4.15Å; I505-F552 HydrophobicContact CD1-CE2 3.93Å; I505-F552 HydrophobicContact CG1-CE2 4.37Å; I505-F552 HydrophobicContact CG2-CE2 4.44Å; I505-F563 HydrophobicContact CD1-CD1 3.98Å
506	E	93.7	Very high	90.8	Very high	27 Å²	27	44.7 Å²	44.7	13%	0.126	22%	0.222	C	C	.	.			trans	-50.7	135.4	173.9	-168.3	-175.7	-161.7	0	0	111.2	Y478 Y513 D514 C533 G534 V558	Y478-E506 PolarHBondContact OH-N 3.13Å; E506-Y513 WeakPolarHBondContact OE2-CB 3.29Å; E506-Y513 WeakPolarHBondContact OE2-CD2 3.36Å; E506-D514 HydrophobicContact CB-CB 3.94Å; E506-C533 VanDerWaalsContact O-CB 3.31Å; E506-C533 WeakPolarHBondContact O-CB 3.17Å; E506-G534 PolarHBondContact O-N 2.96Å; E506-G534 VanDerWaalsContact O-N 3.14Å; E506-V558 HydrophobicContact CG-CB 4.1Å; E506-V558 HydrophobicContact CG-CG1 3.88Å; E506-V558 VanDerWaalsContact OE1-CB 3.27Å; E506-V558 WeakPolarHBondContact OE1-CB 3.44Å; E506-V558 WeakPolarHBondContact OE1-CG2 3.44Å
507	R	90.6	Very high	90.9	Very high	160 Å²	160	45.7 Å²	45.7	60%	0.604	23%	0.227	S	C	*	.			trans	-90.4	121.1	-178.5	-175.2	179.7	175.4	154.8	5.7	110.7	I505 Y535	I505-R507 PolarHBondContact O-N 2.86Å; R507-Y535 HydrophobicContact CB-CE2 4.22Å
508	H	91.6	Very high	91.1	Very high	58 Å²	58	45.7 Å²	45.7	27%	0.269	23%	0.227	S	C	.	.			trans	-141.1	143.5	169.5	-178.9	-93.2	0	0	0	110.1	N510 C511 A512 Y513 C533	H508-N510 PolarHBondContact ND1-N 2.99Å; H508-N510 PolarHBondContact O-N 2.77Å; H508-N510 VanDerWaalsContact O-N 3.13Å; H508-C511 PolarHBondContact ND1-N 3.43Å; H508-C511 PolarHBondContact O-N 2.9Å; H508-A512 PolarHBondContact ND1-N 3.37Å; H508-Y513 HydrophobicContact CB-CD2 3.96Å; H508-Y513 HydrophobicContact CB-CE2 4.29Å; H508-Y513 AromaticContact CD2-CD2 3.91Å; H508-Y513 AromaticContact CD2-CE2 3.4Å; H508-Y513 WeakPolarHBondContact CD2-CE2 3.45Å; H508-Y513 AromaticContact CD2-CZ 3.84Å; H508-C533 PolarHBondContact O-SG 2.84Å
509	D	84.8	Confident	91.3	Very high	147 Å²	147	48 Å²	48	79%	0.786	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.4	-171.9	-63.4	-30.2	0	0	0	113.7
510	N	86.8	Confident	91.5	Very high	129 Å²	129	47.9 Å²	47.9	69%	0.69	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109	11.3	173.9	-69	1.7	0	0	0	113.6	H508 A512	H508-N510 PolarHBondContact ND1-N 2.99Å; H508-N510 PolarHBondContact O-N 2.77Å; H508-N510 VanDerWaalsContact O-N 3.13Å; N510-A512 VanDerWaalsContact C-N 3.33Å; N510-A512 PolarHBondContact O-N 2.94Å
511	C	89.9	Confident	91.6	Very high	14 Å²	14	48 Å²	48	10%	0.095	24%	0.237	C	C	.	.			trans	50.8	45.7	-176.2	-56.5	0	0	0	0	114.2	H508 H531 C533	H508-C511 PolarHBondContact ND1-N 3.43Å; H508-C511 PolarHBondContact O-N 2.9Å; C511-H531 PolarHBondContact O-CE1 2.98Å; C511-H531 VanDerWaalsContact O-CE1 3.26Å; C511-C533 WeakPolarHBondContact CA-SG 3.24Å; C511-C533 HydrophobicContact CB-CB 3.51Å; C511-C533 WeakPolarHBondContact CB-SG 3.36Å; C511-C533 WeakPolarHBondContact SG-CB 3.44Å; C511-C533 PolarHBondContact SG-N 3.14Å; C511-C533 VanDerWaalsContact SG-N 3.36Å; C511-C533 CovalentContact SG-SG 2.03Å; C511-C533 PolarHBondContact SG-SG 3.48Å
512	A	88.6	Confident	91.8	Very high	67 Å²	67	48.9 Å²	48.9	55%	0.554	25%	0.246	S	C	*	.			trans	-89.9	-8	-169.8	0	0	0	0	0	114.3	H508 N510	H508-A512 PolarHBondContact ND1-N 3.37Å; N510-A512 VanDerWaalsContact C-N 3.33Å; N510-A512 PolarHBondContact O-N 2.94Å
513	Y	89.9	Confident	92.1	Very high	105 Å²	105	51.5 Å²	51.5	41%	0.412	26%	0.257	S	S	.	.	S	Bend	trans	-99.7	-104.2	174.5	-51.5	-44.3	0	0	0	107.9	E506 H508 Y515	E506-Y513 WeakPolarHBondContact OE2-CB 3.29Å; E506-Y513 WeakPolarHBondContact OE2-CD2 3.36Å; H508-Y513 HydrophobicContact CB-CD2 3.96Å; H508-Y513 HydrophobicContact CB-CE2 4.29Å; H508-Y513 AromaticContact CD2-CD2 3.91Å; H508-Y513 AromaticContact CD2-CE2 3.4Å; H508-Y513 WeakPolarHBondContact CD2-CE2 3.45Å; H508-Y513 AromaticContact CD2-CZ 3.84Å; Y513-Y515 WeakPolarHBondContact O-CD1 3.16Å
514	D	94.8	Very high	92	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.278	C	S	.	.	S	Bend	trans	-82	136.3	174.5	-54.5	-22.4	0	0	0	111.8	Y478 I505 E506 C533 V553 S554 D555	Y478-D514 HydrophobicContact CE2-CB 4.43Å; Y478-D514 WeakPolarHBondContact CE2-OD2 3.35Å; Y478-D514 PolarHBondContact OH-OD2 2.85Å; I505-D514 HydrophobicContact CG2-CB 3.46Å; I505-D514 VanDerWaalsContact CG2-CB 3.46Å; I505-D514 WeakPolarHBondContact CG2-O 3.34Å; E506-D514 HydrophobicContact CB-CB 3.94Å; D514-C533 WeakPolarHBondContact O-CB 3.49Å; D514-V553 WeakPolarHBondContact CA-O 3.43Å; D514-S554 WeakPolarHBondContact OD1-CA 3.18Å; D514-S554 WeakPolarHBondContact OD1-CB 3.46Å; D514-D555 PolarHBondContact OD1-N 3.05Å
515	Y	95.3	Very high	92.1	Very high	47 Å²	47	59.2 Å²	59.2	18%	0.184	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	157.1	-179.7	67.3	-96.1	0	0	0	114.4	Y513 E517 H531 F532 F552 V553	Y513-Y515 WeakPolarHBondContact O-CD1 3.16Å; Y515-E517 HydrophobicContact CD2-CB 3.98Å; Y515-E517 HydrophobicContact CE2-CB 3.87Å; Y515-H531 AromaticContact CD1-NE2 3.86Å; Y515-H531 AromaticContact CD2-CD2 3.57Å; Y515-H531 AromaticContact CD2-NE2 3.21Å; Y515-H531 WeakPolarHBondContact CD2-NE2 3.14Å; Y515-H531 AromaticContact CE2-CD2 3.9Å; Y515-H531 AromaticContact CE2-NE2 3.49Å; Y515-H531 WeakPolarHBondContact CE2-NE2 3.29Å; Y515-H531 AromaticContact CG-CE1 3.85Å; Y515-H531 AromaticContact CG-NE2 3.39Å; Y515-H531 AromaticContact CZ-NE2 3.92Å; Y515-F532 CarbonylContact C-O 3.57Å; Y515-F532 WeakPolarHBondContact CA-O 3.13Å; Y515-F552 WeakPolarHBondContact O-CA 3.31Å; Y515-F552 VanDerWaalsContact O-CD2 3.24Å; Y515-F552 WeakPolarHBondContact O-CD2 3.35Å; Y515-V553 HydrophobicContact CD1-CB 4.13Å; Y515-V553 HydrophobicContact CE1-CB 3.73Å; Y515-V553 HydrophobicContact CE1-CG1 4.13Å; Y515-V553 HydrophobicContact CE1-CG2 4.03Å; Y515-V553 HydrophobicContact CE2-CB 4.27Å; Y515-V553 HydrophobicContact CE2-CG2 3.94Å; Y515-V553 PolarHBondContact N-O 2.82Å; Y515-V553 PolarHBondContact O-N 3.08Å
516	L	95.9	Very high	92.1	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.8	166.6	-175.3	66.6	0	0	0	110.1	F500 F503 I505 I518 H531 F532 M550 F552 F563	F500-L516 HydrophobicContact CE1-CD2 3.52Å; F500-L516 HydrophobicContact CZ-CD2 3.54Å; F503-L516 HydrophobicContact CE2-CB 4.11Å; F503-L516 HydrophobicContact CE2-CD2 3.85Å; F503-L516 HydrophobicContact CZ-CB 4.41Å; I505-L516 HydrophobicContact CD1-CB 3.87Å; L516-I518 HydrophobicContact CD2-CD1 4.16Å; L516-I518 HydrophobicContact CG-CD1 4.38Å; L516-I518 HydrophobicContact CG-CG1 4.3Å; L516-H531 WeakPolarHBondContact O-CA 3.48Å; L516-F532 PolarHBondContact N-O 3.28Å; L516-F532 WeakPolarHBondContact O-CD2 3.39Å; L516-F532 PolarHBondContact O-N 2.89Å; L516-M550 HydrophobicContact CD1-CG 3.62Å; L516-M550 HydrophobicContact CD1-SD 3.94Å; L516-M550 HydrophobicContact CD2-SD 4.18Å; L516-M550 HydrophobicContact CG-CG 4.35Å; L516-M550 HydrophobicContact CG-SD 4.41Å; L516-F552 HydrophobicContact CD1-CB 3.92Å; L516-F563 HydrophobicContact CD1-CE1 3.74Å; L516-F563 HydrophobicContact CD1-CE2 4.27Å; L516-F563 HydrophobicContact CD1-CZ 3.56Å; L516-F563 HydrophobicContact CD2-CD1 4.22Å; L516-F563 HydrophobicContact CD2-CD2 4.18Å; L516-F563 HydrophobicContact CD2-CE1 4.14Å; L516-F563 HydrophobicContact CD2-CE2 4.09Å; L516-F563 HydrophobicContact CD2-CG 4.25Å; L516-F563 HydrophobicContact CD2-CZ 4.08Å; L516-F563 HydrophobicContact CG-CE1 4.4Å; L516-F563 HydrophobicContact CG-CZ 4.44Å
517	E	95.5	Very high	92.2	Very high	21 Å²	21	62.8 Å²	62.8	10%	0.098	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.9	-179.9	-172.8	-176.4	161.3	0	0	110.1	Y515 R519 L528 W549 M550 K551	Y515-E517 HydrophobicContact CD2-CB 3.98Å; Y515-E517 HydrophobicContact CE2-CB 3.87Å; E517-R519 IonicContact OE1-CZ 2.68Å; E517-R519 IonicContact OE1-NE 3.94Å; E517-R519 PolarHBondContact OE1-NE 3.42Å; E517-R519 IonicContact OE1-NH2 3.14Å; E517-R519 PolarHBondContact OE1-NH2 3Å; E517-L528 HydrophobicContact CG-CD1 3.68Å; E517-W549 HydrophobicContact CG-CZ3 4.3Å; E517-M550 CarbonylContact O-C 3.57Å; E517-M550 WeakPolarHBondContact O-CA 3.33Å; E517-K551 HydrophobicContact CB-CB 4.41Å; E517-K551 PolarHBondContact N-O 2.67Å; E517-K551 PolarHBondContact O-N 3.37Å
518	I	96.9	Very high	92.4	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.8	-176.3	-57.9	177	0	0	0	109.7	L498 F500 L516 I529 G530 F532 I541 L548 M550	L498-I518 HydrophobicContact CD2-CD1 3.66Å; F500-I518 HydrophobicContact CE2-CD1 4.25Å; F500-I518 HydrophobicContact CZ-CD1 3.88Å; L516-I518 HydrophobicContact CD2-CD1 4.16Å; L516-I518 HydrophobicContact CG-CD1 4.38Å; L516-I518 HydrophobicContact CG-CG1 4.3Å; I518-I529 HydrophobicContact CG2-CB 4.34Å; I518-I529 HydrophobicContact CG2-CD1 4.18Å; I518-I529 WeakPolarHBondContact O-CB 3.42Å; I518-I529 PolarHBondContact O-N 3.23Å; I518-G530 PolarHBondContact N-O 2.89Å; I518-G530 PolarHBondContact O-N 2.92Å; I518-F532 HydrophobicContact CB-CE2 4.42Å; I518-F532 HydrophobicContact CD1-CD2 4.22Å; I518-F532 HydrophobicContact CD1-CE2 3.95Å; I518-F532 HydrophobicContact CG1-CE2 4.3Å; I518-I541 HydrophobicContact CD1-CD1 3.61Å; I518-I541 HydrophobicContact CG2-CD1 4.37Å; I518-I541 HydrophobicContact CG2-CG2 4.4Å; I518-L548 HydrophobicContact CG2-CD1 3.92Å; I518-L548 HydrophobicContact CG2-CD2 4.13Å; I518-L548 HydrophobicContact CG2-CG 4.16Å; I518-M550 HydrophobicContact CD1-SD 4.16Å; I518-M550 HydrophobicContact CG1-CG 3.98Å; I518-M550 HydrophobicContact CG1-SD 4.19Å
519	R	96.4	Very high	92.6	Very high	50 Å²	50	59.9 Å²	59.9	19%	0.189	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.4	-176.6	-57.9	-176.3	169.1	-97.7	-1.2	112.3	E517 G521 E524 S526 P527 L528 L548 W549	E517-R519 IonicContact OE1-CZ 2.68Å; E517-R519 IonicContact OE1-NE 3.94Å; E517-R519 PolarHBondContact OE1-NE 3.42Å; E517-R519 IonicContact OE1-NH2 3.14Å; E517-R519 PolarHBondContact OE1-NH2 3Å; R519-G521 PolarHBondContact O-N 2.88Å; R519-E524 VanDerWaalsContact CD-O 3.3Å; R519-E524 WeakPolarHBondContact CD-O 3.27Å; R519-E524 PolarHBondContact NE-O 3.29Å; R519-E524 VanDerWaalsContact NE-O 3.12Å; R519-E524 PolarHBondContact NH1-O 3.37Å; R519-S526 WeakPolarHBondContact CD-O 3.38Å; R519-S526 PolarHBondContact NH1-O 3.01Å; R519-P527 CarbonylContact C-O 3.57Å; R519-P527 WeakPolarHBondContact CA-O 3.46Å; R519-P527 WeakPolarHBondContact CB-O 3.49Å; R519-L528 HydrophobicContact CG-CD1 4.08Å; R519-L548 WeakPolarHBondContact O-CD1 3.41Å; R519-W549 HydrophobicContact CB-CB 4.41Å; R519-W549 HydrophobicContact CB-CE3 3.84Å; R519-W549 HydrophobicContact CG-CE3 3.66Å; R519-W549 HydrophobicContact CG-CZ3 3.88Å; R519-W549 PolarHBondContact N-O 3.26Å; R519-W549 PolarHBondContact O-N 3.18Å
520	D	94.7	Very high	92.9	Very high	23 Å²	23	53.4 Å²	53.4	12%	0.123	29%	0.29	C	S	.	.	S	Bend	trans	-86	85.6	-178.5	-169.4	3.5	0	0	0	111.1	S526 P527 I529 S543 T544	D520-S526 WeakPolarHBondContact O-CB 3.13Å; D520-P527 HydrophobicContact CB-CB 4.5Å; D520-P527 PolarHBondContact N-O 2.77Å; D520-P527 WeakPolarHBondContact O-CD 3.44Å; D520-I529 HydrophobicContact CB-CD1 3.9Å; D520-I529 HydrophobicContact CB-CG1 3.92Å; D520-S543 WeakPolarHBondContact OD1-CA 3.29Å; D520-S543 VanDerWaalsContact OD1-CB 3.25Å; D520-S543 WeakPolarHBondContact OD1-CB 3.27Å; D520-T544 VanDerWaalsContact CG-N 3.26Å; D520-T544 VanDerWaalsContact CG-OG1 3.31Å; D520-T544 PolarHBondContact OD1-N 2.8Å; D520-T544 PolarHBondContact OD1-OG1 2.98Å; D520-T544 WeakPolarHBondContact OD2-CB 3.1Å; D520-T544 WeakPolarHBondContact OD2-CG2 3.29Å; D520-T544 PolarHBondContact OD2-N 3.25Å; D520-T544 PolarHBondContact OD2-OG1 2.89Å
521	G	92.1	Very high	93.3	Very high	9 Å²	9	50.7 Å²	50.7	9%	0.093	27%	0.273	C	S	.	.	S	Bend	trans	155.4	-147.5	-178.5	0	0	0	0	0	113.3	R519 T547 L548 W549	R519-G521 PolarHBondContact O-N 2.88Å; G521-T547 WeakPolarHBondContact CA-OG1 3.01Å; G521-T547 PolarHBondContact N-O 3.5Å; G521-T547 CarbonylContact O-C 3.57Å; G521-L548 CarbonylContact O-C 3.54Å; G521-L548 WeakPolarHBondContact O-CA 3.4Å; G521-L548 PolarHBondContact O-N 3.49Å; G521-W549 WeakPolarHBondContact O-CB 3.44Å; G521-W549 PolarHBondContact O-N 3.49Å; G521-W549 VanDerWaalsContact O-N 3.11Å
522	T	89.6	Confident	93.5	Very high	64 Å²	64	52.4 Å²	52.4	39%	0.393	28%	0.279	S	S	.	.	S	Bend	trans	-114.9	-7	-170	53.8	0	0	0	0	115	K487 S526 T547	K487-T522 WeakPolarHBondContact CD-O 2.95Å; T522-S526 PolarHBondContact N-OG 2.9Å; T522-T547 HydrophobicContact CG2-CG2 3.7Å
523	N	91.4	Very high	93.8	Very high	70 Å²	70	50.2 Å²	50.2	37%	0.374	26%	0.259	S	S	.	.	S	Bend	trans	-154.8	169.7	-169.7	64.5	79.2	0	0	0	113.7	N525 S526	N523-N525 PolarHBondContact O-N 3.05Å; N523-N525 VanDerWaalsContact O-N 3.13Å; N523-N525 WeakPolarHBondContact OD1-CA 2.91Å; N523-N525 WeakPolarHBondContact OD1-CB 3.16Å; N523-N525 PolarHBondContact OD1-N 2.67Å; N523-S526 PolarHBondContact N-OG 3.11Å; N523-S526 VanDerWaalsContact O-CB 3.25Å; N523-S526 WeakPolarHBondContact O-CB 3.38Å; N523-S526 PolarHBondContact O-N 3.06Å; N523-S526 PolarHBondContact O-OG 2.85Å
524	E	90.2	Very high	93.9	Very high	99 Å²	99	45.3 Å²	45.3	46%	0.463	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-24.6	-178.7	-73.1	-179.8	153.4	0	0	114.9	R519 S526 W549 K551	R519-E524 VanDerWaalsContact CD-O 3.3Å; R519-E524 WeakPolarHBondContact CD-O 3.27Å; R519-E524 PolarHBondContact NE-O 3.29Å; R519-E524 VanDerWaalsContact NE-O 3.12Å; R519-E524 PolarHBondContact NH1-O 3.37Å; E524-S526 VanDerWaalsContact C-N 3.33Å; E524-W549 HydrophobicContact CB-CH2 4.45Å; E524-W549 HydrophobicContact CB-CZ2 4.29Å; E524-W549 HydrophobicContact CG-CH2 3.51Å; E524-W549 HydrophobicContact CG-CZ2 3.16Å; E524-K551 IonicContact OE1-NZ 2.77Å; E524-K551 PolarHBondContact OE1-NZ 3.39Å
525	N	91.8	Very high	93.6	Very high	152 Å²	152	50.2 Å²	50.2	81%	0.813	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.3	178.5	-59.8	-40	0	0	0	113.3	N523	N523-N525 PolarHBondContact O-N 3.05Å; N523-N525 VanDerWaalsContact O-N 3.13Å; N523-N525 WeakPolarHBondContact OD1-CA 2.91Å; N523-N525 WeakPolarHBondContact OD1-CB 3.16Å; N523-N525 PolarHBondContact OD1-N 2.67Å
526	S	94.3	Very high	93.2	Very high	11 Å²	11	53.8 Å²	53.8	8%	0.077	28%	0.282	C	S	.	.	S	Bend	trans	-69.6	154.6	179.3	-40.9	0	0	0	0	110.7	R519 D520 T522 N523 E524 L528	R519-S526 WeakPolarHBondContact CD-O 3.38Å; R519-S526 PolarHBondContact NH1-O 3.01Å; D520-S526 WeakPolarHBondContact O-CB 3.13Å; T522-S526 PolarHBondContact N-OG 2.9Å; N523-S526 PolarHBondContact N-OG 3.11Å; N523-S526 VanDerWaalsContact O-CB 3.25Å; N523-S526 WeakPolarHBondContact O-CB 3.38Å; N523-S526 PolarHBondContact O-N 3.06Å; N523-S526 PolarHBondContact O-OG 2.85Å; E524-S526 VanDerWaalsContact C-N 3.33Å; S526-L528 PolarHBondContact O-N 3.08Å
527	P	95.4	Very high	92.7	Very high	92 Å²	92	58.7 Å²	58.7	60%	0.597	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-50.4	131.5	178.8	-28.9	35.5	0	0	0	113	R519 D520 I529	R519-P527 CarbonylContact C-O 3.57Å; R519-P527 WeakPolarHBondContact CA-O 3.46Å; R519-P527 WeakPolarHBondContact CB-O 3.49Å; D520-P527 HydrophobicContact CB-CB 4.5Å; D520-P527 PolarHBondContact N-O 2.77Å; D520-P527 WeakPolarHBondContact O-CD 3.44Å; P527-I529 PolarHBondContact O-N 3.43Å
528	L	95.1	Very high	92.5	Very high	92 Å²	92	58 Å²	58	48%	0.482	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.7	177.8	-175.9	69.4	0	0	0	109.9	E517 R519 S526 G530	E517-L528 HydrophobicContact CG-CD1 3.68Å; R519-L528 HydrophobicContact CG-CD1 4.08Å; S526-L528 PolarHBondContact O-N 3.08Å; L528-G530 WeakPolarHBondContact CD1-O 3.33Å
529	I	94.6	Very high	92.1	Very high	64 Å²	64	66.3 Å²	66.3	33%	0.328	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-46.3	170.2	-57.7	-174.5	0	0	0	109.2	I518 D520 P527 I541 L548	I518-I529 HydrophobicContact CG2-CB 4.34Å; I518-I529 HydrophobicContact CG2-CD1 4.18Å; I518-I529 WeakPolarHBondContact O-CB 3.42Å; I518-I529 PolarHBondContact O-N 3.23Å; D520-I529 HydrophobicContact CB-CD1 3.9Å; D520-I529 HydrophobicContact CB-CG1 3.92Å; P527-I529 PolarHBondContact O-N 3.43Å; I529-I541 HydrophobicContact CD1-CG2 3.75Å; I529-I541 HydrophobicContact CG2-CD1 4.24Å; I529-I541 HydrophobicContact CG2-CG1 4.16Å; I529-I541 HydrophobicContact CG2-CG2 3.96Å; I529-L548 HydrophobicContact CD1-CD1 3.67Å
530	G	92.4	Very high	91.7	Very high	12 Å²	12	68 Å²	68	12%	0.124	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.8	167.6	178.3	0	0	0	0	0	114	I518 L528 F532	I518-G530 PolarHBondContact N-O 2.89Å; I518-G530 PolarHBondContact O-N 2.92Å; L528-G530 WeakPolarHBondContact CD1-O 3.33Å; G530-F532 VanDerWaalsContact C-CE2 3.47Å
531	H	94.2	Very high	91.6	Very high	71 Å²	71	67.5 Å²	67.5	33%	0.329	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	109.8	-176.2	-175.7	-98.5	0	0	0	107.1	C511 Y515 L516	C511-H531 PolarHBondContact O-CE1 2.98Å; C511-H531 VanDerWaalsContact O-CE1 3.26Å; Y515-H531 AromaticContact CD1-NE2 3.86Å; Y515-H531 AromaticContact CD2-CD2 3.57Å; Y515-H531 AromaticContact CD2-NE2 3.21Å; Y515-H531 WeakPolarHBondContact CD2-NE2 3.14Å; Y515-H531 AromaticContact CE2-CD2 3.9Å; Y515-H531 AromaticContact CE2-NE2 3.49Å; Y515-H531 WeakPolarHBondContact CE2-NE2 3.29Å; Y515-H531 AromaticContact CG-CE1 3.85Å; Y515-H531 AromaticContact CG-NE2 3.39Å; Y515-H531 AromaticContact CZ-NE2 3.92Å; L516-H531 WeakPolarHBondContact O-CA 3.48Å
532	F	95.5	Very high	91.5	Very high	50 Å²	50	73 Å²	73	22%	0.219	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	140.9	-158.1	-54.1	-80	0	0	0	111.7	F503 Y515 L516 I518 G530 P538 I541	F503-F532 HydrophobicContact CE1-CB 4.23Å; F503-F532 HydrophobicContact CE2-CB 4.18Å; F503-F532 HydrophobicContact CZ-CB 3.51Å; Y515-F532 CarbonylContact C-O 3.57Å; Y515-F532 WeakPolarHBondContact CA-O 3.13Å; L516-F532 PolarHBondContact N-O 3.28Å; L516-F532 WeakPolarHBondContact O-CD2 3.39Å; L516-F532 PolarHBondContact O-N 2.89Å; I518-F532 HydrophobicContact CB-CE2 4.42Å; I518-F532 HydrophobicContact CD1-CD2 4.22Å; I518-F532 HydrophobicContact CD1-CE2 3.95Å; I518-F532 HydrophobicContact CG1-CE2 4.3Å; G530-F532 VanDerWaalsContact C-CE2 3.47Å; F532-P538 HydrophobicContact CB-CG 4.09Å; F532-P538 HydrophobicContact CD1-CB 3.9Å; F532-P538 HydrophobicContact CD1-CG 3.78Å; F532-P538 HydrophobicContact CD2-CG 4.4Å; F532-P538 HydrophobicContact CE1-CB 3.87Å; F532-P538 HydrophobicContact CE1-CG 4.28Å; F532-P538 HydrophobicContact CG-CB 4.3Å; F532-P538 HydrophobicContact CG-CG 3.84Å; F532-P538 HydrophobicContact CZ-CB 4.25Å; F532-I541 HydrophobicContact CE2-CD1 3.91Å; F532-I541 HydrophobicContact CZ-CD1 3.94Å
533	C	94.3	Very high	91.7	Very high	21 Å²	21	70 Å²	70	14%	0.142	35%	0.349	C	S	.	.			trans	-157.9	175.2	174.2	70	0	0	0	0	110.3	I505 E506 H508 C511 D514	I505-C533 HydrophobicContact CG2-CB 4.19Å; E506-C533 VanDerWaalsContact O-CB 3.31Å; E506-C533 WeakPolarHBondContact O-CB 3.17Å; H508-C533 PolarHBondContact O-SG 2.84Å; C511-C533 WeakPolarHBondContact CA-SG 3.24Å; C511-C533 HydrophobicContact CB-CB 3.51Å; C511-C533 WeakPolarHBondContact CB-SG 3.36Å; C511-C533 WeakPolarHBondContact SG-CB 3.44Å; C511-C533 PolarHBondContact SG-N 3.14Å; C511-C533 VanDerWaalsContact SG-N 3.36Å; C511-C533 CovalentContact SG-SG 2.03Å; C511-C533 PolarHBondContact SG-SG 3.48Å; D514-C533 WeakPolarHBondContact O-CB 3.49Å
534	G	91.7	Very high	91.7	Very high	2 Å²	2	72.2 Å²	72.2	2%	0.021	37%	0.365	C	S	.	.	S	Bend	trans	79.3	-153.3	-175.3	0	0	0	0	0	114.2	I505 E506	I505-G534 PolarHBondContact N-O 3.07Å; I505-G534 CarbonylContact O-C 3.53Å; I505-G534 WeakPolarHBondContact O-CA 3.47Å; I505-G534 PolarHBondContact O-N 2.97Å; I505-G534 VanDerWaalsContact O-N 3.17Å; E506-G534 PolarHBondContact O-N 2.96Å; E506-G534 VanDerWaalsContact O-N 3.14Å
535	Y	87.8	Confident	91.7	Very high	105 Å²	105	69.2 Å²	69.2	41%	0.412	36%	0.355	S	S	.	.	S	Bend	trans	-110.8	-7.2	-169.4	-51.5	-85.2	0	0	0	113.7	E504 R507 K537 K560	E504-Y535 HydrophobicContact CB-CD1 4.19Å; E504-Y535 HydrophobicContact CG-CD1 4.03Å; R507-Y535 HydrophobicContact CB-CE2 4.22Å; Y535-K537 PolarHBondContact O-N 3.34Å; Y535-K560 HydrophobicContact CE1-CD 4.35Å; Y535-K560 VanDerWaalsContact OH-CE 3.3Å; Y535-K560 WeakPolarHBondContact OH-CE 3.02Å; Y535-K560 PolarHBondContact OH-NZ 2.84Å
536	D	87.3	Confident	91.8	Very high	121 Å²	121	64.2 Å²	64.2	65%	0.647	33%	0.329	S	S	*	.	S	Bend	trans	-80.1	113.2	-179.4	-62.9	-53	0	0	0	108.4	P538	D536-P538 WeakPolarHBondContact O-CD 3.38Å
537	K	86.4	Confident	91.7	Very high	104 Å²	104	64.6 Å²	64.6	45%	0.452	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-59.1	125.8	-178.6	-166.4	-156.9	108.8	155.6	0	109.5	F500 F503 Y535 D540	F500-K537 HydrophobicContact CB-CD 3.89Å; F500-K537 HydrophobicContact CB-CG 3.65Å; F500-K537 WeakPolarHBondContact O-CD 3.34Å; F500-K537 WeakPolarHBondContact O-CE 3.09Å; F500-K537 PolarHBondContact O-NZ 3.03Å; F503-K537 HydrophobicContact CB-CG 4.43Å; Y535-K537 PolarHBondContact O-N 3.34Å; K537-D540 IonicContact NZ-OD1 3.52Å; K537-D540 PolarHBondContact NZ-OD1 2.86Å
538	P	90.8	Very high	91.7	Very high	6 Å²	6	60.2 Å²	60.2	4%	0.039	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-56.6	147.6	172.1	-24.5	33.7	0	0	0	111.7	F500 F503 F532 D536	F500-P538 HydrophobicContact CD2-CB 3.77Å; F500-P538 HydrophobicContact CD2-CG 3.98Å; F500-P538 HydrophobicContact CE2-CB 3.75Å; F500-P538 HydrophobicContact CE2-CG 3.9Å; F500-P538 HydrophobicContact CG-CG 4.4Å; F500-P538 HydrophobicContact CZ-CG 4.24Å; F503-P538 HydrophobicContact CD1-CG 4.39Å; F503-P538 HydrophobicContact CD2-CG 3.95Å; F503-P538 HydrophobicContact CE1-CG 4.37Å; F503-P538 HydrophobicContact CE2-CG 3.95Å; F503-P538 VanDerWaalsContact CG-CD 3.48Å; F503-P538 HydrophobicContact CG-CG 4.18Å; F503-P538 HydrophobicContact CZ-CG 4.16Å; F532-P538 HydrophobicContact CB-CG 4.09Å; F532-P538 HydrophobicContact CD1-CB 3.9Å; F532-P538 HydrophobicContact CD1-CG 3.78Å; F532-P538 HydrophobicContact CD2-CG 4.4Å; F532-P538 HydrophobicContact CE1-CB 3.87Å; F532-P538 HydrophobicContact CE1-CG 4.28Å; F532-P538 HydrophobicContact CG-CB 4.3Å; F532-P538 HydrophobicContact CG-CG 3.84Å; F532-P538 HydrophobicContact CZ-CB 4.25Å; D536-P538 WeakPolarHBondContact O-CD 3.38Å
539	E	88.9	Confident	91.8	Very high	174 Å²	174	56.1 Å²	56.1	81%	0.813	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-61.1	160.8	168.6	-63.9	-170.9	161.6	0	0	110.7	I541	E539-I541 PolarHBondContact O-N 3.1Å
540	D	88.4	Confident	91.8	Very high	86 Å²	86	53 Å²	53	46%	0.46	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-73.2	128.7	-177.4	-63	-30.7	0	0	0	109.9	T499 K537 L590	T499-D540 HydrophobicContact CG2-CB 4.12Å; K537-D540 IonicContact NZ-OD1 3.52Å; K537-D540 PolarHBondContact NZ-OD1 2.86Å; D540-L590 HydrophobicContact CB-CB 4.46Å; D540-L590 HydrophobicContact CB-CD2 3.95Å
541	I	91.7	Very high	91.9	Very high	12 Å²	12	53.5 Å²	53.5	6%	0.062	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	138.7	-166	-74.2	166.6	0	0	0	111.2	G497 L498 F500 I518 I529 F532 E539 L590	G497-I541 CarbonylContact C-O 3.6Å; G497-I541 WeakPolarHBondContact CA-O 3.22Å; L498-I541 HydrophobicContact CB-CB 4.25Å; L498-I541 PolarHBondContact N-O 2.83Å; L498-I541 PolarHBondContact O-N 3.35Å; F500-I541 HydrophobicContact CE2-CD1 4.38Å; I518-I541 HydrophobicContact CD1-CD1 3.61Å; I518-I541 HydrophobicContact CG2-CD1 4.37Å; I518-I541 HydrophobicContact CG2-CG2 4.4Å; I529-I541 HydrophobicContact CD1-CG2 3.75Å; I529-I541 HydrophobicContact CG2-CD1 4.24Å; I529-I541 HydrophobicContact CG2-CG1 4.16Å; I529-I541 HydrophobicContact CG2-CG2 3.96Å; F532-I541 HydrophobicContact CE2-CD1 3.91Å; F532-I541 HydrophobicContact CZ-CD1 3.94Å; E539-I541 PolarHBondContact O-N 3.1Å; I541-L590 WeakPolarHBondContact O-CD2 3.38Å
542	R	90.9	Very high	91.9	Very high	125 Å²	125	50.1 Å²	50.1	47%	0.472	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.3	172.6	-168.7	172.8	68.8	169.9	4	110.9	N495 V496 E570 L590	N495-R542 HydrophobicContact CB-CG 4.22Å; V496-R542 WeakPolarHBondContact O-CA 3.34Å; R542-E570 HydrophobicContact CG-CG 4Å; R542-L590 HydrophobicContact CB-CD1 3.79Å; R542-L590 HydrophobicContact CG-CD1 4.23Å
543	S	92.8	Very high	91.8	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.007	25%	0.245	C	C	.	.			trans	-75.3	156.9	169.1	61.7	0	0	0	0	112	N495 V496 D520 S545	N495-S543 WeakPolarHBondContact CB-O 3.23Å; N495-S543 PolarHBondContact ND2-O 3.44Å; V496-S543 WeakPolarHBondContact CA-OG 3.36Å; V496-S543 WeakPolarHBondContact CB-OG 3.37Å; V496-S543 PolarHBondContact N-OG 3.07Å; V496-S543 PolarHBondContact O-N 3.47Å; V496-S543 PolarHBondContact O-OG 3.33Å; D520-S543 WeakPolarHBondContact OD1-CA 3.29Å; D520-S543 VanDerWaalsContact OD1-CB 3.25Å; D520-S543 WeakPolarHBondContact OD1-CB 3.27Å; S543-S545 WeakPolarHBondContact CB-O 3.46Å; S543-S545 PolarHBondContact OG-O 3.11Å
544	T	90.6	Very high	91.8	Very high	117 Å²	117	48.4 Å²	48.4	72%	0.718	24%	0.24	S	C	*	.	S	Bend	trans	-85.2	-17.2	171	61.7	0	0	0	0	113.1	N495 D520	N495-T544 PolarHBondContact ND2-O 3.5Å; D520-T544 VanDerWaalsContact CG-N 3.26Å; D520-T544 VanDerWaalsContact CG-OG1 3.31Å; D520-T544 PolarHBondContact OD1-N 2.8Å; D520-T544 PolarHBondContact OD1-OG1 2.98Å; D520-T544 WeakPolarHBondContact OD2-CB 3.1Å; D520-T544 WeakPolarHBondContact OD2-CG2 3.29Å; D520-T544 PolarHBondContact OD2-N 3.25Å; D520-T544 PolarHBondContact OD2-OG1 2.89Å
545	S	91	Very high	91.7	Very high	36 Å²	36	50.5 Å²	50.5	25%	0.252	25%	0.251	S	S	.	.	S	Bend	trans	-112.6	176.4	175.7	74.6	0	0	0	0	112.7	S543 T547	S543-S545 WeakPolarHBondContact CB-O 3.46Å; S543-S545 PolarHBondContact OG-O 3.11Å; S545-T547 PolarHBondContact O-N 3.31Å; S545-T547 VanDerWaalsContact O-N 3.14Å; S545-T547 PolarHBondContact OG-N 3.25Å; S545-T547 VanDerWaalsContact OG-N 3.13Å; S545-T547 PolarHBondContact OG-O 3.19Å; S545-T547 PolarHBondContact OG-OG1 2.87Å
546	N	93.2	Very high	91.7	Very high	47 Å²	47	47.4 Å²	47.4	25%	0.251	25%	0.251	S	S	.	.	S	Bend	trans	-75.1	12.1	169.8	74.6	-53.4	0	0	0	113.7	T489 V490 Y494	T489-N546 WeakPolarHBondContact CA-O 3.38Å; V490-N546 HydrophobicContact CG2-CB 3.91Å; V490-N546 PolarHBondContact N-O 3.47Å; V490-N546 PolarHBondContact O-ND2 2.03Å; Y494-N546 WeakPolarHBondContact O-CA 3.3Å; Y494-N546 WeakPolarHBondContact O-CB 3.48Å; Y494-N546 PolarHBondContact O-N 3.15Å
547	T	93.9	Very high	91.6	Very high	19 Å²	19	45.4 Å²	45.4	12%	0.117	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142.2	-178.3	62.1	0	0	0	0	112.3	I488 T489 G521 T522 S545	I488-T547 CarbonylContact O-C 3.49Å; I488-T547 VanDerWaalsContact O-CA 3.26Å; I488-T547 WeakPolarHBondContact O-CA 3.08Å; T489-T547 HydrophobicContact CG2-CG2 4.12Å; G521-T547 WeakPolarHBondContact CA-OG1 3.01Å; G521-T547 PolarHBondContact N-O 3.5Å; G521-T547 CarbonylContact O-C 3.57Å; T522-T547 HydrophobicContact CG2-CG2 3.7Å; S545-T547 PolarHBondContact O-N 3.31Å; S545-T547 VanDerWaalsContact O-N 3.14Å; S545-T547 PolarHBondContact OG-N 3.25Å; S545-T547 VanDerWaalsContact OG-N 3.13Å; S545-T547 PolarHBondContact OG-O 3.19Å; S545-T547 PolarHBondContact OG-OG1 2.87Å
548	L	95.3	Very high	91.4	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	137.5	174	-168.7	79.3	0	0	0	109.3	I488 V496 L498 I518 R519 G521 I529	I488-L548 HydrophobicContact CB-CB 4.34Å; I488-L548 HydrophobicContact CD1-CD2 4.19Å; I488-L548 PolarHBondContact N-O 3.35Å; I488-L548 PolarHBondContact O-N 3.48Å; V496-L548 HydrophobicContact CB-CB 3.94Å; V496-L548 HydrophobicContact CG1-CB 3.93Å; V496-L548 HydrophobicContact CG1-CD2 4.18Å; V496-L548 HydrophobicContact CG2-CB 4.04Å; L498-L548 HydrophobicContact CB-CD2 4.16Å; L498-L548 HydrophobicContact CD2-CD2 4.07Å; I518-L548 HydrophobicContact CG2-CD1 3.92Å; I518-L548 HydrophobicContact CG2-CD2 4.13Å; I518-L548 HydrophobicContact CG2-CG 4.16Å; R519-L548 WeakPolarHBondContact O-CD1 3.41Å; G521-L548 CarbonylContact O-C 3.54Å; G521-L548 WeakPolarHBondContact O-CA 3.4Å; G521-L548 PolarHBondContact O-N 3.49Å; I529-L548 HydrophobicContact CD1-CD1 3.67Å
549	W	96	Very high	91.2	Very high	5 Å²	5	46 Å²	46	2%	0.019	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	133	177.7	-179.4	97.5	0	0	0	109.3	V485 E517 R519 G521 E524 K551	V485-W549 HydrophobicContact CG1-CZ2 3.75Å; V485-W549 HydrophobicContact CG2-CZ2 4.34Å; E517-W549 HydrophobicContact CG-CZ3 4.3Å; R519-W549 HydrophobicContact CB-CB 4.41Å; R519-W549 HydrophobicContact CB-CE3 3.84Å; R519-W549 HydrophobicContact CG-CE3 3.66Å; R519-W549 HydrophobicContact CG-CZ3 3.88Å; R519-W549 PolarHBondContact N-O 3.26Å; R519-W549 PolarHBondContact O-N 3.18Å; G521-W549 WeakPolarHBondContact O-CB 3.44Å; G521-W549 PolarHBondContact O-N 3.49Å; G521-W549 VanDerWaalsContact O-N 3.11Å; E524-W549 HydrophobicContact CB-CH2 4.45Å; E524-W549 HydrophobicContact CB-CZ2 4.29Å; E524-W549 HydrophobicContact CG-CH2 3.51Å; E524-W549 HydrophobicContact CG-CZ2 3.16Å; W549-K551 HydrophobicContact CE3-CB 4.47Å; W549-K551 HydrophobicContact CH2-CB 3.23Å; W549-K551 HydrophobicContact CH2-CD 3.46Å; W549-K551 VanDerWaalsContact CH2-CD 3.46Å; W549-K551 HydrophobicContact CH2-CG 3.98Å; W549-K551 HydrophobicContact CZ2-CB 3.76Å; W549-K551 HydrophobicContact CZ2-CD 3.91Å; W549-K551 HydrophobicContact CZ2-CG 4.43Å; W549-K551 HydrophobicContact CZ3-CB 3.62Å; W549-K551 HydrophobicContact CZ3-CD 4.48Å
550	M	94.6	Very high	91.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135.2	-175	-179.4	166.8	74.1	0	0	110.7	I469 V485 W486 L498 L516 E517 I518 F563	I469-M550 HydrophobicContact CB-CE 3.97Å; I469-M550 HydrophobicContact CD1-CE 3.64Å; I469-M550 HydrophobicContact CG1-CE 4.41Å; I469-M550 HydrophobicContact CG2-CE 3.51Å; V485-M550 CarbonylContact C-O 3.58Å; V485-M550 WeakPolarHBondContact CA-O 3.21Å; W486-M550 HydrophobicContact CD2-CE 4.11Å; W486-M550 HydrophobicContact CE3-CB 4.43Å; W486-M550 HydrophobicContact CE3-CE 3.74Å; W486-M550 HydrophobicContact CE3-CG 4.13Å; W486-M550 HydrophobicContact CG-CE 4.49Å; W486-M550 HydrophobicContact CZ3-CE 4.21Å; W486-M550 PolarHBondContact N-O 3.12Å; W486-M550 PolarHBondContact O-N 3.28Å; L498-M550 HydrophobicContact CD2-SD 4.16Å; L516-M550 HydrophobicContact CD1-CG 3.62Å; L516-M550 HydrophobicContact CD1-SD 3.94Å; L516-M550 HydrophobicContact CD2-SD 4.18Å; L516-M550 HydrophobicContact CG-CG 4.35Å; L516-M550 HydrophobicContact CG-SD 4.41Å; E517-M550 CarbonylContact O-C 3.57Å; E517-M550 WeakPolarHBondContact O-CA 3.33Å; I518-M550 HydrophobicContact CD1-SD 4.16Å; I518-M550 HydrophobicContact CG1-CG 3.98Å; I518-M550 HydrophobicContact CG1-SD 4.19Å; M550-F563 HydrophobicContact CE-CE2 4.32Å
551	K	94.6	Very high	91.1	Very high	22 Å²	22	37.2 Å²	37.2	10%	0.096	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	122.6	-178.7	175.1	171.1	-170.3	162.5	0	111.4	E483 C484 V485 E517 E524 W549 V553	E483-K551 WeakPolarHBondContact OE1-CE 3.3Å; E483-K551 IonicContact OE1-NZ 3.93Å; E483-K551 PolarHBondContact OE1-NZ 2.91Å; C484-K551 CarbonylContact O-C 3.23Å; C484-K551 VanDerWaalsContact O-CA 3.24Å; C484-K551 WeakPolarHBondContact O-CA 3.47Å; V485-K551 HydrophobicContact CG2-CB 4.21Å; V485-K551 HydrophobicContact CG2-CD 4.07Å; V485-K551 HydrophobicContact CG2-CG 3.94Å; E517-K551 HydrophobicContact CB-CB 4.41Å; E517-K551 PolarHBondContact N-O 2.67Å; E517-K551 PolarHBondContact O-N 3.37Å; E524-K551 IonicContact OE1-NZ 2.77Å; E524-K551 PolarHBondContact OE1-NZ 3.39Å; W549-K551 HydrophobicContact CE3-CB 4.47Å; W549-K551 HydrophobicContact CH2-CB 3.23Å; W549-K551 HydrophobicContact CH2-CD 3.46Å; W549-K551 VanDerWaalsContact CH2-CD 3.46Å; W549-K551 HydrophobicContact CH2-CG 3.98Å; W549-K551 HydrophobicContact CZ2-CB 3.76Å; W549-K551 HydrophobicContact CZ2-CD 3.91Å; W549-K551 HydrophobicContact CZ2-CG 4.43Å; W549-K551 HydrophobicContact CZ3-CB 3.62Å; W549-K551 HydrophobicContact CZ3-CD 4.48Å; K551-V553 HydrophobicContact CD-CG2 4.38Å; K551-V553 HydrophobicContact CG-CG2 4.01Å
552	F	94.8	Very high	91	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135.9	169.2	173.7	-113.3	0	0	0	109.5	P472 Y478 E483 C484 W486 I505 Y515 L516 F563	P472-F552 HydrophobicContact CG-CD1 4.49Å; Y478-F552 AromaticContact CD1-CZ 3.93Å; Y478-F552 HydrophobicContact CD1-CZ 3.93Å; Y478-F552 HydrophobicContact CD2-CE1 4.38Å; Y478-F552 AromaticContact CD2-CZ 3.84Å; Y478-F552 HydrophobicContact CD2-CZ 3.84Å; Y478-F552 HydrophobicContact CE1-CZ 4.15Å; Y478-F552 HydrophobicContact CE2-CZ 4.06Å; Y478-F552 HydrophobicContact CG-CE1 4.27Å; Y478-F552 AromaticContact CG-CZ 3.79Å; Y478-F552 HydrophobicContact CG-CZ 3.79Å; E483-F552 WeakPolarHBondContact CA-O 3.38Å; C484-F552 HydrophobicContact CB-CB 4.25Å; C484-F552 PolarHBondContact N-O 3.22Å; C484-F552 PolarHBondContact O-N 2.97Å; W486-F552 HydrophobicContact CH2-CB 3.96Å; W486-F552 HydrophobicContact CZ3-CB 3.71Å; I505-F552 HydrophobicContact CD1-CD2 4.15Å; I505-F552 HydrophobicContact CD1-CE2 3.93Å; I505-F552 HydrophobicContact CG1-CE2 4.37Å; I505-F552 HydrophobicContact CG2-CE2 4.44Å; Y515-F552 WeakPolarHBondContact O-CA 3.31Å; Y515-F552 VanDerWaalsContact O-CD2 3.24Å; Y515-F552 WeakPolarHBondContact O-CD2 3.35Å; L516-F552 HydrophobicContact CD1-CB 3.92Å; F552-F563 HydrophobicContact CB-CE1 3.97Å; F552-F563 HydrophobicContact CB-CZ 4.23Å; F552-F563 HydrophobicContact CD2-CD1 4.4Å; F552-F563 AromaticContact CD2-CE1 3.73Å; F552-F563 HydrophobicContact CD2-CE1 3.73Å; F552-F563 HydrophobicContact CE2-CE1 4.39Å; F552-F563 AromaticContact CG-CE1 3.82Å; F552-F563 HydrophobicContact CG-CE1 3.82Å
553	V	93.8	Very high	91	Very high	29 Å²	29	30.7 Å²	30.7	18%	0.176	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136.5	174.8	-177.6	0	0	0	0	108.9	K482 E483 D514 Y515 K551	K482-V553 CarbonylContact O-C 3.54Å; K482-V553 WeakPolarHBondContact O-CA 3.41Å; E483-V553 HydrophobicContact CG-CG2 4.4Å; D514-V553 WeakPolarHBondContact CA-O 3.43Å; Y515-V553 HydrophobicContact CD1-CB 4.13Å; Y515-V553 HydrophobicContact CE1-CB 3.73Å; Y515-V553 HydrophobicContact CE1-CG1 4.13Å; Y515-V553 HydrophobicContact CE1-CG2 4.03Å; Y515-V553 HydrophobicContact CE2-CB 4.27Å; Y515-V553 HydrophobicContact CE2-CG2 3.94Å; Y515-V553 PolarHBondContact N-O 2.82Å; Y515-V553 PolarHBondContact O-N 3.08Å; K551-V553 HydrophobicContact CD-CG2 4.38Å; K551-V553 HydrophobicContact CG-CG2 4.01Å
554	S	92.9	Very high	90.8	Very high	5 Å²	5	30.7 Å²	30.7	4%	0.035	19%	0.187	C	C	.	.			trans	-124.8	147.3	167.2	64.9	0	0	0	0	112.8	R479 M481 K482 D514	R479-S554 PolarHBondContact O-OG 2.82Å; M481-S554 VanDerWaalsContact CA-O 3.24Å; M481-S554 WeakPolarHBondContact CA-O 3.13Å; M481-S554 PolarHBondContact N-O 2.63Å; M481-S554 PolarHBondContact N-OG 3.07Å; K482-S554 PolarHBondContact N-OG 3.08Å; K482-S554 PolarHBondContact O-N 3.5Å; D514-S554 WeakPolarHBondContact OD1-CA 3.18Å; D514-S554 WeakPolarHBondContact OD1-CB 3.46Å
555	D	89.7	Confident	90.8	Very high	47 Å²	47	25.1 Å²	25.1	25%	0.251	15%	0.153	S	C	.	.			trans	-92	-170.7	-177.9	109.3	-20.6	0	0	0	112	P480 M481 D514 T557	P480-D555 CarbonylContact C-O 3.51Å; P480-D555 WeakPolarHBondContact CA-O 3.39Å; P480-D555 WeakPolarHBondContact CB-O 3.45Å; M481-D555 PolarHBondContact N-O 2.73Å; D514-D555 PolarHBondContact OD1-N 3.05Å; D555-T557 PolarHBondContact O-N 3.11Å; D555-T557 WeakPolarHBondContact OD1-CA 3.5Å; D555-T557 PolarHBondContact OD1-N 3.08Å; D555-T557 PolarHBondContact OD1-OG1 3.46Å; D555-T557 PolarHBondContact OD2-OG1 3.13Å
556	G	87.3	Confident	90.6	Very high	39 Å²	39	25.7 Å²	25.7	40%	0.402	15%	0.153	S	C	.	.	S	Bend	trans	-74.8	-2.1	-178	0	0	0	0	0	116.2
557	T	85.3	Confident	90.5	Very high	80 Å²	80	23.7 Å²	23.7	49%	0.491	14%	0.142	S	C	.	.	S	Bend	trans	-140.1	-178.2	-163.2	36.3	0	0	0	0	112.9	D555 N559	D555-T557 PolarHBondContact O-N 3.11Å; D555-T557 WeakPolarHBondContact OD1-CA 3.5Å; D555-T557 PolarHBondContact OD1-N 3.08Å; D555-T557 PolarHBondContact OD1-OG1 3.46Å; D555-T557 PolarHBondContact OD2-OG1 3.13Å; T557-N559 PolarHBondContact O-N 2.75Å; T557-N559 PolarHBondContact O-ND2 3.08Å
558	V	83	Confident	90.3	Very high	76 Å²	76	24.6 Å²	24.6	46%	0.461	15%	0.145	S	C	.	.			trans	24.7	75.8	171.6	-166.4	0	0	0	0	117	E506	E506-V558 HydrophobicContact CG-CB 4.1Å; E506-V558 HydrophobicContact CG-CG1 3.88Å; E506-V558 VanDerWaalsContact OE1-CB 3.27Å; E506-V558 WeakPolarHBondContact OE1-CB 3.44Å; E506-V558 WeakPolarHBondContact OE1-CG2 3.44Å
559	N	86.5	Confident	90.1	Very high	45 Å²	45	28.8 Å²	28.8	24%	0.241	16%	0.163	C	C	.	.			trans	-83.2	160.6	175.7	-47.6	116.9	0	0	0	113.2	D477 Y478 P480 T557	D477-N559 HydrophobicContact CB-CB 4.18Å; Y478-N559 HydrophobicContact CD2-CB 4.03Å; Y478-N559 HydrophobicContact CE2-CB 3.98Å; Y478-N559 WeakPolarHBondContact CE2-ND2 3.4Å; Y478-N559 WeakPolarHBondContact O-CB 3.43Å; P480-N559 WeakPolarHBondContact CD-OD1 3.21Å; T557-N559 PolarHBondContact O-N 2.75Å; T557-N559 PolarHBondContact O-ND2 3.08Å
560	K	89.3	Confident	89.7	Confident	54 Å²	54	28.7 Å²	28.7	24%	0.235	16%	0.163	C	C	.	.			trans	-141.6	170.2	-179.1	-62.3	-66.7	168.6	175.7	0	110.3	D477 Y478 E504 Y535 G562	D477-K560 CarbonylContact C-O 3.55Å; D477-K560 WeakPolarHBondContact CA-O 3.42Å; D477-K560 VanDerWaalsContact OD1-CA 3.3Å; D477-K560 WeakPolarHBondContact OD1-CA 3.04Å; Y478-K560 WeakPolarHBondContact CD1-O 3.25Å; Y478-K560 HydrophobicContact CE1-CB 3.79Å; Y478-K560 VanDerWaalsContact CE1-O 3.22Å; Y478-K560 WeakPolarHBondContact CE1-O 3.08Å; Y478-K560 PolarHBondContact N-O 3.2Å; E504-K560 HydrophobicContact CB-CB 4.45Å; E504-K560 WeakPolarHBondContact O-CB 3.1Å; Y535-K560 HydrophobicContact CE1-CD 4.35Å; Y535-K560 VanDerWaalsContact OH-CE 3.3Å; Y535-K560 WeakPolarHBondContact OH-CE 3.02Å; Y535-K560 PolarHBondContact OH-NZ 2.84Å; K560-G562 PolarHBondContact O-N 3.05Å
561	A	85.4	Confident	89.3	Confident	22 Å²	22	31.6 Å²	31.6	18%	0.182	18%	0.177	C	C	.	.			trans	-55.8	-26.2	179.6	0	0	0	0	0	113.4	Y474 D477	Y474-A561 VanDerWaalsContact CD2-O 3.23Å; Y474-A561 WeakPolarHBondContact CD2-O 3.49Å; D477-A561 PolarHBondContact OD1-N 2.05Å
562	G	89.6	Confident	88.7	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.8	-145.9	176.1	0	0	0	0	0	112.9	S471 E504 K560	S471-G562 VanDerWaalsContact OG-CA 3.3Å; S471-G562 WeakPolarHBondContact OG-CA 3.47Å; E504-G562 PolarHBondContact N-O 3.4Å; E504-G562 WeakPolarHBondContact O-CA 3.44Å; E504-G562 PolarHBondContact O-N 3.19Å; K560-G562 PolarHBondContact O-N 3.05Å
563	F	91.4	Very high	88.2	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	155.1	-173.4	68.9	-90.4	0	0	0	112.9	I469 Q470 S471 W486 F500 A502 F503 I505 L516 M550 F552 A565	I469-F563 HydrophobicContact CG2-CE2 4.44Å; Q470-F563 CarbonylContact C-O 3.58Å; Q470-F563 VanDerWaalsContact CA-O 3.24Å; Q470-F563 WeakPolarHBondContact CA-O 3.35Å; S471-F563 PolarHBondContact N-O 3.13Å; S471-F563 PolarHBondContact OG-N 3.14Å; S471-F563 PolarHBondContact OG-O 3.11Å; W486-F563 AromaticContact CH2-CZ 3.88Å; W486-F563 HydrophobicContact CH2-CZ 3.88Å; W486-F563 HydrophobicContact CZ3-CZ 4.02Å; F500-F563 HydrophobicContact CD1-CB 4.38Å; F500-F563 HydrophobicContact CE1-CB 4.4Å; F500-F563 HydrophobicContact CE1-CD2 4.04Å; F500-F563 HydrophobicContact CE1-CG 4.4Å; A502-F563 VanDerWaalsContact O-CA 3.28Å; A502-F563 WeakPolarHBondContact O-CA 3.48Å; A502-F563 WeakPolarHBondContact O-CB 3.25Å; F503-F563 HydrophobicContact CD2-CB 3.69Å; F503-F563 HydrophobicContact CD2-CG 4.43Å; F503-F563 HydrophobicContact CE2-CB 4.32Å; F503-F563 HydrophobicContact CG-CB 4.45Å; I505-F563 HydrophobicContact CD1-CD1 3.98Å; L516-F563 HydrophobicContact CD1-CE1 3.74Å; L516-F563 HydrophobicContact CD1-CE2 4.27Å; L516-F563 HydrophobicContact CD1-CZ 3.56Å; L516-F563 HydrophobicContact CD2-CD1 4.22Å; L516-F563 HydrophobicContact CD2-CD2 4.18Å; L516-F563 HydrophobicContact CD2-CE1 4.14Å; L516-F563 HydrophobicContact CD2-CE2 4.09Å; L516-F563 HydrophobicContact CD2-CG 4.25Å; L516-F563 HydrophobicContact CD2-CZ 4.08Å; L516-F563 HydrophobicContact CG-CE1 4.4Å; L516-F563 HydrophobicContact CG-CZ 4.44Å; M550-F563 HydrophobicContact CE-CE2 4.32Å; F552-F563 HydrophobicContact CB-CE1 3.97Å; F552-F563 HydrophobicContact CB-CZ 4.23Å; F552-F563 HydrophobicContact CD2-CD1 4.4Å; F552-F563 AromaticContact CD2-CE1 3.73Å; F552-F563 HydrophobicContact CD2-CE1 3.73Å; F552-F563 HydrophobicContact CE2-CE1 4.39Å; F552-F563 AromaticContact CG-CE1 3.82Å; F552-F563 HydrophobicContact CG-CE1 3.82Å; F563-A565 HydrophobicContact CD2-CB 4.44Å
564	A	87.8	Confident	87.8	Confident	1 Å²	1	35 Å²	35	1%	0.008	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	121.4	167.1	0	0	0	0	0	108.7	Q470 Y474 Q501 A502	Q470-A564 HydrophobicContact CG-CB 3.95Å; Y474-A564 HydrophobicContact CD1-CB 4.34Å; Y474-A564 HydrophobicContact CD2-CB 4.5Å; Y474-A564 HydrophobicContact CE1-CB 3.85Å; Y474-A564 HydrophobicContact CE2-CB 4.04Å; Q501-A564 HydrophobicContact CB-CB 4.43Å; Q501-A564 PolarHBondContact N-O 2.77Å; A502-A564 PolarHBondContact N-O 3.19Å; A502-A564 PolarHBondContact O-N 2.96Å
565	A	90.4	Very high	87.2	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.5	-177.6	0	0	0	0	0	111.2	Q468 I469 L498 T499 F500 F563	Q468-A565 CarbonylContact C-O 3.57Å; Q468-A565 WeakPolarHBondContact CA-O 3.34Å; I469-A565 PolarHBondContact N-O 3.3Å; I469-A565 PolarHBondContact O-N 3.4Å; I469-A565 VanDerWaalsContact O-O 3.14Å; L498-A565 HydrophobicContact CD1-CB 3.91Å; L498-A565 HydrophobicContact CG-CB 4.37Å; T499-A565 CarbonylContact O-C 3.13Å; T499-A565 WeakPolarHBondContact O-CA 3.43Å; F500-A565 HydrophobicContact CD1-CB 3.79Å; F500-A565 HydrophobicContact CE1-CB 3.78Å; F500-A565 HydrophobicContact CG-CB 4.37Å; F500-A565 HydrophobicContact CZ-CB 4.33Å; F563-A565 HydrophobicContact CD2-CB 4.44Å
566	N	88.2	Confident	86.8	Confident	48 Å²	48	39.7 Å²	39.7	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	132.4	170.1	-75.4	8.2	0	0	0	109.2	G467 Q468 L498 T499 Q501	G467-N566 WeakPolarHBondContact O-CA 3.17Å; Q468-N566 PolarHBondContact NE2-OD1 2.99Å; L498-N566 CarbonylContact C-O 3.49Å; L498-N566 WeakPolarHBondContact CA-O 3.48Å; T499-N566 PolarHBondContact N-O 2.97Å; T499-N566 PolarHBondContact O-N 2.74Å; T499-N566 PolarHBondContact OG1-O 2.96Å; Q501-N566 VanDerWaalsContact NE2-CG 3.32Å; Q501-N566 PolarHBondContact NE2-ND2 3.38Å; Q501-N566 PolarHBondContact NE2-OD1 3.01Å
567	F	91.6	Very high	86.4	Confident	5 Å²	5	44.8 Å²	44.8	2%	0.022	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.4	165.9	73.7	-89.2	0	0	0	110.1	I462 K464 E466 G467 I469 I488 V496 G497 L498	I462-F567 HydrophobicContact CG2-CE1 4.18Å; I462-F567 HydrophobicContact CG2-CE2 4.2Å; I462-F567 HydrophobicContact CG2-CZ 3.54Å; K464-F567 HydrophobicContact CB-CE2 4.22Å; K464-F567 HydrophobicContact CB-CZ 4.19Å; E466-F567 VanDerWaalsContact C-CE2 3.44Å; E466-F567 CarbonylContact C-O 3.53Å; E466-F567 WeakPolarHBondContact CA-O 3.4Å; E466-F567 WeakPolarHBondContact O-CZ 3.32Å; G467-F567 VanDerWaalsContact C-CE1 3.46Å; G467-F567 VanDerWaalsContact CA-CE1 3.45Å; G467-F567 PolarHBondContact N-O 2.85Å; G467-F567 WeakPolarHBondContact O-CD1 3.19Å; G467-F567 PolarHBondContact O-N 2.88Å; G467-F567 VanDerWaalsContact O-O 3.13Å; I469-F567 HydrophobicContact CD1-CD1 3.84Å; I469-F567 HydrophobicContact CD1-CE1 4.2Å; I469-F567 HydrophobicContact CG1-CD1 3.95Å; I469-F567 HydrophobicContact CG1-CE1 4.08Å; I488-F567 HydrophobicContact CD1-CB 4.1Å; I488-F567 HydrophobicContact CD1-CD1 4.35Å; I488-F567 HydrophobicContact CD1-CG 4.17Å; I488-F567 HydrophobicContact CG2-CB 4.49Å; I488-F567 HydrophobicContact CG2-CD2 3.56Å; I488-F567 HydrophobicContact CG2-CE2 3.91Å; I488-F567 HydrophobicContact CG2-CG 4Å; V496-F567 HydrophobicContact CG1-CB 4.38Å; G497-F567 CarbonylContact O-C 3.56Å; G497-F567 WeakPolarHBondContact O-CA 3.45Å; L498-F567 HydrophobicContact CD1-CB 3.93Å
568	F	89.8	Confident	86.3	Confident	38 Å²	38	45.7 Å²	45.7	17%	0.167	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	163.3	175.4	47.8	-103	0	0	0	111.1	N465 E466 G497 T499 E570 L590 G591	N465-F568 CarbonylContact O-C 3.45Å; N465-F568 WeakPolarHBondContact O-CA 3.12Å; E466-F568 HydrophobicContact CB-CB 4.31Å; G497-F568 PolarHBondContact N-O 3.07Å; G497-F568 PolarHBondContact O-N 2.86Å; T499-F568 HydrophobicContact CG2-CE1 3.75Å; T499-F568 HydrophobicContact CG2-CZ 3.83Å; F568-E570 PolarHBondContact O-N 2.93Å; F568-L590 HydrophobicContact CE2-CD2 4.19Å; F568-L590 HydrophobicContact CE2-CG 3.95Å; F568-L590 HydrophobicContact CZ-CB 4.2Å; F568-L590 HydrophobicContact CZ-CD2 3.82Å; F568-L590 HydrophobicContact CZ-CG 3.88Å; F568-G591 VanDerWaalsContact CE2-N 3.26Å
569	K	89.8	Confident	86.2	Confident	88 Å²	88	44.8 Å²	44.8	38%	0.383	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	127	168.7	61.9	159.6	-163.6	151.1	0	109.1	N465 V490 Y494	N465-K569 HydrophobicContact CB-CB 4.4Å; N465-K569 HydrophobicContact CB-CD 4.29Å; N465-K569 HydrophobicContact CB-CG 4.15Å; N465-K569 PolarHBondContact O-N 3.48Å; V490-K569 HydrophobicContact CB-CB 4.24Å; V490-K569 HydrophobicContact CG1-CB 4.35Å; Y494-K569 HydrophobicContact CD1-CB 4.38Å; Y494-K569 HydrophobicContact CD1-CD 4.1Å; Y494-K569 HydrophobicContact CE1-CD 4.17Å; Y494-K569 HydrophobicContact CG-CB 4.32Å; Y494-K569 HydrophobicContact CG-CD 4.37Å
570	E	88.1	Confident	85.8	Confident	3 Å²	3	42.8 Å²	42.8	1%	0.014	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.5	177.2	173.6	71	169.4	0	0	108.6	N495 R542 F568 N588 L590 G591	N495-E570 HydrophobicContact CB-CB 3.95Å; N495-E570 HydrophobicContact CB-CG 4.17Å; N495-E570 PolarHBondContact N-O 2.01Å; N495-E570 PolarHBondContact O-N 3.22Å; R542-E570 HydrophobicContact CG-CG 4Å; F568-E570 PolarHBondContact O-N 2.93Å; E570-N588 PolarHBondContact OE1-ND2 3.31Å; E570-L590 HydrophobicContact CG-CD1 4.45Å; E570-G591 WeakPolarHBondContact OE2-CA 3.48Å; E570-G591 PolarHBondContact OE2-N 3.26Å
571	E	86.4	Confident	85.4	Confident	62 Å²	62	41.7 Å²	41.7	29%	0.29	24%	0.242	S	C	.	.			trans	-127.4	145.1	171.9	-162.8	178.8	-177.5	0	0	107.7	Y494 E573 K576 N588	Y494-E571 HydrophobicContact CD1-CB 3.91Å; Y494-E571 HydrophobicContact CD1-CG 4.19Å; Y494-E571 HydrophobicContact CE1-CB 3.92Å; Y494-E571 HydrophobicContact CE1-CG 3.93Å; E571-E573 HydrophobicContact CB-CG 4.4Å; E571-E573 PolarHBondContact O-N 2.8Å; E571-K576 WeakPolarHBondContact OE1-CE 3.36Å; E571-K576 IonicContact OE1-NZ 3.9Å; E571-K576 PolarHBondContact OE1-NZ 3.25Å; E571-K576 IonicContact OE2-NZ 2.8Å; E571-K576 PolarHBondContact OE2-NZ 3.06Å; E571-N588 PolarHBondContact O-ND2 3.28Å
572	D	81.6	Confident	85.4	Confident	63 Å²	63	41.1 Å²	41.1	34%	0.337	24%	0.237	S	C	.	.			trans	-86.5	92.3	166.8	-164.4	-42.8	0	0	0	108.1	C574 A575 N588	D572-C574 PolarHBondContact O-N 3.39Å; D572-C574 WeakPolarHBondContact OD1-CB 3.11Å; D572-C574 PolarHBondContact OD1-N 2.92Å; D572-A575 HydrophobicContact CB-CB 3.88Å; D572-A575 WeakPolarHBondContact O-CB 3.48Å; D572-A575 PolarHBondContact O-N 3.01Å; D572-A575 PolarHBondContact OD1-N 2.82Å; D572-N588 WeakPolarHBondContact CA-OD1 3.49Å; D572-N588 PolarHBondContact OD1-OD1 3.21Å
573	E	85.2	Confident	85.1	Confident	33 Å²	33	46.4 Å²	46.4	15%	0.154	26%	0.262	C	S	.	.	S	Bend	trans	-72.2	-19.9	-179.3	-63.2	121.7	146.2	0	0	112.4	E571 K576 G580 N588 Y593	E571-E573 HydrophobicContact CB-CG 4.4Å; E571-E573 PolarHBondContact O-N 2.8Å; E573-K576 HydrophobicContact CB-CD 4.34Å; E573-K576 WeakPolarHBondContact O-CB 3.43Å; E573-K576 PolarHBondContact O-N 3.43Å; E573-G580 WeakPolarHBondContact O-CA 3.1Å; E573-G580 PolarHBondContact O-N 3.44Å; E573-N588 PolarHBondContact N-OD1 3.08Å; E573-Y593 HydrophobicContact CB-CD1 3.36Å; E573-Y593 HydrophobicContact CB-CE1 3.92Å; E573-Y593 HydrophobicContact CB-CG 3.89Å; E573-Y593 HydrophobicContact CG-CD1 3.82Å; E573-Y593 HydrophobicContact CG-CE1 4.25Å; E573-Y593 WeakPolarHBondContact OE2-CD1 3.09Å; E573-Y593 PolarHBondContact OE2-N 3.35Å
574	C	84.1	Confident	84.6	Confident	27 Å²	27	48.9 Å²	48.9	18%	0.182	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.8	172.1	-60	0	0	0	0	112.9	D572 K576 C586 V587 N588	D572-C574 PolarHBondContact O-N 3.39Å; D572-C574 WeakPolarHBondContact OD1-CB 3.11Å; D572-C574 PolarHBondContact OD1-N 2.92Å; C574-K576 PolarHBondContact O-N 3.06Å; C574-C586 WeakPolarHBondContact CA-SG 3.44Å; C574-C586 HydrophobicContact CB-CB 3.65Å; C574-C586 WeakPolarHBondContact CB-SG 3.2Å; C574-C586 WeakPolarHBondContact SG-CB 3.3Å; C574-C586 CovalentContact SG-SG 2.03Å; C574-C586 PolarHBondContact SG-SG 3.14Å; C574-V587 VanDerWaalsContact SG-C 3.51Å; C574-V587 PolarHBondContact SG-N 3.43Å; C574-N588 HydrophobicContact CB-CB 4.48Å; C574-N588 PolarHBondContact N-OD1 3.47Å; C574-N588 PolarHBondContact SG-N 2.88Å
575	A	81.7	Confident	84.3	Confident	79 Å²	79	56.1 Å²	56.1	65%	0.653	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-3.9	171.8	0	0	0	0	0	113.8	D572	D572-A575 HydrophobicContact CB-CB 3.88Å; D572-A575 WeakPolarHBondContact O-CB 3.48Å; D572-A575 PolarHBondContact O-N 3.01Å; D572-A575 PolarHBondContact OD1-N 2.82Å
576	K	79.5	Confident	84.1	Confident	70 Å²	70	57 Å²	57	30%	0.304	31%	0.306	S	S	.	.	S	Bend	trans	-73.5	151.4	175.6	-66.5	173.3	179	164.9	0	111.4	E571 E573 C574 D578 N579	E571-K576 WeakPolarHBondContact OE1-CE 3.36Å; E571-K576 IonicContact OE1-NZ 3.9Å; E571-K576 PolarHBondContact OE1-NZ 3.25Å; E571-K576 IonicContact OE2-NZ 2.8Å; E571-K576 PolarHBondContact OE2-NZ 3.06Å; E573-K576 HydrophobicContact CB-CD 4.34Å; E573-K576 WeakPolarHBondContact O-CB 3.43Å; E573-K576 PolarHBondContact O-N 3.43Å; C574-K576 PolarHBondContact O-N 3.06Å; K576-D578 VanDerWaalsContact CB-OD1 3.23Å; K576-D578 WeakPolarHBondContact CB-OD1 3.35Å; K576-D578 PolarHBondContact O-N 3.21Å; K576-N579 PolarHBondContact O-N 3.18Å
577	P	79.5	Confident	83.9	Confident	147 Å²	147	56.7 Å²	56.7	96%	0.955	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.2	-175.6	-23.7	34.3	0	0	0	115.4
578	D	82.8	Confident	83.4	Confident	98 Å²	98	58.2 Å²	58.2	52%	0.524	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	8.2	179.6	66.7	-24.6	0	0	0	113.6	K576 G580 G581	K576-D578 VanDerWaalsContact CB-OD1 3.23Å; K576-D578 WeakPolarHBondContact CB-OD1 3.35Å; K576-D578 PolarHBondContact O-N 3.21Å; D578-G580 VanDerWaalsContact C-N 3.26Å; D578-G580 PolarHBondContact O-N 3.04Å; D578-G580 PolarHBondContact OD1-N 3.19Å; D578-G581 VanDerWaalsContact O-CA 3.3Å; D578-G581 WeakPolarHBondContact O-CA 3.37Å; D578-G581 PolarHBondContact O-N 2.75Å
579	N	81.5	Confident	82.9	Confident	58 Å²	58	58.8 Å²	58.8	31%	0.31	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	57.3	38.7	-178.1	-173	47.3	0	0	0	111.7	K576 G581 C582 Q584 C586	K576-N579 PolarHBondContact O-N 3.18Å; N579-G581 PolarHBondContact O-N 3.13Å; N579-G581 VanDerWaalsContact O-N 3.08Å; N579-C582 PolarHBondContact ND2-O 2.96Å; N579-C582 VanDerWaalsContact ND2-O 3.1Å; N579-C582 WeakPolarHBondContact O-CB 3.5Å; N579-C582 PolarHBondContact O-N 2.9Å; N579-Q584 PolarHBondContact ND2-O 2.59Å; N579-C586 WeakPolarHBondContact O-CB 3.13Å; N579-C586 WeakPolarHBondContact OD1-CB 3.32Å
580	G	78.6	Confident	82.2	Confident	3 Å²	3	56.7 Å²	56.7	3%	0.031	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	62.9	9.1	-170.5	0	0	0	0	0	114	E573 D578 C582 Y593 K608	E573-G580 WeakPolarHBondContact O-CA 3.1Å; E573-G580 PolarHBondContact O-N 3.44Å; D578-G580 VanDerWaalsContact C-N 3.26Å; D578-G580 PolarHBondContact O-N 3.04Å; D578-G580 PolarHBondContact OD1-N 3.19Å; G580-C582 VanDerWaalsContact C-N 3.35Å; G580-Y593 WeakPolarHBondContact O-CE2 3.25Å; G580-Y593 PolarHBondContact O-OH 2.73Å; G580-K608 PolarHBondContact O-NZ 2.82Å
581	G	80.8	Confident	81.4	Confident	31 Å²	31	58.4 Å²	58.4	32%	0.32	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	66.3	33.9	-167.1	0	0	0	0	0	113.1	D578 N579 K608	D578-G581 VanDerWaalsContact O-CA 3.3Å; D578-G581 WeakPolarHBondContact O-CA 3.37Å; D578-G581 PolarHBondContact O-N 2.75Å; N579-G581 PolarHBondContact O-N 3.13Å; N579-G581 VanDerWaalsContact O-N 3.08Å; G581-K608 WeakPolarHBondContact O-CD 3.42Å; G581-K608 WeakPolarHBondContact O-CG 3.43Å; G581-K608 PolarHBondContact O-NZ 3.33Å
582	C	85.9	Confident	80.9	Confident	9 Å²	9	58.2 Å²	58.2	6%	0.061	34%	0.338	C	S	.	.			trans	-90.8	135.5	168.9	-62.9	0	0	0	0	110.8	N579 G580 C586 C595	N579-C582 PolarHBondContact ND2-O 2.96Å; N579-C582 VanDerWaalsContact ND2-O 3.1Å; N579-C582 WeakPolarHBondContact O-CB 3.5Å; N579-C582 PolarHBondContact O-N 2.9Å; G580-C582 VanDerWaalsContact C-N 3.35Å; C582-C586 HydrophobicContact CB-CB 4.14Å; C582-C595 WeakPolarHBondContact CA-SG 3.19Å; C582-C595 HydrophobicContact CB-CB 3.64Å; C582-C595 WeakPolarHBondContact CB-SG 3.36Å; C582-C595 WeakPolarHBondContact SG-CA 3.5Å; C582-C595 WeakPolarHBondContact SG-CB 3.4Å; C582-C595 CovalentContact SG-SG 2.03Å; C582-C595 PolarHBondContact SG-SG 3.44Å
583	E	82.4	Confident	81	Confident	112 Å²	112	58.4 Å²	58.4	52%	0.523	33%	0.334	S	S	.	.	S	Bend	trans	-63.9	-43.2	-178.3	-173.3	-174.4	151.4	0	0	112.8	K608 S609 C610	E583-K608 WeakPolarHBondContact CB-O 3.37Å; E583-K608 PolarHBondContact N-O 3.05Å; E583-S609 WeakPolarHBondContact OE2-CA 3.3Å; E583-S609 WeakPolarHBondContact OE2-CB 3.47Å; E583-S609 PolarHBondContact OE2-OG 2.96Å; E583-C610 PolarHBondContact OE2-N 2.94Å
584	Q	81.9	Confident	81	Confident	51 Å²	51	62.3 Å²	62.3	24%	0.238	35%	0.353	C	S	.	.	S	Bend	trans	-114.3	-85.3	-175.9	-64.1	178.2	-2.9	0	0	110.7	N579 C610	N579-Q584 PolarHBondContact ND2-O 2.59Å; Q584-C610 VanDerWaalsContact CD-SG 3.6Å; Q584-C610 HydrophobicContact CG-CB 4.29Å
585	R	80.4	Confident	81	Confident	154 Å²	154	61.5 Å²	61.5	58%	0.581	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	120.7	-173.4	178.5	178.6	174.4	163.8	-1.1	111.3	V587 C595 A596	R585-V587 HydrophobicContact CG-CG2 4.11Å; R585-C595 CarbonylContact O-C 3.55Å; R585-C595 WeakPolarHBondContact O-CA 3.42Å; R585-A596 HydrophobicContact CB-CB 4.31Å; R585-A596 WeakPolarHBondContact CB-O 3.39Å; R585-A596 HydrophobicContact CG-CB 4.36Å; R585-A596 PolarHBondContact N-O 2.88Å; R585-A596 VanDerWaalsContact N-O 3.09Å; R585-A596 PolarHBondContact O-N 3.23Å; R585-A596 VanDerWaalsContact O-O 3.13Å
586	C	86.1	Confident	80.8	Confident	18 Å²	18	59.1 Å²	59.1	12%	0.122	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	137.3	165.4	-168.5	0	0	0	0	110	C574 N579 C582	C574-C586 WeakPolarHBondContact CA-SG 3.44Å; C574-C586 HydrophobicContact CB-CB 3.65Å; C574-C586 WeakPolarHBondContact CB-SG 3.2Å; C574-C586 WeakPolarHBondContact SG-CB 3.3Å; C574-C586 CovalentContact SG-SG 2.03Å; C574-C586 PolarHBondContact SG-SG 3.14Å; N579-C586 WeakPolarHBondContact O-CB 3.13Å; N579-C586 WeakPolarHBondContact OD1-CB 3.32Å; C582-C586 HydrophobicContact CB-CB 4.14Å
587	V	84.9	Confident	80.7	Confident	41 Å²	41	57.1 Å²	57.1	25%	0.248	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	109.1	172.6	-178.6	0	0	0	0	108	C574 R585 Y593 Q594 A596	C574-V587 VanDerWaalsContact SG-C 3.51Å; C574-V587 PolarHBondContact SG-N 3.43Å; R585-V587 HydrophobicContact CG-CG2 4.11Å; V587-Y593 WeakPolarHBondContact O-CA 3.48Å; V587-Q594 HydrophobicContact CB-CG 4.13Å; V587-Q594 PolarHBondContact N-O 3.46Å; V587-Q594 PolarHBondContact O-N 2.7Å; V587-A596 HydrophobicContact CG2-CB 3.93Å
588	N	80.4	Confident	80.1	Confident	38 Å²	38	54.1 Å²	54.1	20%	0.203	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	134.7	175.6	-145.5	79.2	0	0	0	109.1	E570 E571 D572 E573 C574	E570-N588 PolarHBondContact OE1-ND2 3.31Å; E571-N588 PolarHBondContact O-ND2 3.28Å; D572-N588 WeakPolarHBondContact CA-OD1 3.49Å; D572-N588 PolarHBondContact OD1-OD1 3.21Å; E573-N588 PolarHBondContact N-OD1 3.08Å; C574-N588 HydrophobicContact CB-CB 4.48Å; C574-N588 PolarHBondContact N-OD1 3.47Å; C574-N588 PolarHBondContact SG-N 2.88Å
589	T	79.4	Confident	78.4	Confident	50 Å²	50	55.8 Å²	55.8	31%	0.307	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	166.3	174.9	55.3	0	0	0	0	108.4	G591 S592 Q594	T589-G591 PolarHBondContact O-N 3.46Å; T589-G591 VanDerWaalsContact O-N 3.13Å; T589-S592 CarbonylContact C-O 3.4Å; T589-S592 WeakPolarHBondContact CA-O 3.32Å; T589-S592 PolarHBondContact N-O 3.08Å; T589-S592 PolarHBondContact O-N 2.81Å; T589-S592 VanDerWaalsContact OG1-C 3.31Å; T589-S592 PolarHBondContact OG1-O 3.15Å; T589-Q594 HydrophobicContact CG2-CG 4.14Å
590	L	75.5	Confident	76.9	Confident	43 Å²	43	55.4 Å²	55.4	23%	0.225	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	114.2	179.9	-144.9	84.7	0	0	0	109.6	T499 D540 I541 R542 F568 E570	T499-L590 HydrophobicContact CG2-CD2 3.73Å; D540-L590 HydrophobicContact CB-CB 4.46Å; D540-L590 HydrophobicContact CB-CD2 3.95Å; I541-L590 WeakPolarHBondContact O-CD2 3.38Å; R542-L590 HydrophobicContact CB-CD1 3.79Å; R542-L590 HydrophobicContact CG-CD1 4.23Å; F568-L590 HydrophobicContact CE2-CD2 4.19Å; F568-L590 HydrophobicContact CE2-CG 3.95Å; F568-L590 HydrophobicContact CZ-CB 4.2Å; F568-L590 HydrophobicContact CZ-CD2 3.82Å; F568-L590 HydrophobicContact CZ-CG 3.88Å; E570-L590 HydrophobicContact CG-CD1 4.45Å
591	G	69.8	Low	76.1	Confident	40 Å²	40	61 Å²	61	41%	0.412	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	7.2	179.3	0	0	0	0	0	114.7	F568 E570 T589	F568-G591 VanDerWaalsContact CE2-N 3.26Å; E570-G591 WeakPolarHBondContact OE2-CA 3.48Å; E570-G591 PolarHBondContact OE2-N 3.26Å; T589-G591 PolarHBondContact O-N 3.46Å; T589-G591 VanDerWaalsContact O-N 3.13Å
592	S	76.4	Confident	75.3	Confident	58 Å²	58	63.4 Å²	63.4	41%	0.406	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	-174	178.8	-147.8	0	0	0	0	111.9	T589	T589-S592 CarbonylContact C-O 3.4Å; T589-S592 WeakPolarHBondContact CA-O 3.32Å; T589-S592 PolarHBondContact N-O 3.08Å; T589-S592 PolarHBondContact O-N 2.81Å; T589-S592 VanDerWaalsContact OG1-C 3.31Å; T589-S592 PolarHBondContact OG1-O 3.15Å
593	Y	84.4	Confident	74.7	Confident	67 Å²	67	66.2 Å²	66.2	26%	0.263	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	154.1	165.1	66.3	-75.2	0	0	0	109.1	E573 G580 V587 K608	E573-Y593 HydrophobicContact CB-CD1 3.36Å; E573-Y593 HydrophobicContact CB-CE1 3.92Å; E573-Y593 HydrophobicContact CB-CG 3.89Å; E573-Y593 HydrophobicContact CG-CD1 3.82Å; E573-Y593 HydrophobicContact CG-CE1 4.25Å; E573-Y593 WeakPolarHBondContact OE2-CD1 3.09Å; E573-Y593 PolarHBondContact OE2-N 3.35Å; G580-Y593 WeakPolarHBondContact O-CE2 3.25Å; G580-Y593 PolarHBondContact O-OH 2.73Å; V587-Y593 WeakPolarHBondContact O-CA 3.48Å; Y593-K608 PolarHBondContact OH-NZ 2.8Å
594	Q	83.8	Confident	74.2	Confident	115 Å²	115	61.2 Å²	61.2	54%	0.537	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.1	169.9	64.5	-176.7	-6.6	0	0	109.9	V587 T589	V587-Q594 HydrophobicContact CB-CG 4.13Å; V587-Q594 PolarHBondContact N-O 3.46Å; V587-Q594 PolarHBondContact O-N 2.7Å; T589-Q594 HydrophobicContact CG2-CG 4.14Å
595	C	84.4	Confident	73.6	Confident	9 Å²	9	64.4 Å²	64.4	6%	0.061	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	134.6	168.4	-54.5	0	0	0	0	108.7	C582 R585 L603	C582-C595 WeakPolarHBondContact CA-SG 3.19Å; C582-C595 HydrophobicContact CB-CB 3.64Å; C582-C595 WeakPolarHBondContact CB-SG 3.36Å; C582-C595 WeakPolarHBondContact SG-CA 3.5Å; C582-C595 WeakPolarHBondContact SG-CB 3.4Å; C582-C595 CovalentContact SG-SG 2.03Å; C582-C595 PolarHBondContact SG-SG 3.44Å; R585-C595 CarbonylContact O-C 3.55Å; R585-C595 WeakPolarHBondContact O-CA 3.42Å; C595-L603 HydrophobicContact CB-CD1 3.64Å; C595-L603 WeakPolarHBondContact O-CD2 3.46Å
596	A	79	Confident	73.6	Confident	30 Å²	30	61.1 Å²	61.1	25%	0.248	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	150.7	171	0	0	0	0	0	108.5	R585 V587	R585-A596 HydrophobicContact CB-CB 4.31Å; R585-A596 WeakPolarHBondContact CB-O 3.39Å; R585-A596 HydrophobicContact CG-CB 4.36Å; R585-A596 PolarHBondContact N-O 2.88Å; R585-A596 VanDerWaalsContact N-O 3.09Å; R585-A596 PolarHBondContact O-N 3.23Å; R585-A596 VanDerWaalsContact O-O 3.13Å; V587-A596 HydrophobicContact CG2-CB 3.93Å
597	C	76	Confident	73.2	Confident	28 Å²	28	67.7 Å²	67.7	19%	0.189	39%	0.386	C	S	.	.			trans	-108.8	155.2	176.6	-55	0	0	0	0	110.3	C610	C597-C610 VanDerWaalsContact CA-SG 3.57Å; C597-C610 HydrophobicContact CB-CB 3.78Å; C597-C610 WeakPolarHBondContact CB-SG 3.33Å; C597-C610 VanDerWaalsContact SG-CA 3.52Å; C597-C610 WeakPolarHBondContact SG-CB 3.47Å; C597-C610 CovalentContact SG-SG 2.04Å; C597-C610 PolarHBondContact SG-SG 3.1Å
598	D	67.1	Low	73	Confident	84 Å²	84	69 Å²	69	45%	0.449	39%	0.388	S	S	.	.			trans	-70.8	156.9	175.4	-73.9	-38	0	0	0	111.3	G600 Y601	D598-G600 PolarHBondContact O-N 2.92Å; D598-G600 VanDerWaalsContact O-N 3.13Å; D598-Y601 PolarHBondContact O-N 3.04Å; D598-Y601 VanDerWaalsContact O-N 3.08Å
599	P	47.1	Very low	72.8	Confident	132 Å²	132	69.5 Å²	69.5	86%	0.857	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	119.9	-177.1	-26.7	35.7	0	0	0	112.9
600	G	49.9	Very low	72.4	Confident	50 Å²	50	67.7 Å²	67.7	52%	0.515	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	116.6	-6.9	-172.2	0	0	0	0	0	113.8	D598 A613	D598-G600 PolarHBondContact O-N 2.92Å; D598-G600 VanDerWaalsContact O-N 3.13Å; G600-A613 PolarHBondContact O-N 2.78Å
601	Y	63	Low	72.1	Confident	121 Å²	121	70.2 Å²	70.2	48%	0.475	39%	0.394	S	S	.	.			trans	-126.7	148	-179.1	-65	-96.7	0	0	0	112.6	D598 C610 E611	D598-Y601 PolarHBondContact O-N 3.04Å; D598-Y601 VanDerWaalsContact O-N 3.08Å; Y601-C610 HydrophobicContact CD1-CB 4.15Å; Y601-C610 WeakPolarHBondContact CD1-O 3.35Å; Y601-C610 HydrophobicContact CG-CB 4.35Å; Y601-E611 CarbonylContact C-O 3.39Å; Y601-E611 WeakPolarHBondContact CA-O 3.3Å; Y601-E611 WeakPolarHBondContact CB-O 3.49Å; Y601-E611 WeakPolarHBondContact CD1-O 3.49Å
602	E	63.4	Low	71.4	Confident	82 Å²	82	69.9 Å²	69.9	38%	0.383	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	152	170.6	51.4	-162.7	165.3	0	0	109.1	G604 C610 E611 A613 K638	E602-G604 PolarHBondContact O-N 3.05Å; E602-C610 CarbonylContact O-C 3.56Å; E602-C610 WeakPolarHBondContact O-CA 3.46Å; E602-E611 HydrophobicContact CG-CB 4.27Å; E602-E611 PolarHBondContact N-O 3.41Å; E602-E611 PolarHBondContact O-N 2.04Å; E602-A613 HydrophobicContact CB-CB 3.49Å; E602-A613 VanDerWaalsContact CB-CB 3.49Å; E602-A613 HydrophobicContact CG-CB 3.62Å; E602-K638 IonicContact OE1-NZ 3.05Å
603	L	74.1	Confident	70.7	Confident	68 Å²	68	68.4 Å²	68.4	36%	0.356	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	122.2	176.8	-164.6	71.6	0	0	0	109.5	C595 K607	C595-L603 HydrophobicContact CB-CD1 3.64Å; C595-L603 WeakPolarHBondContact O-CD2 3.46Å; L603-K607 HydrophobicContact CD2-CB 3.91Å; L603-K607 HydrophobicContact CD2-CG 4.41Å
604	G	71.1	Confident	70	Confident	6 Å²	6	66.7 Å²	66.7	6%	0.062	38%	0.377	C	S	.	.			trans	-66.1	173.6	-176.7	0	0	0	0	0	113.6	E602 D606 K607 S609	E602-G604 PolarHBondContact O-N 3.05Å; G604-D606 PolarHBondContact O-N 3.09Å; G604-K607 PolarHBondContact O-N 3.49Å; G604-S609 PolarHBondContact N-O 2.92Å
605	P	70.1	Confident	69.5	Low	118 Å²	118	62.5 Å²	62.5	77%	0.766	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-24.3	-176.5	-26	34.6	0	0	0	115	K607 E611	P605-K607 VanDerWaalsContact C-N 3.29Å; P605-E611 WeakPolarHBondContact CD-OE1 3.21Å
606	D	79.2	Confident	69.4	Low	86 Å²	86	64 Å²	64	46%	0.46	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-7.2	177.7	73.5	-16.9	0	0	0	114	G604 K608 S609	G604-D606 PolarHBondContact O-N 3.09Å; D606-K608 PolarHBondContact O-N 3.24Å; D606-K608 PolarHBondContact OD1-N 2.92Å; D606-S609 PolarHBondContact OD1-N 2.88Å; D606-S609 PolarHBondContact OD2-N 3.02Å
607	K	78.2	Confident	69.5	Low	156 Å²	156	67.9 Å²	67.9	68%	0.678	40%	0.397	S	S	*	.	S	Bend	trans	60	23.1	-174.3	-56.4	-174.7	179.4	-176	0	114.8	L603 G604 P605	L603-K607 HydrophobicContact CD2-CB 3.91Å; L603-K607 HydrophobicContact CD2-CG 4.41Å; G604-K607 PolarHBondContact O-N 3.49Å; P605-K607 VanDerWaalsContact C-N 3.29Å
608	K	80	Confident	70	Confident	67 Å²	67	68.6 Å²	68.6	29%	0.291	40%	0.399	S	S	.	.	S	Bend	trans	-135.7	-39.7	-176	-75.4	177.5	167	-73.1	0	113.4	G580 G581 E583 Y593 D606	G580-K608 PolarHBondContact O-NZ 2.82Å; G581-K608 WeakPolarHBondContact O-CD 3.42Å; G581-K608 WeakPolarHBondContact O-CG 3.43Å; G581-K608 PolarHBondContact O-NZ 3.33Å; E583-K608 WeakPolarHBondContact CB-O 3.37Å; E583-K608 PolarHBondContact N-O 3.05Å; Y593-K608 PolarHBondContact OH-NZ 2.8Å; D606-K608 PolarHBondContact O-N 3.24Å; D606-K608 PolarHBondContact OD1-N 2.92Å
609	S	77.6	Confident	70.9	Confident	50 Å²	50	69.3 Å²	69.3	35%	0.35	41%	0.407	S	S	.	.	S	Bend	trans	-83.5	161.3	173.8	-86.1	0	0	0	0	112.8	E583 G604 D606	E583-S609 WeakPolarHBondContact OE2-CA 3.3Å; E583-S609 WeakPolarHBondContact OE2-CB 3.47Å; E583-S609 PolarHBondContact OE2-OG 2.96Å; G604-S609 PolarHBondContact N-O 2.92Å; D606-S609 PolarHBondContact OD1-N 2.88Å; D606-S609 PolarHBondContact OD2-N 3.02Å
610	C	71.2	Confident	72.5	Confident	12 Å²	12	70 Å²	70	8%	0.081	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	109.3	-176.7	-70.5	0	0	0	0	111.5	E583 Q584 C597 Y601 E602	E583-C610 PolarHBondContact OE2-N 2.94Å; Q584-C610 VanDerWaalsContact CD-SG 3.6Å; Q584-C610 HydrophobicContact CG-CB 4.29Å; C597-C610 VanDerWaalsContact CA-SG 3.57Å; C597-C610 HydrophobicContact CB-CB 3.78Å; C597-C610 WeakPolarHBondContact CB-SG 3.33Å; C597-C610 VanDerWaalsContact SG-CA 3.52Å; C597-C610 WeakPolarHBondContact SG-CB 3.47Å; C597-C610 CovalentContact SG-SG 2.04Å; C597-C610 PolarHBondContact SG-SG 3.1Å; Y601-C610 HydrophobicContact CD1-CB 4.15Å; Y601-C610 WeakPolarHBondContact CD1-O 3.35Å; Y601-C610 HydrophobicContact CG-CB 4.35Å; E602-C610 CarbonylContact O-C 3.56Å; E602-C610 WeakPolarHBondContact O-CA 3.46Å
611	E	67.9	Low	74	Confident	95 Å²	95	71.3 Å²	71.3	44%	0.444	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	164.4	177.3	-64.6	-172.2	-172	0	0	111.4	Y601 E602 P605 A613	Y601-E611 CarbonylContact C-O 3.39Å; Y601-E611 WeakPolarHBondContact CA-O 3.3Å; Y601-E611 WeakPolarHBondContact CB-O 3.49Å; Y601-E611 WeakPolarHBondContact CD1-O 3.49Å; E602-E611 HydrophobicContact CG-CB 4.27Å; E602-E611 PolarHBondContact N-O 3.41Å; E602-E611 PolarHBondContact O-N 2.04Å; P605-E611 WeakPolarHBondContact CD-OE1 3.21Å; E611-A613 PolarHBondContact O-N 3.37Å
612	A	56.3	Low	75.3	Confident	34 Å²	34	70.2 Å²	70.2	28%	0.281	39%	0.394	S	S	.	.			trans	-80.8	100.1	-178.1	0	0	0	0	0	112.6	P628	A612-P628 HydrophobicContact CB-CB 4.5Å
613	A	60	Low	76.4	Confident	27 Å²	27	67.2 Å²	67.2	22%	0.223	38%	0.384	C	S	.	.			trans	-73.7	161.9	172.1	0	0	0	0	0	112.4	G600 E602 E611	G600-A613 PolarHBondContact O-N 2.78Å; E602-A613 HydrophobicContact CB-CB 3.49Å; E602-A613 VanDerWaalsContact CB-CB 3.49Å; E602-A613 HydrophobicContact CG-CB 3.62Å; E611-A613 PolarHBondContact O-N 3.37Å
614	C	70.4	Confident	77.1	Confident	30 Å²	30	67.4 Å²	67.4	20%	0.203	39%	0.388	C	S	.	.			trans	-150.8	142.3	166.5	61.4	0	0	0	0	112	P628 C640 W642	C614-P628 HydrophobicContact CB-CB 3.97Å; C614-P628 HydrophobicContact CB-CG 3.87Å; C614-C640 HydrophobicContact CB-CB 3.45Å; C614-C640 VanDerWaalsContact CB-CB 3.45Å; C614-C640 WeakPolarHBondContact CB-SG 3.3Å; C614-C640 WeakPolarHBondContact SG-CB 3.03Å; C614-C640 CovalentContact SG-SG 2.01Å; C614-C640 PolarHBondContact SG-SG 2.66Å; C614-W642 HydrophobicContact CB-CH2 4.31Å; C614-W642 HydrophobicContact CB-CZ2 3.97Å
615	G	73.9	Confident	78	Confident	28 Å²	28	67.5 Å²	67.5	29%	0.289	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	101.9	-173.4	-173.8	0	0	0	0	0	114	V641 W642	G615-V641 CarbonylContact C-O 3.59Å; G615-V641 WeakPolarHBondContact CA-O 3.35Å; G615-W642 VanDerWaalsContact N-CE2 3.33Å
616	G	81.7	Confident	78.9	Confident	40 Å²	40	64.3 Å²	64.3	41%	0.412	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	124.4	169.5	178.2	0	0	0	0	0	114.5	V641 W642 Q643	G616-V641 PolarHBondContact N-O 3.44Å; G616-W642 WeakPolarHBondContact O-CA 3.42Å; G616-Q643 PolarHBondContact O-N 3.25Å
617	L	81.5	Confident	79.3	Confident	111 Å²	111	60.3 Å²	60.3	58%	0.581	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	125.7	174	-177.5	70	0	0	0	110.1	T619 Q643 V645	L617-T619 HydrophobicContact CD2-CG2 4.41Å; L617-T619 HydrophobicContact CG-CG2 4.3Å; L617-Q643 CarbonylContact C-O 3.57Å; L617-Q643 WeakPolarHBondContact CA-O 3.41Å; L617-Q643 HydrophobicContact CD1-CB 3.91Å; L617-V645 HydrophobicContact CD1-CG2 3.85Å
618	L	85.9	Confident	79.5	Confident	43 Å²	43	53.1 Å²	53.1	23%	0.225	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	109.4	-177.2	-61.4	176.2	0	0	0	109.7	I625 W642 Q643 V644 V645 F723	L618-I625 HydrophobicContact CD1-CG2 3.63Å; L618-W642 HydrophobicContact CD1-CB 4.33Å; L618-W642 HydrophobicContact CD1-CG 4.45Å; L618-Q643 PolarHBondContact N-O 3.37Å; L618-V644 HydrophobicContact CB-CG2 4.25Å; L618-V644 HydrophobicContact CD1-CG2 4.2Å; L618-V644 CarbonylContact O-C 3.52Å; L618-V644 WeakPolarHBondContact O-CA 3.49Å; L618-V645 PolarHBondContact O-N 3.35Å; L618-F723 HydrophobicContact CB-CZ 4.18Å; L618-F723 HydrophobicContact CD1-CE1 3.78Å; L618-F723 HydrophobicContact CD1-CZ 4.08Å
619	T	85.6	Confident	79.1	Confident	100 Å²	100	51.4 Å²	51.4	61%	0.613	32%	0.315	S	S	*	.			trans	-104.6	4.3	-179.5	53.2	0	0	0	0	113.9	L617 V645	L617-T619 HydrophobicContact CD2-CG2 4.41Å; L617-T619 HydrophobicContact CG-CG2 4.3Å; T619-V645 WeakPolarHBondContact CA-O 3.04Å
620	K	81.7	Confident	79.3	Confident	147 Å²	147	52.5 Å²	52.5	64%	0.639	31%	0.312	S	S	*	.	S	Bend	trans	-73.1	148.3	175.7	-63.6	-175.9	179	-179.6	0	110.1	N622 F723	K620-N622 VanDerWaalsContact CB-O 3.29Å; K620-N622 WeakPolarHBondContact CB-O 3.02Å; K620-N622 PolarHBondContact O-N 3.19Å; K620-F723 WeakPolarHBondContact O-CE2 3.36Å
621	L	82.3	Confident	79.6	Confident	76 Å²	76	56.3 Å²	56.3	40%	0.398	34%	0.337	S	S	.	.	S	Bend	trans	-73.9	-15	175.6	-59.5	178.8	0	0	0	112.9	P647 F724 S725	L621-P647 VanDerWaalsContact CD2-CD 3.43Å; L621-P647 HydrophobicContact CD2-CG 4.06Å; L621-F724 CarbonylContact O-C 3.59Å; L621-S725 VanDerWaalsContact CA-OG 3.25Å; L621-S725 WeakPolarHBondContact CA-OG 3.35Å; L621-S725 WeakPolarHBondContact CB-OG 3.39Å; L621-S725 VanDerWaalsContact CD2-OG 3.26Å; L621-S725 WeakPolarHBondContact CD2-OG 3.45Å; L621-S725 PolarHBondContact O-N 2.89Å; L621-S725 PolarHBondContact O-OG 3.06Å; L621-S725 VanDerWaalsContact O-OG 3.06Å
622	N	88.3	Confident	80.2	Confident	99 Å²	99	59.6 Å²	59.6	53%	0.529	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	163.5	169.6	60.3	5.1	0	0	0	110.8	K620 F723 F724	K620-N622 VanDerWaalsContact CB-O 3.29Å; K620-N622 WeakPolarHBondContact CB-O 3.02Å; K620-N622 PolarHBondContact O-N 3.19Å; N622-F723 CarbonylContact C-O 3.58Å; N622-F723 VanDerWaalsContact CA-O 3.29Å; N622-F723 WeakPolarHBondContact CA-O 3.43Å; N622-F724 HydrophobicContact CB-CB 4.26Å
623	G	86.9	Confident	81.5	Confident	18 Å²	18	64.1 Å²	64.1	19%	0.186	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.5	175.4	176.8	0	0	0	0	0	112.5	H722 F723	G623-H722 WeakPolarHBondContact O-CA 3.31Å; G623-H722 PolarHBondContact O-CE1 3.13Å; G623-H722 PolarHBondContact O-ND1 2.81Å; G623-F723 VanDerWaalsContact C-CE1 3.44Å; G623-F723 VanDerWaalsContact CA-CE1 3.5Å; G623-F723 PolarHBondContact N-O 2.86Å; G623-F723 WeakPolarHBondContact O-CD1 3.43Å; G623-F723 PolarHBondContact O-N 3.39Å; G623-F723 VanDerWaalsContact O-O 3.1Å
624	T	88.8	Confident	82.8	Confident	72 Å²	72	63 Å²	63	44%	0.442	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	136	178.2	-57.5	0	0	0	0	108.5	K720 A721 H722	T624-K720 HydrophobicContact CG2-CG 3.9Å; T624-A721 CarbonylContact C-O 3.52Å; T624-A721 VanDerWaalsContact CA-O 3.31Å; T624-A721 WeakPolarHBondContact CA-O 3.41Å; T624-A721 WeakPolarHBondContact CG2-O 3.28Å; T624-H722 PolarHBondContact OG1-ND1 3.19Å
625	I	89.8	Confident	83.3	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.041	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	146.5	169.1	66.5	168.1	0	0	0	109.7	L618 W642 M654 I706 F719 A721 F723	L618-I625 HydrophobicContact CD1-CG2 3.63Å; I625-W642 HydrophobicContact CD1-CD2 3.96Å; I625-W642 HydrophobicContact CD1-CE3 4.04Å; I625-W642 HydrophobicContact CD1-CG 4.24Å; I625-W642 HydrophobicContact CG2-CG 4.28Å; I625-M654 HydrophobicContact CD1-CE 3.5Å; I625-M654 VanDerWaalsContact CD1-CE 3.5Å; I625-M654 HydrophobicContact CG1-CE 3.74Å; I625-I706 HydrophobicContact CD1-CB 4.49Å; I625-I706 HydrophobicContact CD1-CG2 4.15Å; I625-F719 HydrophobicContact CD1-CE2 4.13Å; I625-F719 HydrophobicContact CG1-CE2 4.19Å; I625-A721 HydrophobicContact CG1-CB 4.35Å; I625-A721 PolarHBondContact N-O 2.73Å; I625-A721 PolarHBondContact O-N 2.74Å; I625-F723 HydrophobicContact CG2-CD1 4.16Å; I625-F723 HydrophobicContact CG2-CE1 4.14Å
626	T	89.1	Confident	83.8	Confident	52 Å²	52	65.2 Å²	65.2	32%	0.319	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.2	178.4	49.4	0	0	0	0	109.7	W630 W642 F719 K720	T626-W630 HydrophobicContact CG2-CB 4.24Å; T626-W630 HydrophobicContact CG2-CG 3.86Å; T626-W642 WeakPolarHBondContact O-CZ2 3.5Å; T626-F719 VanDerWaalsContact CA-O 3.29Å; T626-F719 WeakPolarHBondContact CA-O 3.44Å; T626-K720 HydrophobicContact CG2-CB 4.04Å; T626-K720 HydrophobicContact CG2-CG 3.83Å
627	T	88.7	Confident	83.8	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.006	37%	0.373	C	S	.	.			trans	-59.1	147.2	164.2	40	0	0	0	0	111.2	G629 W630 F708 K717 G718 F719	T627-G629 PolarHBondContact O-N 2.68Å; T627-W630 VanDerWaalsContact O-CB 3.3Å; T627-W630 WeakPolarHBondContact O-CB 3.37Å; T627-W630 PolarHBondContact O-N 3.37Å; T627-F708 HydrophobicContact CG2-CD1 4.22Å; T627-F708 HydrophobicContact CG2-CE1 4.09Å; T627-F708 HydrophobicContact CG2-CE2 4.41Å; T627-F708 HydrophobicContact CG2-CG 4.43Å; T627-F708 HydrophobicContact CG2-CZ 4.19Å; T627-K717 PolarHBondContact OG1-O 2.72Å; T627-G718 WeakPolarHBondContact OG1-CA 3.29Å; T627-F719 HydrophobicContact CG2-CD1 3.44Å; T627-F719 VanDerWaalsContact CG2-CD1 3.44Å; T627-F719 HydrophobicContact CG2-CD2 4.42Å; T627-F719 HydrophobicContact CG2-CE1 3.53Å; T627-F719 HydrophobicContact CG2-CE2 4.5Å; T627-F719 HydrophobicContact CG2-CG 3.91Å; T627-F719 HydrophobicContact CG2-CZ 4.08Å; T627-F719 PolarHBondContact N-O 2.89Å; T627-F719 PolarHBondContact OG1-N 2.87Å; T627-F719 PolarHBondContact OG1-O 2.78Å
628	P	81.3	Confident	83.9	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.032	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	137.6	171.4	24.2	-32.9	0	0	0	109.7	A612 C614 Y634 P635 K638	A612-P628 HydrophobicContact CB-CB 4.5Å; C614-P628 HydrophobicContact CB-CB 3.97Å; C614-P628 HydrophobicContact CB-CG 3.87Å; P628-Y634 VanDerWaalsContact O-CA 3.29Å; P628-Y634 WeakPolarHBondContact O-CA 3.03Å; P628-Y634 WeakPolarHBondContact O-CB 3.01Å; P628-P635 HydrophobicContact CB-CG 4.47Å; P628-P635 WeakPolarHBondContact O-CD 3.13Å; P628-K638 HydrophobicContact CG-CB 4.47Å; P628-K638 HydrophobicContact CG-CG 4.38Å
629	G	73.3	Confident	84	Confident	32 Å²	32	68 Å²	68	33%	0.33	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.9	-12	-178.6	0	0	0	0	0	116.1	T627 K632	T627-G629 PolarHBondContact O-N 2.68Å; G629-K632 WeakPolarHBondContact O-CA 3.24Å; G629-K632 VanDerWaalsContact O-CB 3.3Å; G629-K632 WeakPolarHBondContact O-CB 3.38Å; G629-K632 PolarHBondContact O-N 3.06Å
630	W	80.3	Confident	84.1	Confident	73 Å²	73	63.2 Å²	63.2	28%	0.277	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	134.2	178.8	177.5	-89.9	0	0	0	112.7	T626 T627 F658 K717 K720	T626-W630 HydrophobicContact CG2-CB 4.24Å; T626-W630 HydrophobicContact CG2-CG 3.86Å; T627-W630 VanDerWaalsContact O-CB 3.3Å; T627-W630 WeakPolarHBondContact O-CB 3.37Å; T627-W630 PolarHBondContact O-N 3.37Å; W630-F658 HydrophobicContact CH2-CB 3.8Å; W630-F658 AromaticContact CH2-CD1 3.28Å; W630-F658 HydrophobicContact CH2-CD1 3.28Å; W630-F658 HydrophobicContact CH2-CD2 4.19Å; W630-F658 AromaticContact CH2-CE1 3.85Å; W630-F658 HydrophobicContact CH2-CE1 3.85Å; W630-F658 AromaticContact CH2-CG 3.47Å; W630-F658 HydrophobicContact CH2-CG 3.47Å; W630-F658 VanDerWaalsContact CH2-CG 3.47Å; W630-F658 HydrophobicContact CZ2-CB 4.48Å; W630-F658 HydrophobicContact CZ3-CB 4.44Å; W630-F658 AromaticContact CZ3-CD1 3.26Å; W630-F658 HydrophobicContact CZ3-CD1 3.26Å; W630-F658 AromaticContact CZ3-CE1 3.64Å; W630-F658 HydrophobicContact CZ3-CE1 3.64Å; W630-F658 AromaticContact CZ3-CG 3.97Å; W630-F658 HydrophobicContact CZ3-CG 3.97Å; W630-K717 VanDerWaalsContact CE3-O 3.29Å; W630-K717 HydrophobicContact CZ3-CB 4.23Å; W630-K720 HydrophobicContact CD2-CB 4.31Å; W630-K720 HydrophobicContact CH2-CB 4.39Å; W630-K720 HydrophobicContact CZ2-CB 3.97Å; W630-K720 HydrophobicContact CZ2-CD 4.33Å
631	P	78.9	Confident	84.4	Confident	92 Å²	92	58.1 Å²	58.1	60%	0.597	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	cis	-90.4	12.4	5.9	37.8	-37.9	0	0	0	114.7
632	K	80.2	Confident	84.8	Confident	163 Å²	163	55.2 Å²	55.2	71%	0.709	30%	0.303	S	S	*	.	S	Bend	trans	-81.1	173.4	170.4	-56.1	179.2	-178.8	175.1	0	109.8	G629	G629-K632 WeakPolarHBondContact O-CA 3.24Å; G629-K632 VanDerWaalsContact O-CB 3.3Å; G629-K632 WeakPolarHBondContact O-CB 3.38Å; G629-K632 PolarHBondContact O-N 3.06Å
633	E	83.8	Confident	84.9	Confident	130 Å²	130	53.5 Å²	53.5	61%	0.607	29%	0.292	S	S	*	.	P	Polyproline II helix	trans	-60.2	140.6	175.6	-66.8	171.1	-172	0	0	111.7	K716	E633-K716 CarbonylContact C-O 3.55Å; E633-K716 WeakPolarHBondContact CA-O 3.42Å
634	Y	86.4	Confident	85.1	Confident	3 Å²	3	52.8 Å²	52.8	1%	0.012	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-72.9	154.4	179.2	53.5	-103.7	0	0	0	111.9	P628 L661 E662 D670 F708 S715 K716 G718	P628-Y634 VanDerWaalsContact O-CA 3.29Å; P628-Y634 WeakPolarHBondContact O-CA 3.03Å; P628-Y634 WeakPolarHBondContact O-CB 3.01Å; Y634-L661 HydrophobicContact CD1-CD2 4.18Å; Y634-L661 HydrophobicContact CE1-CD2 3.48Å; Y634-L661 VanDerWaalsContact CE1-CD2 3.48Å; Y634-E662 PolarHBondContact OH-N 3.4Å; Y634-D670 WeakPolarHBondContact CE2-OD2 3.41Å; Y634-D670 PolarHBondContact OH-OD2 2.98Å; Y634-F708 HydrophobicContact CD1-CZ 4.11Å; Y634-F708 HydrophobicContact CD2-CE1 4.46Å; Y634-F708 AromaticContact CD2-CZ 3.88Å; Y634-F708 HydrophobicContact CD2-CZ 3.88Å; Y634-F708 HydrophobicContact CE1-CZ 4.3Å; Y634-F708 HydrophobicContact CE2-CZ 4.08Å; Y634-F708 HydrophobicContact CG-CE1 4.37Å; Y634-F708 AromaticContact CG-CZ 3.9Å; Y634-F708 HydrophobicContact CG-CZ 3.9Å; Y634-S715 WeakPolarHBondContact O-CB 3.1Å; Y634-S715 PolarHBondContact O-OG 2.82Å; Y634-K716 WeakPolarHBondContact CD1-O 3.38Å; Y634-K716 HydrophobicContact CE1-CB 3.81Å; Y634-K716 WeakPolarHBondContact CE1-O 3.28Å; Y634-K716 VanDerWaalsContact CZ-N 3.32Å; Y634-K716 PolarHBondContact N-O 3.03Å; Y634-K716 PolarHBondContact OH-N 3Å; Y634-G718 VanDerWaalsContact CD1-CA 3.49Å
635	P	82.1	Confident	85.2	Confident	43 Å²	43	51.1 Å²	51.1	28%	0.279	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-73	147.5	178.1	-12.5	28.4	0	0	0	112	P628 K638 S710	P628-P635 HydrophobicContact CB-CG 4.47Å; P628-P635 WeakPolarHBondContact O-CD 3.13Å; P635-K638 HydrophobicContact CB-CG 3.82Å; P635-K638 HydrophobicContact CG-CG 4.1Å; P635-S710 PolarHBondContact O-OG 3.22Å
636	P	83.5	Confident	85.1	Confident	61 Å²	61	51 Å²	51	40%	0.396	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	158.9	170.4	28.9	-34.7	0	0	0	112	K638 D711	P636-K638 VanDerWaalsContact C-N 3.27Å; P636-K638 PolarHBondContact O-N 3.32Å; P636-D711 CarbonylContact C-O 3.43Å; P636-D711 VanDerWaalsContact CA-O 3.25Å; P636-D711 WeakPolarHBondContact CA-O 3.3Å; P636-D711 WeakPolarHBondContact CB-O 3.09Å
637	N	82.1	Confident	85	Confident	116 Å²	116	51.7 Å²	51.7	62%	0.62	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	28.8	-179.1	-56.5	-79.5	0	0	0	114.9	S710 D711 N712	N637-S710 WeakPolarHBondContact CA-O 2.88Å; N637-S710 PolarHBondContact N-O 3.27Å; N637-S710 PolarHBondContact N-OG 3.05Å; N637-D711 PolarHBondContact N-O 3.14Å; N637-N712 WeakPolarHBondContact ND2-CA 3.23Å; N637-N712 WeakPolarHBondContact ND2-CB 3.44Å; N637-N712 WeakPolarHBondContact OD1-CB 3.28Å
638	K	82.8	Confident	84.6	Confident	54 Å²	54	57.5 Å²	57.5	24%	0.235	32%	0.315	C	S	.	.			trans	-90.3	140.7	176.2	-73	-75.3	-178.7	167.1	0	110.3	E602 P628 P635 P636 R709 S710	E602-K638 IonicContact OE1-NZ 3.05Å; P628-K638 HydrophobicContact CG-CB 4.47Å; P628-K638 HydrophobicContact CG-CG 4.38Å; P635-K638 HydrophobicContact CB-CG 3.82Å; P635-K638 HydrophobicContact CG-CG 4.1Å; P636-K638 VanDerWaalsContact C-N 3.27Å; P636-K638 PolarHBondContact O-N 3.32Å; K638-R709 WeakPolarHBondContact O-CA 3.2Å; K638-S710 PolarHBondContact N-OG 3.41Å; K638-S710 PolarHBondContact O-N 3.13Å
639	N	87.4	Confident	84.4	Confident	83 Å²	83	63.6 Å²	63.6	44%	0.444	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	103.2	173.5	-179.9	12.7	0	0	0	108.1	F708 R709	N639-F708 CarbonylContact C-O 3.44Å; N639-F708 WeakPolarHBondContact CA-O 3Å; N639-R709 HydrophobicContact CB-CG 4.37Å; N639-R709 PolarHBondContact ND2-NH2 3.2Å; N639-R709 PolarHBondContact OD1-NE 2.91Å
640	C	87.8	Confident	85	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	118.8	-171	-49	0	0	0	0	109.1	C614 W642 E707 F708	C614-C640 HydrophobicContact CB-CB 3.45Å; C614-C640 VanDerWaalsContact CB-CB 3.45Å; C614-C640 WeakPolarHBondContact CB-SG 3.3Å; C614-C640 WeakPolarHBondContact SG-CB 3.03Å; C614-C640 CovalentContact SG-SG 2.01Å; C614-C640 PolarHBondContact SG-SG 2.66Å; C640-W642 HydrophobicContact CB-CE3 4.35Å; C640-W642 HydrophobicContact CB-CH2 3.52Å; C640-W642 HydrophobicContact CB-CZ2 4.13Å; C640-W642 HydrophobicContact CB-CZ3 3.64Å; C640-E707 CarbonylContact O-C 3.48Å; C640-E707 WeakPolarHBondContact O-CA 3.31Å; C640-F708 HydrophobicContact CB-CB 4.2Å; C640-F708 HydrophobicContact CB-CD1 4.22Å; C640-F708 PolarHBondContact N-O 2.8Å; C640-F708 PolarHBondContact O-N 2.71Å
641	V	88.7	Confident	85.3	Confident	40 Å²	40	67 Å²	67	24%	0.242	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.6	-179.8	-177.5	0	0	0	0	109.7	G615 G616 Q643 R705 I706 E707	G615-V641 CarbonylContact C-O 3.59Å; G615-V641 WeakPolarHBondContact CA-O 3.35Å; G616-V641 PolarHBondContact N-O 3.44Å; V641-Q643 HydrophobicContact CG1-CG 4.49Å; V641-R705 HydrophobicContact CG1-CG 4.13Å; V641-I706 CarbonylContact C-O 3.55Å; V641-I706 WeakPolarHBondContact CA-O 3.12Å; V641-E707 HydrophobicContact CG2-CB 4.39Å; V641-E707 HydrophobicContact CG2-CG 4.01Å
642	W	91.4	Very high	85.9	Confident	14 Å²	14	62.6 Å²	62.6	5%	0.053	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	135.9	168.5	-58.6	-91.6	0	0	0	110.1	C614 G615 G616 L618 I625 T626 C640 R705 I706 F708 F719	C614-W642 HydrophobicContact CB-CH2 4.31Å; C614-W642 HydrophobicContact CB-CZ2 3.97Å; G615-W642 VanDerWaalsContact N-CE2 3.33Å; G616-W642 WeakPolarHBondContact O-CA 3.42Å; L618-W642 HydrophobicContact CD1-CB 4.33Å; L618-W642 HydrophobicContact CD1-CG 4.45Å; I625-W642 HydrophobicContact CD1-CD2 3.96Å; I625-W642 HydrophobicContact CD1-CE3 4.04Å; I625-W642 HydrophobicContact CD1-CG 4.24Å; I625-W642 HydrophobicContact CG2-CG 4.28Å; T626-W642 WeakPolarHBondContact O-CZ2 3.5Å; C640-W642 HydrophobicContact CB-CE3 4.35Å; C640-W642 HydrophobicContact CB-CH2 3.52Å; C640-W642 HydrophobicContact CB-CZ2 4.13Å; C640-W642 HydrophobicContact CB-CZ3 3.64Å; W642-R705 WeakPolarHBondContact O-CA 3.27Å; W642-I706 HydrophobicContact CB-CB 4.36Å; W642-I706 HydrophobicContact CB-CD1 4.42Å; W642-I706 HydrophobicContact CE3-CB 4.33Å; W642-I706 HydrophobicContact CE3-CG2 4.13Å; W642-I706 PolarHBondContact N-O 2.88Å; W642-I706 PolarHBondContact O-N 3.09Å; W642-F708 HydrophobicContact CH2-CB 4.3Å; W642-F708 HydrophobicContact CZ3-CB 3.79Å; W642-F719 HydrophobicContact CH2-CZ 4.03Å; W642-F719 AromaticContact CZ3-CZ 3.9Å; W642-F719 HydrophobicContact CZ3-CZ 3.9Å
643	Q	90.1	Very high	86.4	Confident	64 Å²	64	55.4 Å²	55.4	30%	0.299	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	110.8	172.9	-76.2	176	-38.7	0	0	107.9	G616 L617 L618 V641 L678 M704 R705	G616-Q643 PolarHBondContact O-N 3.25Å; L617-Q643 CarbonylContact C-O 3.57Å; L617-Q643 WeakPolarHBondContact CA-O 3.41Å; L617-Q643 HydrophobicContact CD1-CB 3.91Å; L618-Q643 PolarHBondContact N-O 3.37Å; V641-Q643 HydrophobicContact CG1-CG 4.49Å; Q643-L678 HydrophobicContact CB-CD2 3.87Å; Q643-L678 HydrophobicContact CG-CD2 4.01Å; Q643-L678 PolarHBondContact NE2-O 3.21Å; Q643-M704 CarbonylContact C-O 3.45Å; Q643-R705 HydrophobicContact CG-CG 4.37Å
644	V	90.8	Very high	86.7	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	130.2	176.8	-170.1	0	0	0	0	108.8	L618 I652 N703 M704 I706 F723	L618-V644 HydrophobicContact CB-CG2 4.25Å; L618-V644 HydrophobicContact CD1-CG2 4.2Å; L618-V644 CarbonylContact O-C 3.52Å; L618-V644 WeakPolarHBondContact O-CA 3.49Å; V644-I652 HydrophobicContact CB-CD1 3.93Å; V644-I652 HydrophobicContact CB-CG2 4.28Å; V644-I652 HydrophobicContact CG1-CD1 3.68Å; V644-I652 HydrophobicContact CG1-CG1 3.95Å; V644-I652 HydrophobicContact CG1-CG2 3.89Å; V644-I652 WeakPolarHBondContact O-CD1 3.19Å; V644-N703 VanDerWaalsContact O-CA 3.28Å; V644-N703 WeakPolarHBondContact O-CA 3.26Å; V644-M704 HydrophobicContact CB-CB 4.48Å; V644-M704 PolarHBondContact N-O 3.13Å; V644-M704 PolarHBondContact O-N 3.13Å; V644-I706 HydrophobicContact CG2-CD1 3.77Å; V644-F723 HydrophobicContact CG1-CD2 3.73Å; V644-F723 HydrophobicContact CG1-CE2 3.72Å; V644-F723 HydrophobicContact CG2-CD2 4.37Å; V644-F723 HydrophobicContact CG2-CG 4.44Å
645	V	90.3	Very high	87.1	Confident	38 Å²	38	54.5 Å²	54.5	23%	0.23	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	115.9	177.8	-179.6	0	0	0	0	109.6	L617 L618 T619 L678 N703	L617-V645 HydrophobicContact CD1-CG2 3.85Å; L618-V645 PolarHBondContact O-N 3.35Å; T619-V645 WeakPolarHBondContact CA-O 3.04Å; V645-L678 HydrophobicContact CG2-CD1 4.03Å; V645-L678 HydrophobicContact CG2-CD2 3.82Å; V645-L678 HydrophobicContact CG2-CG 4.47Å; V645-N703 HydrophobicContact CG2-CB 4.36Å
646	A	87.9	Confident	87.6	Confident	5 Å²	5	52.8 Å²	52.8	4%	0.041	27%	0.27	C	S	.	.			trans	-100.7	170.5	172.6	0	0	0	0	0	110.6	I652 N702	A646-I652 HydrophobicContact CB-CD1 4.21Å; A646-I652 HydrophobicContact CB-CG1 3.94Å; A646-N702 PolarHBondContact N-O 2.89Å; A646-N702 WeakPolarHBondContact O-CB 3.09Å; A646-N702 PolarHBondContact O-ND2 3.23Å
647	P	86.9	Confident	88	Confident	67 Å²	67	54.8 Å²	54.8	44%	0.435	27%	0.274	S	S	.	.			trans	-62.5	155.2	170.1	-19.6	32.4	0	0	0	111.8	L621 Q649 Y650 N702	L621-P647 VanDerWaalsContact CD2-CD 3.43Å; L621-P647 HydrophobicContact CD2-CG 4.06Å; P647-Q649 PolarHBondContact O-N 3.08Å; P647-Y650 HydrophobicContact CB-CD2 3.86Å; P647-Y650 HydrophobicContact CB-CE2 4.21Å; P647-Y650 HydrophobicContact CG-CD2 4.04Å; P647-Y650 HydrophobicContact CG-CE2 4.22Å; P647-Y650 PolarHBondContact O-N 2.96Å; P647-N702 VanDerWaalsContact O-CB 3.24Å; P647-N702 WeakPolarHBondContact O-CB 3.25Å
648	T	80.1	Confident	88.5	Confident	123 Å²	123	52.3 Å²	52.3	76%	0.755	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-10.2	-169.3	51.4	0	0	0	0	116.8
649	Q	77.9	Confident	89.1	Confident	133 Å²	133	50.1 Å²	50.1	62%	0.621	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-3.6	176.9	-60.6	-180	25.3	0	0	113.4	P647 K727	P647-Q649 PolarHBondContact O-N 3.08Å; Q649-K727 HydrophobicContact CB-CD 4.18Å
650	Y	85.1	Confident	89.4	Confident	69 Å²	69	48.1 Å²	48.1	27%	0.271	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	150.3	-175.1	-68.6	-106.1	0	0	0	111.2	P647 N702 D726 K727	P647-Y650 HydrophobicContact CB-CD2 3.86Å; P647-Y650 HydrophobicContact CB-CE2 4.21Å; P647-Y650 HydrophobicContact CG-CD2 4.04Å; P647-Y650 HydrophobicContact CG-CE2 4.22Å; P647-Y650 PolarHBondContact O-N 2.96Å; Y650-N702 WeakPolarHBondContact O-CA 3.46Å; Y650-N702 WeakPolarHBondContact O-CB 3.47Å; Y650-D726 CarbonylContact C-O 3.58Å; Y650-D726 VanDerWaalsContact CA-O 3.25Å; Y650-D726 WeakPolarHBondContact CA-O 3.3Å; Y650-K727 HydrophobicContact CD1-CB 3.9Å; Y650-K727 HydrophobicContact CE1-CB 3.74Å; Y650-K727 HydrophobicContact CE2-CB 4.37Å; Y650-K727 HydrophobicContact CE2-CD 4.4Å; Y650-K727 HydrophobicContact CG-CB 4.28Å
651	R	87.4	Confident	89.6	Confident	106 Å²	106	48.4 Å²	48.4	40%	0.4	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144.4	163.1	-71.2	-178.7	178.4	132.3	5.5	109	T698 S699 Q700 S725 D726 D728	R651-T698 HydrophobicContact CB-CG2 4.19Å; R651-S699 WeakPolarHBondContact CD-O 3.37Å; R651-Q700 PolarHBondContact NE-O 3.29Å; R651-S725 CarbonylContact O-C 3.46Å; R651-S725 WeakPolarHBondContact O-CA 3.31Å; R651-D726 PolarHBondContact N-O 3.3Å; R651-D726 PolarHBondContact O-N 3.1Å; R651-D728 IonicContact CZ-OD2 3.45Å; R651-D728 IonicContact NH1-OD2 3.18Å; R651-D728 PolarHBondContact NH1-OD2 3.27Å
652	I	90.2	Very high	89.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128	177.3	-60.2	146.2	0	0	0	108.8	V644 A646 S699 N702 M704 F723	V644-I652 HydrophobicContact CB-CD1 3.93Å; V644-I652 HydrophobicContact CB-CG2 4.28Å; V644-I652 HydrophobicContact CG1-CD1 3.68Å; V644-I652 HydrophobicContact CG1-CG1 3.95Å; V644-I652 HydrophobicContact CG1-CG2 3.89Å; V644-I652 WeakPolarHBondContact O-CD1 3.19Å; A646-I652 HydrophobicContact CB-CD1 4.21Å; A646-I652 HydrophobicContact CB-CG1 3.94Å; I652-S699 WeakPolarHBondContact CA-OG 3.37Å; I652-S699 WeakPolarHBondContact CB-OG 3.33Å; I652-S699 PolarHBondContact N-OG 3.22Å; I652-S699 PolarHBondContact O-N 2.53Å; I652-S699 PolarHBondContact O-OG 2.92Å; I652-N702 WeakPolarHBondContact CD1-O 3.19Å; I652-M704 HydrophobicContact CB-CB 4.39Å; I652-M704 HydrophobicContact CB-CE 4.28Å; I652-M704 HydrophobicContact CD1-CB 4.17Å; I652-M704 HydrophobicContact CG2-CB 4.32Å; I652-M704 HydrophobicContact CG2-CE 4.05Å; I652-M704 HydrophobicContact CG2-SD 4.22Å; I652-M704 WeakPolarHBondContact O-CE 3.45Å; I652-F723 HydrophobicContact CG2-CB 4.45Å
653	S	91.4	Very high	89.3	Confident	12 Å²	12	49.3 Å²	49.3	8%	0.084	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	143.4	172.8	-61.5	0	0	0	0	110.3	V697 T698 F723 F724	S653-V697 CarbonylContact C-O 3.47Å; S653-V697 WeakPolarHBondContact CA-O 3.36Å; S653-T698 WeakPolarHBondContact OG-CG2 3.17Å; S653-T698 PolarHBondContact OG-OG1 2.84Å; S653-T698 VanDerWaalsContact OG-OG1 3.06Å; S653-F723 VanDerWaalsContact O-CA 3.27Å; S653-F723 WeakPolarHBondContact O-CA 3.5Å; S653-F724 VanDerWaalsContact CB-CE2 3.5Å; S653-F724 PolarHBondContact N-O 2.78Å; S653-F724 PolarHBondContact O-N 3.36Å
654	M	91.2	Very high	88.8	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	118.7	-171.4	179.1	59.8	167.6	0	0	109.9	I625 F656 I674 V696 V697 M704 A721 F723	I625-M654 HydrophobicContact CD1-CE 3.5Å; I625-M654 VanDerWaalsContact CD1-CE 3.5Å; I625-M654 HydrophobicContact CG1-CE 3.74Å; M654-F656 HydrophobicContact CE-CE1 4.28Å; M654-F656 HydrophobicContact CE-CE2 4.49Å; M654-F656 HydrophobicContact CE-CZ 4.05Å; M654-F656 HydrophobicContact CG-CE2 4.36Å; M654-I674 HydrophobicContact CG-CD1 4.11Å; M654-V696 WeakPolarHBondContact O-CA 3.28Å; M654-V697 PolarHBondContact N-O 2.82Å; M654-V697 PolarHBondContact O-N 3.38Å; M654-M704 HydrophobicContact CB-CE 4.17Å; M654-M704 HydrophobicContact CB-SD 3.95Å; M654-A721 HydrophobicContact CE-CB 3.29Å; M654-A721 HydrophobicContact SD-CB 4.01Å; M654-F723 HydrophobicContact SD-CB 3.94Å
655	K	93.1	Very high	87.9	Confident	114 Å²	114	59.3 Å²	59.3	50%	0.496	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	123.1	-177.9	178.8	178.2	179.6	-178.2	0	110.3	V696 A721 H722 F724	K655-V696 HydrophobicContact CB-CG2 4.07Å; K655-V696 HydrophobicContact CD-CG2 4.44Å; K655-V696 HydrophobicContact CG-CG2 4.06Å; K655-A721 CarbonylContact O-C 3.58Å; K655-A721 VanDerWaalsContact O-CA 3.26Å; K655-A721 WeakPolarHBondContact O-CA 3.47Å; K655-A721 WeakPolarHBondContact O-CB 3.45Å; K655-H722 PolarHBondContact N-O 3.47Å; K655-H722 PolarHBondContact O-N 3.27Å; K655-F724 HydrophobicContact CB-CE1 4.39Å
656	F	93	Very high	87.4	Confident	8 Å²	8	63 Å²	63	4%	0.035	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	132.3	171.7	-67.8	-90.8	0	0	0	110.3	M654 F659 V672 I674 V693 P694 F719 A721	M654-F656 HydrophobicContact CE-CE1 4.28Å; M654-F656 HydrophobicContact CE-CE2 4.49Å; M654-F656 HydrophobicContact CE-CZ 4.05Å; M654-F656 HydrophobicContact CG-CE2 4.36Å; F656-F659 AromaticContact CD1-CD2 3.6Å; F656-F659 HydrophobicContact CD1-CD2 3.6Å; F656-F659 HydrophobicContact CD1-CE2 4.2Å; F656-F659 AromaticContact CE1-CD2 3.79Å; F656-F659 HydrophobicContact CE1-CD2 3.79Å; F656-F659 AromaticContact CE1-CE2 3.91Å; F656-F659 HydrophobicContact CE1-CE2 3.91Å; F656-F659 HydrophobicContact CG-CD2 4.27Å; F656-F659 HydrophobicContact CZ-CE2 4.42Å; F656-V672 HydrophobicContact CE1-CG1 4.25Å; F656-V672 HydrophobicContact CZ-CG1 3.93Å; F656-I674 HydrophobicContact CE2-CD1 3.8Å; F656-I674 HydrophobicContact CZ-CD1 3.94Å; F656-V693 HydrophobicContact CB-CG1 3.71Å; F656-P694 HydrophobicContact CD2-CB 3.84Å; F656-P694 HydrophobicContact CD2-CG 3.87Å; F656-P694 HydrophobicContact CE2-CB 4.06Å; F656-P694 HydrophobicContact CE2-CG 4.02Å; F656-P694 HydrophobicContact CG-CG 4.38Å; F656-F719 HydrophobicContact CD1-CB 4.06Å; F656-F719 HydrophobicContact CD1-CD2 4.24Å; F656-F719 HydrophobicContact CD1-CG 4.24Å; F656-F719 HydrophobicContact CE1-CB 4.19Å; F656-F719 HydrophobicContact CE1-CD1 4.39Å; F656-F719 AromaticContact CE1-CD2 3.83Å; F656-F719 HydrophobicContact CE1-CD2 3.83Å; F656-F719 HydrophobicContact CE1-CE2 4.31Å; F656-F719 AromaticContact CE1-CG 3.89Å; F656-F719 HydrophobicContact CE1-CG 3.89Å; F656-A721 HydrophobicContact CB-CB 4.49Å; F656-A721 HydrophobicContact CD1-CB 3.58Å; F656-A721 HydrophobicContact CE1-CB 3.88Å; F656-A721 HydrophobicContact CG-CB 4.05Å
657	E	91.6	Very high	87.4	Confident	102 Å²	102	63.2 Å²	63.2	48%	0.477	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-31.4	170.5	-64.9	-178.4	173.1	0	0	111.2	K720	E657-K720 PolarHBondContact N-O 3.12Å; E657-K720 WeakPolarHBondContact OE2-CD 3.37Å; E657-K720 WeakPolarHBondContact OE2-CE 3.37Å; E657-K720 IonicContact OE2-NZ 3.66Å; E657-K720 PolarHBondContact OE2-NZ 2.91Å
658	F	93.9	Very high	87.2	Confident	65 Å²	65	67.3 Å²	67.3	29%	0.285	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	143.3	176	-178.2	-84	0	0	0	109.6	W630 E660 K717 G718 F719 K720	W630-F658 HydrophobicContact CH2-CB 3.8Å; W630-F658 AromaticContact CH2-CD1 3.28Å; W630-F658 HydrophobicContact CH2-CD1 3.28Å; W630-F658 HydrophobicContact CH2-CD2 4.19Å; W630-F658 AromaticContact CH2-CE1 3.85Å; W630-F658 HydrophobicContact CH2-CE1 3.85Å; W630-F658 AromaticContact CH2-CG 3.47Å; W630-F658 HydrophobicContact CH2-CG 3.47Å; W630-F658 VanDerWaalsContact CH2-CG 3.47Å; W630-F658 HydrophobicContact CZ2-CB 4.48Å; W630-F658 HydrophobicContact CZ3-CB 4.44Å; W630-F658 AromaticContact CZ3-CD1 3.26Å; W630-F658 HydrophobicContact CZ3-CD1 3.26Å; W630-F658 AromaticContact CZ3-CE1 3.64Å; W630-F658 HydrophobicContact CZ3-CE1 3.64Å; W630-F658 AromaticContact CZ3-CG 3.97Å; W630-F658 HydrophobicContact CZ3-CG 3.97Å; F658-E660 HydrophobicContact CE1-CB 3.52Å; F658-E660 HydrophobicContact CZ-CB 3.79Å; F658-K717 HydrophobicContact CE1-CB 3.9Å; F658-K717 HydrophobicContact CE1-CD 4.44Å; F658-K717 HydrophobicContact CZ-CB 4.27Å; F658-K717 HydrophobicContact CZ-CD 4.02Å; F658-G718 WeakPolarHBondContact CD1-O 3.47Å; F658-G718 WeakPolarHBondContact CE1-O 3.4Å; F658-F719 VanDerWaalsContact O-CA 3.24Å; F658-F719 WeakPolarHBondContact O-CA 3.27Å; F658-F719 VanDerWaalsContact O-CB 3.28Å; F658-F719 WeakPolarHBondContact O-CB 3.49Å; F658-K720 HydrophobicContact CB-CB 4.45Å; F658-K720 PolarHBondContact N-O 3.03Å; F658-K720 VanDerWaalsContact N-O 3.13Å; F658-K720 PolarHBondContact O-N 3.33Å
659	F	94.4	Very high	87.6	Confident	7 Å²	7	66 Å²	66	3%	0.031	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	116	-178.6	-163	-101.4	0	0	0	112	F656 L661 V672 F688 E692 V693 P694 F719	F656-F659 AromaticContact CD1-CD2 3.6Å; F656-F659 HydrophobicContact CD1-CD2 3.6Å; F656-F659 HydrophobicContact CD1-CE2 4.2Å; F656-F659 AromaticContact CE1-CD2 3.79Å; F656-F659 HydrophobicContact CE1-CD2 3.79Å; F656-F659 AromaticContact CE1-CE2 3.91Å; F656-F659 HydrophobicContact CE1-CE2 3.91Å; F656-F659 HydrophobicContact CG-CD2 4.27Å; F656-F659 HydrophobicContact CZ-CE2 4.42Å; F659-L661 HydrophobicContact CE1-CD1 4.46Å; F659-L661 HydrophobicContact CE1-CG 4.44Å; F659-L661 HydrophobicContact CE2-CD1 3.96Å; F659-L661 HydrophobicContact CE2-CG 4.26Å; F659-L661 HydrophobicContact CZ-CD1 3.65Å; F659-L661 HydrophobicContact CZ-CG 4Å; F659-V672 HydrophobicContact CE2-CG1 3.59Å; F659-V672 HydrophobicContact CZ-CG1 3.91Å; F659-F688 HydrophobicContact CE1-CB 4.22Å; F659-F688 HydrophobicContact CE2-CB 4.46Å; F659-F688 HydrophobicContact CZ-CB 3.7Å; F659-E692 WeakPolarHBondContact CD1-O 3.38Å; F659-V693 HydrophobicContact CB-CG2 4.2Å; F659-P694 HydrophobicContact CD1-CG 4.44Å; F659-P694 HydrophobicContact CD2-CG 4.39Å; F659-P694 HydrophobicContact CE1-CG 4.38Å; F659-P694 HydrophobicContact CE2-CG 4.37Å; F659-P694 HydrophobicContact CG-CG 4.43Å; F659-P694 HydrophobicContact CZ-CG 4.36Å; F659-F719 HydrophobicContact CD2-CB 3.66Å; F659-F719 HydrophobicContact CD2-CD1 4.44Å; F659-F719 HydrophobicContact CD2-CG 4.32Å; F659-F719 HydrophobicContact CE2-CB 4.23Å; F659-F719 HydrophobicContact CE2-CD1 4.15Å; F659-F719 HydrophobicContact CE2-CG 4.46Å
660	E	93.7	Very high	88.4	Confident	42 Å²	42	59.7 Å²	59.7	20%	0.196	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	99	175.9	-168.1	-169.8	164.2	0	0	109.9	F658 G690 T691 K716 K717 G718	F658-E660 HydrophobicContact CE1-CB 3.52Å; F658-E660 HydrophobicContact CZ-CB 3.79Å; E660-G690 WeakPolarHBondContact CA-O 3.44Å; E660-T691 HydrophobicContact CG-CG2 4.26Å; E660-K716 HydrophobicContact CG-CB 4.09Å; E660-K716 HydrophobicContact CG-CG 4.47Å; E660-K716 WeakPolarHBondContact O-CB 3.26Å; E660-K717 WeakPolarHBondContact OE2-CD 3.24Å; E660-K717 IonicContact OE2-NZ 2.63Å; E660-G718 PolarHBondContact N-O 3.05Å; E660-G718 VanDerWaalsContact O-CA 3.27Å; E660-G718 WeakPolarHBondContact O-CA 3.48Å; E660-G718 PolarHBondContact O-N 3.37Å
661	L	92.8	Very high	88.8	Confident	5 Å²	5	58.5 Å²	58.5	3%	0.026	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-122.6	151.1	177.2	-62.4	-173.5	0	0	0	111.6	Y634 F659 G663 G690 F708 F719	Y634-L661 HydrophobicContact CD1-CD2 4.18Å; Y634-L661 HydrophobicContact CE1-CD2 3.48Å; Y634-L661 VanDerWaalsContact CE1-CD2 3.48Å; F659-L661 HydrophobicContact CE1-CD1 4.46Å; F659-L661 HydrophobicContact CE1-CG 4.44Å; F659-L661 HydrophobicContact CE2-CD1 3.96Å; F659-L661 HydrophobicContact CE2-CG 4.26Å; F659-L661 HydrophobicContact CZ-CD1 3.65Å; F659-L661 HydrophobicContact CZ-CG 4Å; L661-G663 PolarHBondContact O-N 2.97Å; L661-G690 PolarHBondContact N-O 2.86Å; L661-G690 WeakPolarHBondContact O-CA 3.13Å; L661-G690 PolarHBondContact O-N 3.42Å; L661-G690 VanDerWaalsContact O-N 3.07Å; L661-F708 HydrophobicContact CD1-CD2 4.1Å; L661-F708 HydrophobicContact CD1-CE2 3.95Å; L661-F708 HydrophobicContact CD2-CD2 4.3Å; L661-F708 HydrophobicContact CD2-CE2 3.54Å; L661-F708 HydrophobicContact CD2-CZ 4.2Å; L661-F708 HydrophobicContact CG-CE2 4.41Å; L661-F719 HydrophobicContact CD1-CD1 4.49Å; L661-F719 HydrophobicContact CD2-CD1 4.46Å
662	E	91.9	Very high	89.1	Confident	41 Å²	41	53.5 Å²	53.5	19%	0.192	26%	0.261	C	S	.	.	S	Bend	trans	-61.6	132.2	165.8	175.7	167.6	-140.3	0	0	110.4	Y634 Y669 D670 V714	Y634-E662 PolarHBondContact OH-N 3.4Å; E662-Y669 HydrophobicContact CG-CD2 4.34Å; E662-Y669 HydrophobicContact CG-CG 4.31Å; E662-D670 HydrophobicContact CB-CB 4.24Å; E662-D670 CarbonylContact O-C 3.56Å; E662-D670 WeakPolarHBondContact O-CB 3.19Å; E662-D670 PolarHBondContact O-N 3.01Å; E662-V714 WeakPolarHBondContact CB-O 3.46Å; E662-V714 WeakPolarHBondContact OE2-CA 3.17Å; E662-V714 VanDerWaalsContact OE2-CB 3.32Å; E662-V714 WeakPolarHBondContact OE2-CB 3.47Å; E662-V714 PolarHBondContact OE2-N 3.21Å
663	G	81.1	Confident	89.3	Confident	33 Å²	33	54.7 Å²	54.7	34%	0.34	27%	0.267	S	S	.	.			trans	-178.1	169.7	-177.2	0	0	0	0	0	115.3	L661	L661-G663 PolarHBondContact O-N 2.97Å
664	N	79.5	Confident	89.5	Confident	72 Å²	72	54.1 Å²	54.1	39%	0.385	26%	0.263	S	S	.	.			trans	-135.2	-179.8	168.7	64.4	1.6	0	0	0	108.4	V666 C667 K668 C689	N664-V666 PolarHBondContact O-N 3.4Å; N664-V666 PolarHBondContact OD1-N 2.92Å; N664-C667 PolarHBondContact O-N 3.03Å; N664-C667 PolarHBondContact OD1-N 2.91Å; N664-K668 PolarHBondContact OD1-N 3.33Å; N664-C689 PolarHBondContact O-SG 2.67Å
665	E	72.5	Confident	89.6	Confident	203 Å²	203	56.2 Å²	56.2	95%	0.949	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-17.7	-177.4	-62.8	-180	178.6	0	0	115.7
666	V	80.8	Confident	89.3	Confident	115 Å²	115	51 Å²	51	70%	0.697	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-0.3	-179.4	-164.2	0	0	0	0	112.2	N664 K668	N664-V666 PolarHBondContact O-N 3.4Å; N664-V666 PolarHBondContact OD1-N 2.92Å; V666-K668 PolarHBondContact O-N 3.04Å
667	C	86.6	Confident	89	Confident	10 Å²	10	51 Å²	51	7%	0.068	25%	0.251	C	S	.	.			trans	47.3	54.4	-177	-60.1	0	0	0	0	112.8	N664 K687 C689	N664-C667 PolarHBondContact O-N 3.03Å; N664-C667 PolarHBondContact OD1-N 2.91Å; C667-K687 HydrophobicContact CB-CD 4.13Å; C667-K687 HydrophobicContact CB-CG 4.18Å; C667-K687 VanDerWaalsContact O-CE 3.28Å; C667-K687 WeakPolarHBondContact O-CE 3.47Å; C667-K687 PolarHBondContact O-NZ 3.42Å; C667-C689 WeakPolarHBondContact CA-SG 3.29Å; C667-C689 HydrophobicContact CB-CB 3.62Å; C667-C689 WeakPolarHBondContact CB-SG 3.49Å; C667-C689 WeakPolarHBondContact SG-CB 3.08Å; C667-C689 PolarHBondContact SG-N 2.82Å; C667-C689 CovalentContact SG-SG 2.04Å; C667-C689 PolarHBondContact SG-SG 3.25Å
668	K	83.8	Confident	88.6	Confident	153 Å²	153	49.3 Å²	49.3	67%	0.665	24%	0.244	S	C	*	.			trans	-74.7	-36.2	-174.6	-172.8	-176.6	173.7	-167.5	0	113.7	N664 V666	N664-K668 PolarHBondContact OD1-N 3.33Å; V666-K668 PolarHBondContact O-N 3.04Å
669	Y	88.7	Confident	88	Confident	96 Å²	96	49 Å²	49	38%	0.376	25%	0.251	S	S	.	.	S	Bend	trans	-86.2	-107.9	-176.6	-52.8	-72	0	0	0	109.2	E662 Y671 D711	E662-Y669 HydrophobicContact CG-CD2 4.34Å; E662-Y669 HydrophobicContact CG-CG 4.31Å; Y669-Y671 VanDerWaalsContact O-CD1 3.29Å; Y669-Y671 WeakPolarHBondContact O-CD1 3.27Å; Y669-D711 WeakPolarHBondContact CD1-OD2 3.44Å
670	D	93	Very high	87.1	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.27	C	S	.	.	S	Bend	trans	-84.1	146.2	178.2	-59.1	-9.7	0	0	0	111.3	Y634 E662 C689 R709 S710 D711	Y634-D670 WeakPolarHBondContact CE2-OD2 3.41Å; Y634-D670 PolarHBondContact OH-OD2 2.98Å; E662-D670 HydrophobicContact CB-CB 4.24Å; E662-D670 CarbonylContact O-C 3.56Å; E662-D670 WeakPolarHBondContact O-CB 3.19Å; E662-D670 PolarHBondContact O-N 3.01Å; D670-C689 WeakPolarHBondContact O-CB 3.4Å; D670-R709 VanDerWaalsContact CA-O 3.32Å; D670-R709 WeakPolarHBondContact CA-O 3.16Å; D670-S710 WeakPolarHBondContact OD1-CA 3.22Å; D670-D711 PolarHBondContact OD1-N 2.5Å
671	Y	94	Very high	86.5	Confident	44 Å²	44	56.3 Å²	56.3	17%	0.173	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	158	179.9	57.8	-91.6	0	0	0	113.4	Y669 E673 K687 F688 F708 R709	Y669-Y671 VanDerWaalsContact O-CD1 3.29Å; Y669-Y671 WeakPolarHBondContact O-CD1 3.27Å; Y671-E673 HydrophobicContact CD2-CB 4.25Å; Y671-E673 HydrophobicContact CE2-CB 4.38Å; Y671-K687 HydrophobicContact CD2-CD 4.2Å; Y671-K687 HydrophobicContact CD2-CG 3.91Å; Y671-K687 VanDerWaalsContact CE1-CE 3.49Å; Y671-K687 VanDerWaalsContact CE2-CE 3.43Å; Y671-K687 HydrophobicContact CG-CD 4.26Å; Y671-K687 HydrophobicContact CG-CG 4.1Å; Y671-F688 CarbonylContact C-O 3.57Å; Y671-F688 VanDerWaalsContact CA-O 3.25Å; Y671-F688 WeakPolarHBondContact CA-O 3.35Å; Y671-F688 WeakPolarHBondContact CB-O 3.31Å; Y671-F708 CarbonylContact O-C 3.4Å; Y671-F708 WeakPolarHBondContact O-CA 3.35Å; Y671-F708 VanDerWaalsContact O-CD2 3.23Å; Y671-F708 WeakPolarHBondContact O-CD2 2.98Å; Y671-R709 HydrophobicContact CE1-CB 4.28Å; Y671-R709 HydrophobicContact CE2-CB 4.43Å; Y671-R709 HydrophobicContact CE2-CG 4.47Å; Y671-R709 PolarHBondContact N-O 3.06Å; Y671-R709 PolarHBondContact O-N 3.4Å
672	V	94.6	Very high	86.2	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	137.2	158.5	71.4	0	0	0	0	110.5	F656 F659 K687 F688 I706 E707 F708 F719	F656-V672 HydrophobicContact CE1-CG1 4.25Å; F656-V672 HydrophobicContact CZ-CG1 3.93Å; F659-V672 HydrophobicContact CE2-CG1 3.59Å; F659-V672 HydrophobicContact CZ-CG1 3.91Å; V672-K687 WeakPolarHBondContact O-CA 3.34Å; V672-F688 HydrophobicContact CG1-CB 3.99Å; V672-F688 HydrophobicContact CG1-CD2 4.25Å; V672-F688 PolarHBondContact N-O 2.79Å; V672-F688 PolarHBondContact O-N 2.83Å; V672-I706 HydrophobicContact CG2-CG2 3.45Å; V672-I706 VanDerWaalsContact CG2-CG2 3.45Å; V672-E707 CarbonylContact C-O 3.36Å; V672-E707 WeakPolarHBondContact CA-O 3.4Å; V672-F708 HydrophobicContact CG2-CB 4.32Å; V672-F719 HydrophobicContact CB-CD1 4.48Å; V672-F719 HydrophobicContact CB-CE1 3.86Å; V672-F719 HydrophobicContact CB-CZ 4.45Å; V672-F719 HydrophobicContact CG1-CE1 4.42Å; V672-F719 HydrophobicContact CG2-CE1 3.9Å; V672-F719 HydrophobicContact CG2-CZ 3.98Å
673	E	94	Very high	85.9	Confident	26 Å²	26	60.2 Å²	60.2	12%	0.121	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.6	179.9	-165.7	-172.8	72.8	0	0	109.8	Y671 R675 L684 I706 E707	Y671-E673 HydrophobicContact CD2-CB 4.25Å; Y671-E673 HydrophobicContact CE2-CB 4.38Å; E673-R675 IonicContact OE1-CZ 2.66Å; E673-R675 IonicContact OE1-NE 3.09Å; E673-R675 PolarHBondContact OE1-NE 3.11Å; E673-R675 IonicContact OE1-NH2 2.7Å; E673-R675 PolarHBondContact OE1-NH2 3.18Å; E673-R675 IonicContact OE2-CZ 2.75Å; E673-R675 IonicContact OE2-NE 2.71Å; E673-R675 IonicContact OE2-NH2 2.67Å; E673-R675 PolarHBondContact OE2-NH2 3.34Å; E673-L684 HydrophobicContact CG-CD1 3.32Å; E673-I706 CarbonylContact O-C 3.55Å; E673-I706 WeakPolarHBondContact O-CA 3.35Å; E673-E707 HydrophobicContact CB-CB 4.5Å; E673-E707 PolarHBondContact N-O 2.83Å; E673-E707 PolarHBondContact O-N 3.27Å
674	I	94.7	Very high	86.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.9	-177.3	-55.5	177.4	0	0	0	110.9	M654 F656 H685 G686 F688 V697 M704 R705 I706	M654-I674 HydrophobicContact CG-CD1 4.11Å; F656-I674 HydrophobicContact CE2-CD1 3.8Å; F656-I674 HydrophobicContact CZ-CD1 3.94Å; I674-H685 PolarHBondContact O-N 2.82Å; I674-G686 PolarHBondContact N-O 3.15Å; I674-G686 VanDerWaalsContact N-O 3.09Å; I674-F688 HydrophobicContact CB-CE2 4.44Å; I674-F688 HydrophobicContact CD1-CD2 4.37Å; I674-F688 HydrophobicContact CD1-CE2 3.97Å; I674-F688 HydrophobicContact CG1-CE2 4.18Å; I674-V697 HydrophobicContact CB-CG1 4.42Å; I674-V697 HydrophobicContact CD1-CB 4.31Å; I674-V697 HydrophobicContact CD1-CG2 4.11Å; I674-V697 HydrophobicContact CG2-CB 4.39Å; I674-V697 HydrophobicContact CG2-CG1 3.75Å; I674-M704 HydrophobicContact CG2-CE 4.36Å; I674-M704 HydrophobicContact CG2-CG 3.9Å; I674-M704 HydrophobicContact CG2-SD 3.69Å; I674-R705 WeakPolarHBondContact CA-O 3.07Å; I674-I706 HydrophobicContact CG1-CG1 4.42Å; I674-I706 HydrophobicContact CG1-CG2 4.34Å
675	R	93.7	Very high	86.8	Confident	43 Å²	43	62.6 Å²	62.6	16%	0.162	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	146.6	-177.1	-52.9	-174.2	173.8	-104.3	-2.5	113.9	E673 G677 S680 S682 K683 L684 M704 R705	E673-R675 IonicContact OE1-CZ 2.66Å; E673-R675 IonicContact OE1-NE 3.09Å; E673-R675 PolarHBondContact OE1-NE 3.11Å; E673-R675 IonicContact OE1-NH2 2.7Å; E673-R675 PolarHBondContact OE1-NH2 3.18Å; E673-R675 IonicContact OE2-CZ 2.75Å; E673-R675 IonicContact OE2-NE 2.71Å; E673-R675 IonicContact OE2-NH2 2.67Å; E673-R675 PolarHBondContact OE2-NH2 3.34Å; R675-G677 PolarHBondContact O-N 2.92Å; R675-S680 WeakPolarHBondContact CD-O 3.45Å; R675-S680 PolarHBondContact NE-O 3.42Å; R675-S680 PolarHBondContact NH1-O 2.96Å; R675-S682 VanDerWaalsContact CB-OG 3.29Å; R675-S682 WeakPolarHBondContact CB-OG 3.4Å; R675-S682 PolarHBondContact NH1-O 2.77Å; R675-K683 CarbonylContact C-O 3.59Å; R675-K683 VanDerWaalsContact CA-O 3.25Å; R675-K683 WeakPolarHBondContact CA-O 3.5Å; R675-L684 HydrophobicContact CG-CD1 4.12Å; R675-M704 WeakPolarHBondContact O-CA 3.44Å; R675-M704 WeakPolarHBondContact O-CG 3.41Å; R675-R705 PolarHBondContact N-O 3.35Å; R675-R705 PolarHBondContact O-N 3Å
676	S	88	Confident	87.6	Confident	6 Å²	6	53.6 Å²	53.6	4%	0.042	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	75.2	171.5	-87.1	0	0	0	0	111.9	K683 S699 Q700	S676-K683 PolarHBondContact N-O 3.47Å; S676-S699 VanDerWaalsContact OG-CA 3.29Å; S676-S699 WeakPolarHBondContact OG-CA 3.45Å; S676-Q700 PolarHBondContact OG-N 3.34Å
677	G	85.9	Confident	88.2	Confident	7 Å²	7	51.8 Å²	51.8	7%	0.072	26%	0.26	C	S	.	.	S	Bend	trans	159.4	174	176.9	0	0	0	0	0	112.4	R675 N703 R705	R675-G677 PolarHBondContact O-N 2.92Å; G677-N703 WeakPolarHBondContact CA-OD1 3.4Å; G677-R705 WeakPolarHBondContact O-CB 3.43Å; G677-R705 PolarHBondContact O-N 3.19Å
678	L	82.8	Confident	88.6	Confident	66 Å²	66	53.5 Å²	53.5	35%	0.346	27%	0.267	S	S	.	.	S	Bend	trans	-94.5	-15.6	-179	-64.9	178.7	0	0	0	114.4	Q643 V645 N703 R705	Q643-L678 HydrophobicContact CB-CD2 3.87Å; Q643-L678 HydrophobicContact CG-CD2 4.01Å; Q643-L678 PolarHBondContact NE2-O 3.21Å; V645-L678 HydrophobicContact CG2-CD1 4.03Å; V645-L678 HydrophobicContact CG2-CD2 3.82Å; V645-L678 HydrophobicContact CG2-CG 4.47Å; L678-N703 HydrophobicContact CD2-CB 4.04Å; L678-N703 HydrophobicContact CG-CB 3.98Å; L678-R705 WeakPolarHBondContact O-CD 3.3Å
679	S	80.4	Confident	89	Confident	60 Å²	60	47.1 Å²	47.1	42%	0.42	24%	0.241	S	C	.	.	S	Bend	trans	-91.5	162.1	176.3	63.9	0	0	0	0	112.5	D681 S682	S679-D681 PolarHBondContact O-N 2.92Å; S679-S682 WeakPolarHBondContact O-CB 3.47Å; S679-S682 PolarHBondContact O-N 2.96Å; S679-S682 PolarHBondContact O-OG 3.39Å; S679-S682 PolarHBondContact OG-N 3.21Å
680	S	75.8	Confident	89.1	Confident	63 Å²	63	43.4 Å²	43.4	44%	0.441	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.9	168	46.4	0	0	0	0	112.8	R675 S682	R675-S680 WeakPolarHBondContact CD-O 3.45Å; R675-S680 PolarHBondContact NE-O 3.42Å; R675-S680 PolarHBondContact NH1-O 2.96Å; S680-S682 VanDerWaalsContact C-N 3.26Å; S680-S682 PolarHBondContact O-N 2.86Å
681	D	81.1	Confident	89	Confident	139 Å²	139	48.5 Å²	48.5	74%	0.743	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	2.1	-169.3	-40.1	-34.7	0	0	0	112.3	S679	S679-D681 PolarHBondContact O-N 2.92Å
682	S	86.5	Confident	88.9	Confident	16 Å²	16	54.2 Å²	54.2	11%	0.112	29%	0.292	C	S	.	.	S	Bend	trans	-68.9	157.8	176.6	62.8	0	0	0	0	112.4	R675 S679 S680 L684	R675-S682 VanDerWaalsContact CB-OG 3.29Å; R675-S682 WeakPolarHBondContact CB-OG 3.4Å; R675-S682 PolarHBondContact NH1-O 2.77Å; S679-S682 WeakPolarHBondContact O-CB 3.47Å; S679-S682 PolarHBondContact O-N 2.96Å; S679-S682 PolarHBondContact O-OG 3.39Å; S679-S682 PolarHBondContact OG-N 3.21Å; S680-S682 VanDerWaalsContact C-N 3.26Å; S680-S682 PolarHBondContact O-N 2.86Å; S682-L684 PolarHBondContact O-N 3.09Å; S682-L684 VanDerWaalsContact O-N 3.09Å
683	K	87.4	Confident	88.7	Confident	112 Å²	112	58.2 Å²	58.2	49%	0.487	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	117	-172.8	-179.1	-175.1	175.2	177.6	0	110.8	R675 S676	R675-K683 CarbonylContact C-O 3.59Å; R675-K683 VanDerWaalsContact CA-O 3.25Å; R675-K683 WeakPolarHBondContact CA-O 3.5Å; S676-K683 PolarHBondContact N-O 3.47Å
684	L	90.3	Very high	88.6	Confident	74 Å²	74	57.7 Å²	57.7	39%	0.387	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	130.7	171.5	-177	62.7	0	0	0	110.5	E673 R675 S682 G686	E673-L684 HydrophobicContact CG-CD1 3.32Å; R675-L684 HydrophobicContact CG-CD1 4.12Å; S682-L684 PolarHBondContact O-N 3.09Å; S682-L684 VanDerWaalsContact O-N 3.09Å; L684-G686 WeakPolarHBondContact CD1-O 3.05Å
685	H	89.1	Confident	88.4	Confident	81 Å²	81	66.1 Å²	66.1	38%	0.375	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-41.9	167.5	-75.3	-74.2	0	0	0	111.7	I674 V697 T698	I674-H685 PolarHBondContact O-N 2.82Å; H685-V697 HydrophobicContact CB-CG1 3.53Å; H685-V697 VanDerWaalsContact CG-CG1 3.48Å; H685-T698 PolarHBondContact NE2-O 3.45Å
686	G	88.7	Confident	88.3	Confident	14 Å²	14	67.6 Å²	67.6	14%	0.144	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179	164.2	179.6	0	0	0	0	0	112.4	I674 L684	I674-G686 PolarHBondContact N-O 3.15Å; I674-G686 VanDerWaalsContact N-O 3.09Å; L684-G686 WeakPolarHBondContact CD1-O 3.05Å
687	K	92.8	Very high	88.4	Confident	76 Å²	76	67.9 Å²	67.9	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122	173.6	-172.2	-171.6	-172.4	-164.7	0	106.5	C667 Y671 V672	C667-K687 HydrophobicContact CB-CD 4.13Å; C667-K687 HydrophobicContact CB-CG 4.18Å; C667-K687 VanDerWaalsContact O-CE 3.28Å; C667-K687 WeakPolarHBondContact O-CE 3.47Å; C667-K687 PolarHBondContact O-NZ 3.42Å; Y671-K687 HydrophobicContact CD2-CD 4.2Å; Y671-K687 HydrophobicContact CD2-CG 3.91Å; Y671-K687 VanDerWaalsContact CE1-CE 3.49Å; Y671-K687 VanDerWaalsContact CE2-CE 3.43Å; Y671-K687 HydrophobicContact CG-CD 4.26Å; Y671-K687 HydrophobicContact CG-CG 4.1Å; V672-K687 WeakPolarHBondContact O-CA 3.34Å
688	F	94.4	Very high	88.6	Confident	46 Å²	46	70.3 Å²	70.3	20%	0.202	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.7	-165.2	-50	-83.5	0	0	0	111.1	F659 Y671 V672 I674 P694 V697	F659-F688 HydrophobicContact CE1-CB 4.22Å; F659-F688 HydrophobicContact CE2-CB 4.46Å; F659-F688 HydrophobicContact CZ-CB 3.7Å; Y671-F688 CarbonylContact C-O 3.57Å; Y671-F688 VanDerWaalsContact CA-O 3.25Å; Y671-F688 WeakPolarHBondContact CA-O 3.35Å; Y671-F688 WeakPolarHBondContact CB-O 3.31Å; V672-F688 HydrophobicContact CG1-CB 3.99Å; V672-F688 HydrophobicContact CG1-CD2 4.25Å; V672-F688 PolarHBondContact N-O 2.79Å; V672-F688 PolarHBondContact O-N 2.83Å; I674-F688 HydrophobicContact CB-CE2 4.44Å; I674-F688 HydrophobicContact CD1-CD2 4.37Å; I674-F688 HydrophobicContact CD1-CE2 3.97Å; I674-F688 HydrophobicContact CG1-CE2 4.18Å; F688-P694 HydrophobicContact CB-CG 3.82Å; F688-P694 HydrophobicContact CD1-CB 3.69Å; F688-P694 HydrophobicContact CD1-CG 3.66Å; F688-P694 HydrophobicContact CD2-CG 4.44Å; F688-P694 HydrophobicContact CE1-CB 3.82Å; F688-P694 HydrophobicContact CE1-CG 4.31Å; F688-P694 HydrophobicContact CG-CB 4.1Å; F688-P694 HydrophobicContact CG-CG 3.72Å; F688-P694 HydrophobicContact CZ-CB 4.34Å; F688-V697 HydrophobicContact CE2-CG2 4.35Å; F688-V697 HydrophobicContact CZ-CG2 4.05Å
689	C	93.4	Very high	88.9	Confident	19 Å²	19	67.3 Å²	67.3	13%	0.128	37%	0.368	C	S	.	.			trans	-162.5	176	-179.7	64.4	0	0	0	0	109.8	N664 C667 D670	N664-C689 PolarHBondContact O-SG 2.67Å; C667-C689 WeakPolarHBondContact CA-SG 3.29Å; C667-C689 HydrophobicContact CB-CB 3.62Å; C667-C689 WeakPolarHBondContact CB-SG 3.49Å; C667-C689 WeakPolarHBondContact SG-CB 3.08Å; C667-C689 PolarHBondContact SG-N 2.82Å; C667-C689 CovalentContact SG-SG 2.04Å; C667-C689 PolarHBondContact SG-SG 3.25Å; D670-C689 WeakPolarHBondContact O-CB 3.4Å
690	G	91.1	Very high	89.2	Confident	19 Å²	19	68.1 Å²	68.1	20%	0.196	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	81.6	-154.2	-176.9	0	0	0	0	0	112.9	E660 L661	E660-G690 WeakPolarHBondContact CA-O 3.44Å; L661-G690 PolarHBondContact N-O 2.86Å; L661-G690 WeakPolarHBondContact O-CA 3.13Å; L661-G690 PolarHBondContact O-N 3.42Å; L661-G690 VanDerWaalsContact O-N 3.07Å
691	T	91.1	Very high	89.7	Confident	108 Å²	108	72 Å²	72	66%	0.663	37%	0.371	S	S	*	.	S	Bend	trans	-107.9	-7.4	-174	51.9	0	0	0	0	114.4	E660	E660-T691 HydrophobicContact CG-CG2 4.26Å
692	E	91	Very high	90	Very high	164 Å²	164	67.1 Å²	67.1	77%	0.766	35%	0.345	S	S	*	.	S	Bend	trans	-78.6	127	179.2	-65.2	-172.4	163.8	0	0	110.1	F659 P694	F659-E692 WeakPolarHBondContact CD1-O 3.38Å; E692-P694 WeakPolarHBondContact O-CD 3.29Å
693	V	91.2	Very high	90.2	Very high	83 Å²	83	68 Å²	68	50%	0.503	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-75.1	120.5	-179	-177.6	0	0	0	0	109.3	F656 F659	F656-V693 HydrophobicContact CB-CG1 3.71Å; F659-V693 HydrophobicContact CB-CG2 4.2Å
694	P	92.1	Very high	90.5	Very high	16 Å²	16	62.7 Å²	62.7	10%	0.104	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-63.6	146.2	-179.5	-24.2	35.2	0	0	0	113.4	F656 F659 F688 E692	F656-P694 HydrophobicContact CD2-CB 3.84Å; F656-P694 HydrophobicContact CD2-CG 3.87Å; F656-P694 HydrophobicContact CE2-CB 4.06Å; F656-P694 HydrophobicContact CE2-CG 4.02Å; F656-P694 HydrophobicContact CG-CG 4.38Å; F659-P694 HydrophobicContact CD1-CG 4.44Å; F659-P694 HydrophobicContact CD2-CG 4.39Å; F659-P694 HydrophobicContact CE1-CG 4.38Å; F659-P694 HydrophobicContact CE2-CG 4.37Å; F659-P694 HydrophobicContact CG-CG 4.43Å; F659-P694 HydrophobicContact CZ-CG 4.36Å; F688-P694 HydrophobicContact CB-CG 3.82Å; F688-P694 HydrophobicContact CD1-CB 3.69Å; F688-P694 HydrophobicContact CD1-CG 3.66Å; F688-P694 HydrophobicContact CD2-CG 4.44Å; F688-P694 HydrophobicContact CE1-CB 3.82Å; F688-P694 HydrophobicContact CE1-CG 4.31Å; F688-P694 HydrophobicContact CG-CB 4.1Å; F688-P694 HydrophobicContact CG-CG 3.72Å; F688-P694 HydrophobicContact CZ-CB 4.34Å; E692-P694 WeakPolarHBondContact O-CD 3.29Å
695	E	90.6	Very high	90.6	Very high	176 Å²	176	60.7 Å²	60.7	82%	0.822	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-58.7	161.4	168.9	-66.1	-168.3	158.7	0	0	112.4	V697	E695-V697 PolarHBondContact O-N 2.87Å; E695-V697 VanDerWaalsContact O-N 3.14Å
696	V	89.9	Confident	90.8	Very high	74 Å²	74	56.9 Å²	56.9	45%	0.448	30%	0.295	S	S	.	.			trans	-66.7	114.2	-177.1	-179	0	0	0	0	110.8	M654 K655	M654-V696 WeakPolarHBondContact O-CA 3.28Å; K655-V696 HydrophobicContact CB-CG2 4.07Å; K655-V696 HydrophobicContact CD-CG2 4.44Å; K655-V696 HydrophobicContact CG-CG2 4.06Å
697	V	90.8	Very high	91	Very high	13 Å²	13	56.9 Å²	56.9	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	119.4	-179	-177.3	0	0	0	0	110.2	S653 M654 I674 H685 F688 E695 M704	S653-V697 CarbonylContact C-O 3.47Å; S653-V697 WeakPolarHBondContact CA-O 3.36Å; M654-V697 PolarHBondContact N-O 2.82Å; M654-V697 PolarHBondContact O-N 3.38Å; I674-V697 HydrophobicContact CB-CG1 4.42Å; I674-V697 HydrophobicContact CD1-CB 4.31Å; I674-V697 HydrophobicContact CD1-CG2 4.11Å; I674-V697 HydrophobicContact CG2-CB 4.39Å; I674-V697 HydrophobicContact CG2-CG1 3.75Å; H685-V697 HydrophobicContact CB-CG1 3.53Å; H685-V697 VanDerWaalsContact CG-CG1 3.48Å; F688-V697 HydrophobicContact CE2-CG2 4.35Å; F688-V697 HydrophobicContact CZ-CG2 4.05Å; E695-V697 PolarHBondContact O-N 2.87Å; E695-V697 VanDerWaalsContact O-N 3.14Å; V697-M704 WeakPolarHBondContact O-CE 3.41Å
698	T	89.9	Confident	91.1	Very high	58 Å²	58	53.2 Å²	53.2	36%	0.356	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.5	177.2	-55.2	0	0	0	0	111.1	R651 S653 H685	R651-T698 HydrophobicContact CB-CG2 4.19Å; S653-T698 WeakPolarHBondContact OG-CG2 3.17Å; S653-T698 PolarHBondContact OG-OG1 2.84Å; S653-T698 VanDerWaalsContact OG-OG1 3.06Å; H685-T698 PolarHBondContact NE2-O 3.45Å
699	S	90.4	Very high	90.9	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.014	28%	0.284	C	S	.	.			trans	-71.4	149.8	177.6	51.3	0	0	0	0	112.9	R651 I652 S676 Y701	R651-S699 WeakPolarHBondContact CD-O 3.37Å; I652-S699 WeakPolarHBondContact CA-OG 3.37Å; I652-S699 WeakPolarHBondContact CB-OG 3.33Å; I652-S699 PolarHBondContact N-OG 3.22Å; I652-S699 PolarHBondContact O-N 2.53Å; I652-S699 PolarHBondContact O-OG 2.92Å; S676-S699 VanDerWaalsContact OG-CA 3.29Å; S676-S699 WeakPolarHBondContact OG-CA 3.45Å; S699-Y701 PolarHBondContact OG-O 2.88Å
700	Q	84.9	Confident	90.8	Very high	78 Å²	78	55.5 Å²	55.5	36%	0.364	28%	0.282	S	S	.	.	S	Bend	trans	-72.7	-31.7	177.5	-61.9	-167.3	-61.8	0	0	112.5	R651 S676	R651-Q700 PolarHBondContact NE-O 3.29Å; S676-Q700 PolarHBondContact OG-N 3.34Å
701	Y	86.4	Confident	90.6	Very high	145 Å²	145	56.5 Å²	56.5	57%	0.569	28%	0.282	S	S	*	.	S	Bend	trans	-124.5	-173.4	-175.3	-54.4	-68	0	0	0	110.7	S699 N703	S699-Y701 PolarHBondContact OG-O 2.88Å; Y701-N703 PolarHBondContact O-N 3.04Å; Y701-N703 VanDerWaalsContact O-N 3.11Å
702	N	87.9	Confident	90.4	Very high	35 Å²	35	56.9 Å²	56.9	19%	0.187	28%	0.281	C	S	.	.	S	Bend	trans	-77.2	18	176.6	70.3	-56.9	0	0	0	114.6	A646 P647 Y650 I652	A646-N702 PolarHBondContact N-O 2.89Å; A646-N702 WeakPolarHBondContact O-CB 3.09Å; A646-N702 PolarHBondContact O-ND2 3.23Å; P647-N702 VanDerWaalsContact O-CB 3.24Å; P647-N702 WeakPolarHBondContact O-CB 3.25Å; Y650-N702 WeakPolarHBondContact O-CA 3.46Å; Y650-N702 WeakPolarHBondContact O-CB 3.47Å; I652-N702 WeakPolarHBondContact CD1-O 3.19Å
703	N	91.3	Very high	90	Very high	35 Å²	35	52.7 Å²	52.7	19%	0.187	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	146.4	179.1	54	30.1	0	0	0	112.9	V644 V645 G677 L678 Y701	V644-N703 VanDerWaalsContact O-CA 3.28Å; V644-N703 WeakPolarHBondContact O-CA 3.26Å; V645-N703 HydrophobicContact CG2-CB 4.36Å; G677-N703 WeakPolarHBondContact CA-OD1 3.4Å; L678-N703 HydrophobicContact CD2-CB 4.04Å; L678-N703 HydrophobicContact CG-CB 3.98Å; Y701-N703 PolarHBondContact O-N 3.04Å; Y701-N703 VanDerWaalsContact O-N 3.11Å
704	M	92.9	Very high	89.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139.8	179.8	-173.3	-175	-74.9	0	0	109.8	Q643 V644 I652 M654 I674 R675 V697 I706	Q643-M704 CarbonylContact C-O 3.45Å; V644-M704 HydrophobicContact CB-CB 4.48Å; V644-M704 PolarHBondContact N-O 3.13Å; V644-M704 PolarHBondContact O-N 3.13Å; I652-M704 HydrophobicContact CB-CB 4.39Å; I652-M704 HydrophobicContact CB-CE 4.28Å; I652-M704 HydrophobicContact CD1-CB 4.17Å; I652-M704 HydrophobicContact CG2-CB 4.32Å; I652-M704 HydrophobicContact CG2-CE 4.05Å; I652-M704 HydrophobicContact CG2-SD 4.22Å; I652-M704 WeakPolarHBondContact O-CE 3.45Å; M654-M704 HydrophobicContact CB-CE 4.17Å; M654-M704 HydrophobicContact CB-SD 3.95Å; I674-M704 HydrophobicContact CG2-CE 4.36Å; I674-M704 HydrophobicContact CG2-CG 3.9Å; I674-M704 HydrophobicContact CG2-SD 3.69Å; R675-M704 WeakPolarHBondContact O-CA 3.44Å; R675-M704 WeakPolarHBondContact O-CG 3.41Å; V697-M704 WeakPolarHBondContact O-CE 3.41Å; M704-I706 HydrophobicContact CB-CD1 4.44Å; M704-I706 HydrophobicContact CG-CD1 3.91Å; M704-I706 HydrophobicContact CG-CG1 4.34Å; M704-I706 HydrophobicContact SD-CD1 3.94Å; M704-I706 HydrophobicContact SD-CG1 4.19Å
705	R	92.6	Very high	89.2	Confident	32 Å²	32	52.5 Å²	52.5	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.5	172.6	-179.9	171.7	-175.5	-86.2	-9	109.3	V641 W642 Q643 I674 R675 G677 L678 E707	V641-R705 HydrophobicContact CG1-CG 4.13Å; W642-R705 WeakPolarHBondContact O-CA 3.27Å; Q643-R705 HydrophobicContact CG-CG 4.37Å; I674-R705 WeakPolarHBondContact CA-O 3.07Å; R675-R705 PolarHBondContact N-O 3.35Å; R675-R705 PolarHBondContact O-N 3Å; G677-R705 WeakPolarHBondContact O-CB 3.43Å; G677-R705 PolarHBondContact O-N 3.19Å; L678-R705 WeakPolarHBondContact O-CD 3.3Å; R705-E707 IonicContact CZ-OE2 3Å; R705-E707 IonicContact NH1-OE2 3.18Å; R705-E707 PolarHBondContact NH1-OE2 3.16Å; R705-E707 IonicContact NH2-OE2 2.63Å; R705-E707 PolarHBondContact NH2-OE2 3.42Å
706	I	93.8	Very high	89.3	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.2	179	-54	90.4	0	0	0	107.1	I625 V641 W642 V644 V672 E673 I674 M704	I625-I706 HydrophobicContact CD1-CB 4.49Å; I625-I706 HydrophobicContact CD1-CG2 4.15Å; V641-I706 CarbonylContact C-O 3.55Å; V641-I706 WeakPolarHBondContact CA-O 3.12Å; W642-I706 HydrophobicContact CB-CB 4.36Å; W642-I706 HydrophobicContact CB-CD1 4.42Å; W642-I706 HydrophobicContact CE3-CB 4.33Å; W642-I706 HydrophobicContact CE3-CG2 4.13Å; W642-I706 PolarHBondContact N-O 2.88Å; W642-I706 PolarHBondContact O-N 3.09Å; V644-I706 HydrophobicContact CG2-CD1 3.77Å; V672-I706 HydrophobicContact CG2-CG2 3.45Å; V672-I706 VanDerWaalsContact CG2-CG2 3.45Å; E673-I706 CarbonylContact O-C 3.55Å; E673-I706 WeakPolarHBondContact O-CA 3.35Å; I674-I706 HydrophobicContact CG1-CG1 4.42Å; I674-I706 HydrophobicContact CG1-CG2 4.34Å; M704-I706 HydrophobicContact CB-CD1 4.44Å; M704-I706 HydrophobicContact CG-CD1 3.91Å; M704-I706 HydrophobicContact CG-CG1 4.34Å; M704-I706 HydrophobicContact SD-CD1 3.94Å; M704-I706 HydrophobicContact SD-CG1 4.19Å
707	E	92.9	Very high	89.2	Confident	14 Å²	14	49.1 Å²	49.1	7%	0.065	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	110.8	-178.3	178	163.6	179.4	0	0	109.8	C640 V641 V672 E673 R705 R709	C640-E707 CarbonylContact O-C 3.48Å; C640-E707 WeakPolarHBondContact O-CA 3.31Å; V641-E707 HydrophobicContact CG2-CB 4.39Å; V641-E707 HydrophobicContact CG2-CG 4.01Å; V672-E707 CarbonylContact C-O 3.36Å; V672-E707 WeakPolarHBondContact CA-O 3.4Å; E673-E707 HydrophobicContact CB-CB 4.5Å; E673-E707 PolarHBondContact N-O 2.83Å; E673-E707 PolarHBondContact O-N 3.27Å; R705-E707 IonicContact CZ-OE2 3Å; R705-E707 IonicContact NH1-OE2 3.18Å; R705-E707 PolarHBondContact NH1-OE2 3.16Å; R705-E707 IonicContact NH2-OE2 2.63Å; R705-E707 PolarHBondContact NH2-OE2 3.42Å; E707-R709 HydrophobicContact CG-CG 4.34Å; E707-R709 IonicContact OE1-CZ 3.85Å; E707-R709 IonicContact OE1-NE 2.86Å; E707-R709 PolarHBondContact OE1-NE 2.59Å; E707-R709 IonicContact OE1-NH2 3.94Å; E707-R709 PolarHBondContact OE1-NH2 2.77Å
708	F	93.7	Very high	89.3	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134	171.8	168	-110.8	0	0	0	110.1	T627 Y634 N639 C640 W642 L661 Y671 V672 F719	T627-F708 HydrophobicContact CG2-CD1 4.22Å; T627-F708 HydrophobicContact CG2-CE1 4.09Å; T627-F708 HydrophobicContact CG2-CE2 4.41Å; T627-F708 HydrophobicContact CG2-CG 4.43Å; T627-F708 HydrophobicContact CG2-CZ 4.19Å; Y634-F708 HydrophobicContact CD1-CZ 4.11Å; Y634-F708 HydrophobicContact CD2-CE1 4.46Å; Y634-F708 AromaticContact CD2-CZ 3.88Å; Y634-F708 HydrophobicContact CD2-CZ 3.88Å; Y634-F708 HydrophobicContact CE1-CZ 4.3Å; Y634-F708 HydrophobicContact CE2-CZ 4.08Å; Y634-F708 HydrophobicContact CG-CE1 4.37Å; Y634-F708 AromaticContact CG-CZ 3.9Å; Y634-F708 HydrophobicContact CG-CZ 3.9Å; N639-F708 CarbonylContact C-O 3.44Å; N639-F708 WeakPolarHBondContact CA-O 3Å; C640-F708 HydrophobicContact CB-CB 4.2Å; C640-F708 HydrophobicContact CB-CD1 4.22Å; C640-F708 PolarHBondContact N-O 2.8Å; C640-F708 PolarHBondContact O-N 2.71Å; W642-F708 HydrophobicContact CH2-CB 4.3Å; W642-F708 HydrophobicContact CZ3-CB 3.79Å; L661-F708 HydrophobicContact CD1-CD2 4.1Å; L661-F708 HydrophobicContact CD1-CE2 3.95Å; L661-F708 HydrophobicContact CD2-CD2 4.3Å; L661-F708 HydrophobicContact CD2-CE2 3.54Å; L661-F708 HydrophobicContact CD2-CZ 4.2Å; L661-F708 HydrophobicContact CG-CE2 4.41Å; Y671-F708 CarbonylContact O-C 3.4Å; Y671-F708 WeakPolarHBondContact O-CA 3.35Å; Y671-F708 VanDerWaalsContact O-CD2 3.23Å; Y671-F708 WeakPolarHBondContact O-CD2 2.98Å; V672-F708 HydrophobicContact CG2-CB 4.32Å; F708-F719 HydrophobicContact CB-CE1 3.95Å; F708-F719 HydrophobicContact CB-CZ 4.18Å; F708-F719 AromaticContact CD2-CE1 3.89Å; F708-F719 HydrophobicContact CD2-CE1 3.89Å; F708-F719 AromaticContact CG-CE1 3.95Å; F708-F719 HydrophobicContact CG-CE1 3.95Å
709	R	90.9	Very high	89.4	Confident	101 Å²	101	45.7 Å²	45.7	38%	0.381	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.3	172.9	-66.3	-166.9	-179.9	-149.8	4.9	111.1	K638 N639 D670 Y671 E707	K638-R709 WeakPolarHBondContact O-CA 3.2Å; N639-R709 HydrophobicContact CB-CG 4.37Å; N639-R709 PolarHBondContact ND2-NH2 3.2Å; N639-R709 PolarHBondContact OD1-NE 2.91Å; D670-R709 VanDerWaalsContact CA-O 3.32Å; D670-R709 WeakPolarHBondContact CA-O 3.16Å; Y671-R709 HydrophobicContact CE1-CB 4.28Å; Y671-R709 HydrophobicContact CE2-CB 4.43Å; Y671-R709 HydrophobicContact CE2-CG 4.47Å; Y671-R709 PolarHBondContact N-O 3.06Å; Y671-R709 PolarHBondContact O-N 3.4Å; E707-R709 HydrophobicContact CG-CG 4.34Å; E707-R709 IonicContact OE1-CZ 3.85Å; E707-R709 IonicContact OE1-NE 2.86Å; E707-R709 PolarHBondContact OE1-NE 2.59Å; E707-R709 IonicContact OE1-NH2 3.94Å; E707-R709 PolarHBondContact OE1-NH2 2.77Å
710	S	91.4	Very high	89.5	Confident	12 Å²	12	48.9 Å²	48.9	8%	0.084	24%	0.235	C	C	.	.			trans	-114.6	145.8	164.1	58.6	0	0	0	0	111.7	P635 N637 K638 D670	P635-S710 PolarHBondContact O-OG 3.22Å; N637-S710 WeakPolarHBondContact CA-O 2.88Å; N637-S710 PolarHBondContact N-O 3.27Å; N637-S710 PolarHBondContact N-OG 3.05Å; K638-S710 PolarHBondContact N-OG 3.41Å; K638-S710 PolarHBondContact O-N 3.13Å; D670-S710 WeakPolarHBondContact OD1-CA 3.22Å
711	D	87.8	Confident	89.9	Confident	39 Å²	39	45.1 Å²	45.1	21%	0.209	22%	0.217	C	C	.	.			trans	-87.8	-167.5	173.4	78.6	23.5	0	0	0	112.5	P636 N637 Y669 D670 T713	P636-D711 CarbonylContact C-O 3.43Å; P636-D711 VanDerWaalsContact CA-O 3.25Å; P636-D711 WeakPolarHBondContact CA-O 3.3Å; P636-D711 WeakPolarHBondContact CB-O 3.09Å; N637-D711 PolarHBondContact N-O 3.14Å; Y669-D711 WeakPolarHBondContact CD1-OD2 3.44Å; D670-D711 PolarHBondContact OD1-N 2.5Å; D711-T713 VanDerWaalsContact C-N 3.26Å; D711-T713 PolarHBondContact O-N 3.17Å; D711-T713 WeakPolarHBondContact OD1-CA 3.3Å; D711-T713 WeakPolarHBondContact OD1-CB 3.15Å; D711-T713 PolarHBondContact OD1-N 2.03Å; D711-T713 PolarHBondContact OD1-OG1 3.33Å
712	N	86.7	Confident	90.2	Very high	117 Å²	117	41 Å²	41	63%	0.626	20%	0.203	S	C	*	.	S	Bend	trans	-84.4	7.3	-177.8	70.3	-27.9	0	0	0	114.4	N637	N637-N712 WeakPolarHBondContact ND2-CA 3.23Å; N637-N712 WeakPolarHBondContact ND2-CB 3.44Å; N637-N712 WeakPolarHBondContact OD1-CB 3.28Å
713	T	81.6	Confident	90.4	Very high	75 Å²	75	39.5 Å²	39.5	46%	0.46	20%	0.195	S	C	.	.	S	Bend	trans	-119.5	-127.4	-175.1	48.1	0	0	0	0	113.9	D711 S715	D711-T713 VanDerWaalsContact C-N 3.26Å; D711-T713 PolarHBondContact O-N 3.17Å; D711-T713 WeakPolarHBondContact OD1-CA 3.3Å; D711-T713 WeakPolarHBondContact OD1-CB 3.15Å; D711-T713 PolarHBondContact OD1-N 2.03Å; D711-T713 PolarHBondContact OD1-OG1 3.33Å; T713-S715 PolarHBondContact O-N 3.36Å; T713-S715 VanDerWaalsContact O-N 3.1Å
714	V	80.3	Confident	90.4	Very high	72 Å²	72	39.6 Å²	39.6	44%	0.436	19%	0.194	S	C	.	.			trans	-78.9	106.2	-147.8	-175.1	0	0	0	0	112.7	E662	E662-V714 WeakPolarHBondContact CB-O 3.46Å; E662-V714 WeakPolarHBondContact OE2-CA 3.17Å; E662-V714 VanDerWaalsContact OE2-CB 3.32Å; E662-V714 WeakPolarHBondContact OE2-CB 3.47Å; E662-V714 PolarHBondContact OE2-N 3.21Å
715	S	87.6	Confident	90.1	Very high	23 Å²	23	40.3 Å²	40.3	16%	0.161	20%	0.199	C	C	.	.			trans	-70.8	145.1	173.6	-52.2	0	0	0	0	112.7	Y634 T713	Y634-S715 WeakPolarHBondContact O-CB 3.1Å; Y634-S715 PolarHBondContact O-OG 2.82Å; T713-S715 PolarHBondContact O-N 3.36Å; T713-S715 VanDerWaalsContact O-N 3.1Å
716	K	91.2	Very high	89.5	Confident	80 Å²	80	39.7 Å²	39.7	35%	0.348	20%	0.198	S	C	.	.			trans	-127.7	177.9	172.6	-64.6	-62.2	-175.6	177.4	0	109.7	E633 Y634 E660 G718	E633-K716 CarbonylContact C-O 3.55Å; E633-K716 WeakPolarHBondContact CA-O 3.42Å; Y634-K716 WeakPolarHBondContact CD1-O 3.38Å; Y634-K716 HydrophobicContact CE1-CB 3.81Å; Y634-K716 WeakPolarHBondContact CE1-O 3.28Å; Y634-K716 VanDerWaalsContact CZ-N 3.32Å; Y634-K716 PolarHBondContact N-O 3.03Å; Y634-K716 PolarHBondContact OH-N 3Å; E660-K716 HydrophobicContact CG-CB 4.09Å; E660-K716 HydrophobicContact CG-CG 4.47Å; E660-K716 WeakPolarHBondContact O-CB 3.26Å; K716-G718 PolarHBondContact O-N 2.88Å
717	K	88.3	Confident	88.8	Confident	99 Å²	99	42.5 Å²	42.5	43%	0.43	21%	0.21	S	C	.	.			trans	-61.1	-25.1	179.7	-67.5	-179.5	-168	149.6	0	113.7	T627 W630 F658 E660	T627-K717 PolarHBondContact OG1-O 2.72Å; W630-K717 VanDerWaalsContact CE3-O 3.29Å; W630-K717 HydrophobicContact CZ3-CB 4.23Å; F658-K717 HydrophobicContact CE1-CB 3.9Å; F658-K717 HydrophobicContact CE1-CD 4.44Å; F658-K717 HydrophobicContact CZ-CB 4.27Å; F658-K717 HydrophobicContact CZ-CD 4.02Å; E660-K717 WeakPolarHBondContact OE2-CD 3.24Å; E660-K717 IonicContact OE2-NZ 2.63Å
718	G	91.9	Very high	87.9	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.6	-143.6	178.6	0	0	0	0	0	113.1	T627 Y634 F658 E660 K716	T627-G718 WeakPolarHBondContact OG1-CA 3.29Å; Y634-G718 VanDerWaalsContact CD1-CA 3.49Å; F658-G718 WeakPolarHBondContact CD1-O 3.47Å; F658-G718 WeakPolarHBondContact CE1-O 3.4Å; E660-G718 PolarHBondContact N-O 3.05Å; E660-G718 VanDerWaalsContact O-CA 3.27Å; E660-G718 WeakPolarHBondContact O-CA 3.48Å; E660-G718 PolarHBondContact O-N 3.37Å; K716-G718 PolarHBondContact O-N 2.88Å
719	F	93.4	Very high	87.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	154.1	-178.1	66.1	-105	0	0	0	113.1	I625 T626 T627 W642 F656 F658 F659 L661 V672 F708 A721	I625-F719 HydrophobicContact CD1-CE2 4.13Å; I625-F719 HydrophobicContact CG1-CE2 4.19Å; T626-F719 VanDerWaalsContact CA-O 3.29Å; T626-F719 WeakPolarHBondContact CA-O 3.44Å; T627-F719 HydrophobicContact CG2-CD1 3.44Å; T627-F719 VanDerWaalsContact CG2-CD1 3.44Å; T627-F719 HydrophobicContact CG2-CD2 4.42Å; T627-F719 HydrophobicContact CG2-CE1 3.53Å; T627-F719 HydrophobicContact CG2-CE2 4.5Å; T627-F719 HydrophobicContact CG2-CG 3.91Å; T627-F719 HydrophobicContact CG2-CZ 4.08Å; T627-F719 PolarHBondContact N-O 2.89Å; T627-F719 PolarHBondContact OG1-N 2.87Å; T627-F719 PolarHBondContact OG1-O 2.78Å; W642-F719 HydrophobicContact CH2-CZ 4.03Å; W642-F719 AromaticContact CZ3-CZ 3.9Å; W642-F719 HydrophobicContact CZ3-CZ 3.9Å; F656-F719 HydrophobicContact CD1-CB 4.06Å; F656-F719 HydrophobicContact CD1-CD2 4.24Å; F656-F719 HydrophobicContact CD1-CG 4.24Å; F656-F719 HydrophobicContact CE1-CB 4.19Å; F656-F719 HydrophobicContact CE1-CD1 4.39Å; F656-F719 AromaticContact CE1-CD2 3.83Å; F656-F719 HydrophobicContact CE1-CD2 3.83Å; F656-F719 HydrophobicContact CE1-CE2 4.31Å; F656-F719 AromaticContact CE1-CG 3.89Å; F656-F719 HydrophobicContact CE1-CG 3.89Å; F658-F719 VanDerWaalsContact O-CA 3.24Å; F658-F719 WeakPolarHBondContact O-CA 3.27Å; F658-F719 VanDerWaalsContact O-CB 3.28Å; F658-F719 WeakPolarHBondContact O-CB 3.49Å; F659-F719 HydrophobicContact CD2-CB 3.66Å; F659-F719 HydrophobicContact CD2-CD1 4.44Å; F659-F719 HydrophobicContact CD2-CG 4.32Å; F659-F719 HydrophobicContact CE2-CB 4.23Å; F659-F719 HydrophobicContact CE2-CD1 4.15Å; F659-F719 HydrophobicContact CE2-CG 4.46Å; L661-F719 HydrophobicContact CD1-CD1 4.49Å; L661-F719 HydrophobicContact CD2-CD1 4.46Å; V672-F719 HydrophobicContact CB-CD1 4.48Å; V672-F719 HydrophobicContact CB-CE1 3.86Å; V672-F719 HydrophobicContact CB-CZ 4.45Å; V672-F719 HydrophobicContact CG1-CE1 4.42Å; V672-F719 HydrophobicContact CG2-CE1 3.9Å; V672-F719 HydrophobicContact CG2-CZ 3.98Å; F708-F719 HydrophobicContact CB-CE1 3.95Å; F708-F719 HydrophobicContact CB-CZ 4.18Å; F708-F719 AromaticContact CD2-CE1 3.89Å; F708-F719 HydrophobicContact CD2-CE1 3.89Å; F708-F719 AromaticContact CG-CE1 3.95Å; F708-F719 HydrophobicContact CG-CE1 3.95Å; F719-A721 HydrophobicContact CD2-CB 4.29Å
720	K	92.8	Very high	86.8	Confident	68 Å²	68	41.7 Å²	41.7	30%	0.296	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	126.6	165.7	-180	-179.4	-178.5	-133.8	0	107.6	T624 T626 W630 E657 F658	T624-K720 HydrophobicContact CG2-CG 3.9Å; T626-K720 HydrophobicContact CG2-CB 4.04Å; T626-K720 HydrophobicContact CG2-CG 3.83Å; W630-K720 HydrophobicContact CD2-CB 4.31Å; W630-K720 HydrophobicContact CH2-CB 4.39Å; W630-K720 HydrophobicContact CZ2-CB 3.97Å; W630-K720 HydrophobicContact CZ2-CD 4.33Å; E657-K720 PolarHBondContact N-O 3.12Å; E657-K720 WeakPolarHBondContact OE2-CD 3.37Å; E657-K720 WeakPolarHBondContact OE2-CE 3.37Å; E657-K720 IonicContact OE2-NZ 3.66Å; E657-K720 PolarHBondContact OE2-NZ 2.91Å; F658-K720 HydrophobicContact CB-CB 4.45Å; F658-K720 PolarHBondContact N-O 3.03Å; F658-K720 VanDerWaalsContact N-O 3.13Å; F658-K720 PolarHBondContact O-N 3.33Å
721	A	92.3	Very high	86	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	139	-174.2	0	0	0	0	0	111.9	T624 I625 M654 K655 F656 F719	T624-A721 CarbonylContact C-O 3.52Å; T624-A721 VanDerWaalsContact CA-O 3.31Å; T624-A721 WeakPolarHBondContact CA-O 3.41Å; T624-A721 WeakPolarHBondContact CG2-O 3.28Å; I625-A721 HydrophobicContact CG1-CB 4.35Å; I625-A721 PolarHBondContact N-O 2.73Å; I625-A721 PolarHBondContact O-N 2.74Å; M654-A721 HydrophobicContact CE-CB 3.29Å; M654-A721 HydrophobicContact SD-CB 4.01Å; K655-A721 CarbonylContact O-C 3.58Å; K655-A721 VanDerWaalsContact O-CA 3.26Å; K655-A721 WeakPolarHBondContact O-CA 3.47Å; K655-A721 WeakPolarHBondContact O-CB 3.45Å; F656-A721 HydrophobicContact CB-CB 4.49Å; F656-A721 HydrophobicContact CD1-CB 3.58Å; F656-A721 HydrophobicContact CE1-CB 3.88Å; F656-A721 HydrophobicContact CG-CB 4.05Å; F719-A721 HydrophobicContact CD2-CB 4.29Å
722	H	92.7	Very high	85.2	Confident	57 Å²	57	51.6 Å²	51.6	26%	0.264	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	125.7	178.8	-168.6	68	0	0	0	109.8	G623 T624 K655	G623-H722 WeakPolarHBondContact O-CA 3.31Å; G623-H722 PolarHBondContact O-CE1 3.13Å; G623-H722 PolarHBondContact O-ND1 2.81Å; T624-H722 PolarHBondContact OG1-ND1 3.19Å; K655-H722 PolarHBondContact N-O 3.47Å; K655-H722 PolarHBondContact O-N 3.27Å
723	F	92.8	Very high	84.8	Confident	5 Å²	5	52.9 Å²	52.9	2%	0.022	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	143.4	170.2	75.1	-89	0	0	0	110	L618 K620 N622 G623 I625 V644 I652 S653 M654	L618-F723 HydrophobicContact CB-CZ 4.18Å; L618-F723 HydrophobicContact CD1-CE1 3.78Å; L618-F723 HydrophobicContact CD1-CZ 4.08Å; K620-F723 WeakPolarHBondContact O-CE2 3.36Å; N622-F723 CarbonylContact C-O 3.58Å; N622-F723 VanDerWaalsContact CA-O 3.29Å; N622-F723 WeakPolarHBondContact CA-O 3.43Å; G623-F723 VanDerWaalsContact C-CE1 3.44Å; G623-F723 VanDerWaalsContact CA-CE1 3.5Å; G623-F723 PolarHBondContact N-O 2.86Å; G623-F723 WeakPolarHBondContact O-CD1 3.43Å; G623-F723 PolarHBondContact O-N 3.39Å; G623-F723 VanDerWaalsContact O-O 3.1Å; I625-F723 HydrophobicContact CG2-CD1 4.16Å; I625-F723 HydrophobicContact CG2-CE1 4.14Å; V644-F723 HydrophobicContact CG1-CD2 3.73Å; V644-F723 HydrophobicContact CG1-CE2 3.72Å; V644-F723 HydrophobicContact CG2-CD2 4.37Å; V644-F723 HydrophobicContact CG2-CG 4.44Å; I652-F723 HydrophobicContact CG2-CB 4.45Å; S653-F723 VanDerWaalsContact O-CA 3.27Å; S653-F723 WeakPolarHBondContact O-CA 3.5Å; M654-F723 HydrophobicContact SD-CB 3.94Å
724	F	90.6	Very high	84.7	Confident	36 Å²	36	52.2 Å²	52.2	16%	0.158	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	138	175.2	54.9	-85.8	0	0	0	108.7	L621 N622 S653 K655 V745	L621-F724 CarbonylContact O-C 3.59Å; N622-F724 HydrophobicContact CB-CB 4.26Å; S653-F724 VanDerWaalsContact CB-CE2 3.5Å; S653-F724 PolarHBondContact N-O 2.78Å; S653-F724 PolarHBondContact O-N 3.36Å; K655-F724 HydrophobicContact CB-CE1 4.39Å; F724-V745 HydrophobicContact CD2-CG1 3.47Å; F724-V745 VanDerWaalsContact CD2-CG1 3.47Å; F724-V745 HydrophobicContact CD2-CG2 4.23Å; F724-V745 HydrophobicContact CE2-CB 4.28Å; F724-V745 HydrophobicContact CE2-CG1 3.68Å; F724-V745 HydrophobicContact CE2-CG2 3.54Å; F724-V745 HydrophobicContact CG-CG1 4.26Å; F724-V745 HydrophobicContact CZ-CG2 4.17Å
725	S	87.2	Confident	84.5	Confident	15 Å²	15	49.3 Å²	49.3	11%	0.105	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.4	174.5	71.9	0	0	0	0	109.3	L621 R651	L621-S725 VanDerWaalsContact CA-OG 3.25Å; L621-S725 WeakPolarHBondContact CA-OG 3.35Å; L621-S725 WeakPolarHBondContact CB-OG 3.39Å; L621-S725 VanDerWaalsContact CD2-OG 3.26Å; L621-S725 WeakPolarHBondContact CD2-OG 3.45Å; L621-S725 PolarHBondContact O-N 2.89Å; L621-S725 PolarHBondContact O-OG 3.06Å; L621-S725 VanDerWaalsContact O-OG 3.06Å; R651-S725 CarbonylContact O-C 3.46Å; R651-S725 WeakPolarHBondContact O-CA 3.31Å
726	D	80.5	Confident	84.1	Confident	19 Å²	19	50.1 Å²	50.1	10%	0.102	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	145.5	-177.6	-171.6	33.4	0	0	0	110	Y650 R651 N743 G746	Y650-D726 CarbonylContact C-O 3.58Å; Y650-D726 VanDerWaalsContact CA-O 3.25Å; Y650-D726 WeakPolarHBondContact CA-O 3.3Å; R651-D726 PolarHBondContact N-O 3.3Å; R651-D726 PolarHBondContact O-N 3.1Å; D726-N743 PolarHBondContact OD2-ND2 2.87Å; D726-G746 PolarHBondContact OD1-N 2.03Å
727	K	79.3	Confident	83.7	Confident	60 Å²	60	46.8 Å²	46.8	26%	0.261	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	125.4	175.3	174.1	166.6	155.2	-111.8	0	107.6	Q649 Y650 E729 N743	Q649-K727 HydrophobicContact CB-CD 4.18Å; Y650-K727 HydrophobicContact CD1-CB 3.9Å; Y650-K727 HydrophobicContact CE1-CB 3.74Å; Y650-K727 HydrophobicContact CE2-CB 4.37Å; Y650-K727 HydrophobicContact CE2-CD 4.4Å; Y650-K727 HydrophobicContact CG-CB 4.28Å; K727-E729 VanDerWaalsContact C-N 3.27Å; K727-E729 WeakPolarHBondContact CB-OE1 3.27Å; K727-E729 VanDerWaalsContact CD-OE1 3.23Å; K727-E729 WeakPolarHBondContact CD-OE1 3.4Å; K727-E729 WeakPolarHBondContact CE-OE1 3.47Å; K727-E729 HydrophobicContact CG-CG 4.49Å; K727-E729 VanDerWaalsContact CG-OE1 3.25Å; K727-E729 WeakPolarHBondContact CG-OE1 3.41Å; K727-E729 IonicContact NZ-OE1 3.45Å; K727-E729 PolarHBondContact NZ-OE1 2.91Å; K727-E729 PolarHBondContact O-N 2.89Å; K727-N743 PolarHBondContact O-ND2 3.37Å; K727-N743 PolarHBondContact O-OD1 3.26Å
728	D	72.8	Confident	83.4	Confident	38 Å²	38	46.6 Å²	46.6	20%	0.203	25%	0.249	C	C	.	.			trans	-78	80.3	175.6	-171.9	-17.1	0	0	0	108.7	R651 C730 S731 N743	R651-D728 IonicContact CZ-OD2 3.45Å; R651-D728 IonicContact NH1-OD2 3.18Å; R651-D728 PolarHBondContact NH1-OD2 3.27Å; D728-C730 PolarHBondContact O-N 2.99Å; D728-S731 WeakPolarHBondContact O-CB 3.01Å; D728-S731 PolarHBondContact O-N 3.03Å; D728-S731 PolarHBondContact O-OG 3.08Å; D728-S731 PolarHBondContact OD1-N 3.5Å; D728-N743 WeakPolarHBondContact CA-OD1 3.03Å
729	E	81.9	Confident	82.9	Confident	38 Å²	38	48.1 Å²	48.1	18%	0.178	26%	0.257	C	S	.	.	S	Bend	trans	-61.7	-33.7	178.2	-91.4	94.9	-145.6	0	0	112.1	K727 S731 K732 N743 Y748	K727-E729 VanDerWaalsContact C-N 3.27Å; K727-E729 WeakPolarHBondContact CB-OE1 3.27Å; K727-E729 VanDerWaalsContact CD-OE1 3.23Å; K727-E729 WeakPolarHBondContact CD-OE1 3.4Å; K727-E729 WeakPolarHBondContact CE-OE1 3.47Å; K727-E729 HydrophobicContact CG-CG 4.49Å; K727-E729 VanDerWaalsContact CG-OE1 3.25Å; K727-E729 WeakPolarHBondContact CG-OE1 3.41Å; K727-E729 IonicContact NZ-OE1 3.45Å; K727-E729 PolarHBondContact NZ-OE1 2.91Å; K727-E729 PolarHBondContact O-N 2.89Å; E729-S731 VanDerWaalsContact C-N 3.25Å; E729-S731 PolarHBondContact O-N 3.42Å; E729-K732 PolarHBondContact O-N 3.04Å; E729-N743 PolarHBondContact N-OD1 3.47Å; E729-Y748 HydrophobicContact CB-CD1 3.23Å; E729-Y748 HydrophobicContact CB-CE1 3.8Å; E729-Y748 HydrophobicContact CB-CG 3.86Å; E729-Y748 HydrophobicContact CG-CD1 3.55Å; E729-Y748 HydrophobicContact CG-CE1 3.78Å
730	C	80.6	Confident	82.3	Confident	22 Å²	22	52.7 Å²	52.7	15%	0.149	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.9	178.2	-61	0	0	0	0	112.9	D728 K732 C741 N743	D728-C730 PolarHBondContact O-N 2.99Å; C730-K732 PolarHBondContact O-N 3.02Å; C730-C741 WeakPolarHBondContact CA-SG 3.28Å; C730-C741 HydrophobicContact CB-CB 3.65Å; C730-C741 WeakPolarHBondContact CB-SG 3.36Å; C730-C741 WeakPolarHBondContact SG-CB 3.36Å; C730-C741 PolarHBondContact SG-O 2.88Å; C730-C741 VanDerWaalsContact SG-O 3.35Å; C730-C741 CovalentContact SG-SG 2.04Å; C730-C741 PolarHBondContact SG-SG 3.29Å; C730-N743 HydrophobicContact CB-CB 4.45Å; C730-N743 PolarHBondContact SG-N 2.91Å
731	S	74.8	Confident	81.9	Confident	89 Å²	89	50.3 Å²	50.3	62%	0.622	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.9	174.9	74.3	0	0	0	0	114.7	D728 E729	D728-S731 WeakPolarHBondContact O-CB 3.01Å; D728-S731 PolarHBondContact O-N 3.03Å; D728-S731 PolarHBondContact O-OG 3.08Å; D728-S731 PolarHBondContact OD1-N 3.5Å; E729-S731 VanDerWaalsContact C-N 3.25Å; E729-S731 PolarHBondContact O-N 3.42Å
732	K	69.6	Low	81.3	Confident	170 Å²	170	53.6 Å²	53.6	74%	0.739	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	114.7	179.1	-168.3	178.6	-178.1	-176.2	0	110.8	E729 C730 N734 G735	E729-K732 PolarHBondContact O-N 3.04Å; C730-K732 PolarHBondContact O-N 3.02Å; K732-N734 PolarHBondContact O-N 3.47Å; K732-G735 PolarHBondContact O-N 3.46Å
733	D	78.2	Confident	80.4	Confident	145 Å²	145	53.2 Å²	53.2	78%	0.775	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	55.6	32	176.5	-154.6	33.4	0	0	0	113.9	G735 G736	D733-G735 PolarHBondContact O-N 2.99Å; D733-G735 VanDerWaalsContact O-N 3.13Å; D733-G736 PolarHBondContact O-N 2.95Å
734	N	81	Confident	79.6	Confident	60 Å²	60	55.6 Å²	55.6	32%	0.321	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	53.7	31.8	-178.1	-163	45.5	0	0	0	113	K732 G736 C737 H739 C741	K732-N734 PolarHBondContact O-N 3.47Å; N734-G736 PolarHBondContact O-N 2.99Å; N734-C737 PolarHBondContact ND2-O 2.87Å; N734-C737 VanDerWaalsContact O-CB 3.25Å; N734-C737 WeakPolarHBondContact O-CB 3.34Å; N734-C737 PolarHBondContact O-N 2.83Å; N734-C737 PolarHBondContact O-SG 3.02Å; N734-C737 VanDerWaalsContact O-SG 3.36Å; N734-H739 PolarHBondContact ND2-O 2.03Å; N734-C741 VanDerWaalsContact O-CB 3.23Å; N734-C741 WeakPolarHBondContact O-CB 3.34Å; N734-C741 VanDerWaalsContact OD1-CB 3.3Å; N734-C741 WeakPolarHBondContact OD1-CB 3.36Å; N734-C741 PolarHBondContact OD1-N 2.92Å
735	G	75.8	Confident	78.6	Confident	12 Å²	12	58.7 Å²	58.7	12%	0.124	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	60	12.8	-172.8	0	0	0	0	0	114.7	K732 D733 C737 Y748 H763	K732-G735 PolarHBondContact O-N 3.46Å; D733-G735 PolarHBondContact O-N 2.99Å; D733-G735 VanDerWaalsContact O-N 3.13Å; G735-C737 VanDerWaalsContact C-N 3.28Å; G735-Y748 WeakPolarHBondContact O-CE2 3.26Å; G735-Y748 VanDerWaalsContact O-CZ 3.31Å; G735-Y748 PolarHBondContact O-OH 2.96Å; G735-Y748 VanDerWaalsContact O-OH 3.14Å; G735-H763 PolarHBondContact O-CE1 3.34Å
736	G	78	Confident	77.6	Confident	40 Å²	40	61.1 Å²	61.1	41%	0.412	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	70.1	20.3	-168.4	0	0	0	0	0	114	D733 N734 H763	D733-G736 PolarHBondContact O-N 2.95Å; N734-G736 PolarHBondContact O-N 2.99Å; G736-H763 PolarHBondContact O-ND1 3.24Å
737	C	83.9	Confident	77.3	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.068	37%	0.366	C	S	.	.			trans	-81.3	133.8	175.2	-58.6	0	0	0	0	111.2	N734 G735 H739 E740 C741 C750	N734-C737 PolarHBondContact ND2-O 2.87Å; N734-C737 VanDerWaalsContact O-CB 3.25Å; N734-C737 WeakPolarHBondContact O-CB 3.34Å; N734-C737 PolarHBondContact O-N 2.83Å; N734-C737 PolarHBondContact O-SG 3.02Å; N734-C737 VanDerWaalsContact O-SG 3.36Å; G735-C737 VanDerWaalsContact C-N 3.28Å; C737-H739 VanDerWaalsContact C-N 3.28Å; C737-H739 PolarHBondContact O-N 3.45Å; C737-E740 WeakPolarHBondContact CB-O 3.44Å; C737-C741 HydrophobicContact CB-CB 4.13Å; C737-C750 WeakPolarHBondContact CA-SG 3.44Å; C737-C750 HydrophobicContact CB-CB 3.56Å; C737-C750 WeakPolarHBondContact CB-SG 3.37Å; C737-C750 WeakPolarHBondContact SG-CA 3.41Å; C737-C750 WeakPolarHBondContact SG-CB 3.44Å; C737-C750 CovalentContact SG-SG 2.03Å; C737-C750 PolarHBondContact SG-SG 3.21Å
738	Q	80.4	Confident	77.5	Confident	94 Å²	94	63.5 Å²	63.5	44%	0.439	37%	0.366	S	S	.	.	S	Bend	trans	-62	-34.1	179	180	-175.1	-28	0	0	112.9	H763 D764	Q738-H763 WeakPolarHBondContact CB-O 3.45Å; Q738-H763 PolarHBondContact N-O 2.71Å; Q738-D764 VanDerWaalsContact OE1-CA 3.28Å
739	H	82.6	Confident	78	Confident	33 Å²	33	65 Å²	65	15%	0.153	38%	0.376	C	S	.	.	S	Bend	trans	-116.1	-79.5	-176.1	-79.2	162.8	0	0	0	112.4	N734 C737 Q751 R753 F756 C765	N734-H739 PolarHBondContact ND2-O 2.03Å; C737-H739 VanDerWaalsContact C-N 3.28Å; C737-H739 PolarHBondContact O-N 3.45Å; H739-Q751 VanDerWaalsContact CB-O 3.32Å; H739-Q751 WeakPolarHBondContact CB-O 3.47Å; H739-R753 HydrophobicContact CB-CG 4.17Å; H739-R753 PolarHBondContact ND1-N 2.63Å; H739-F756 AromaticContact CE1-CD2 3.86Å; H739-F756 AromaticContact CE1-CG 3.84Å; H739-C765 WeakPolarHBondContact ND1-CB 3.37Å; H739-C765 PolarHBondContact ND1-SG 2.84Å
740	E	80.4	Confident	78	Confident	95 Å²	95	63.6 Å²	63.6	44%	0.444	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	145.8	-174.1	-177.9	162.8	-159	0	0	109.9	C737 C750 Q751	C737-E740 WeakPolarHBondContact CB-O 3.44Å; E740-C750 CarbonylContact O-C 3.59Å; E740-C750 VanDerWaalsContact O-CA 3.31Å; E740-C750 WeakPolarHBondContact O-CA 3.37Å; E740-Q751 HydrophobicContact CB-CB 4.24Å; E740-Q751 PolarHBondContact N-O 2.88Å; E740-Q751 PolarHBondContact O-N 2.97Å
741	C	83.6	Confident	78	Confident	18 Å²	18	66.8 Å²	66.8	12%	0.122	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.4	178.4	-175.5	0	0	0	0	108.9	C730 N734 C737 Y748	C730-C741 WeakPolarHBondContact CA-SG 3.28Å; C730-C741 HydrophobicContact CB-CB 3.65Å; C730-C741 WeakPolarHBondContact CB-SG 3.36Å; C730-C741 WeakPolarHBondContact SG-CB 3.36Å; C730-C741 PolarHBondContact SG-O 2.88Å; C730-C741 VanDerWaalsContact SG-O 3.35Å; C730-C741 CovalentContact SG-SG 2.04Å; C730-C741 PolarHBondContact SG-SG 3.29Å; N734-C741 VanDerWaalsContact O-CB 3.23Å; N734-C741 WeakPolarHBondContact O-CB 3.34Å; N734-C741 VanDerWaalsContact OD1-CB 3.3Å; N734-C741 WeakPolarHBondContact OD1-CB 3.36Å; N734-C741 PolarHBondContact OD1-N 2.92Å; C737-C741 HydrophobicContact CB-CB 4.13Å; C741-Y748 VanDerWaalsContact SG-CD2 3.6Å
742	I	81.1	Confident	78.1	Confident	70 Å²	70	63.3 Å²	63.3	36%	0.359	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.7	172.9	-48.9	173.9	0	0	0	107.8	Y748 V749 Q751	I742-Y748 CarbonylContact O-C 3.57Å; I742-Y748 WeakPolarHBondContact O-CA 3.05Å; I742-Y748 WeakPolarHBondContact O-CB 3.15Å; I742-V749 HydrophobicContact CB-CG1 3.93Å; I742-V749 HydrophobicContact CD1-CG1 4.36Å; I742-V749 PolarHBondContact N-O 2.84Å; I742-V749 PolarHBondContact O-N 2.72Å; I742-Q751 HydrophobicContact CD1-CB 4.09Å; I742-Q751 HydrophobicContact CG1-CB 4.32Å
743	N	74.2	Confident	77.8	Confident	49 Å²	49	62.8 Å²	62.8	26%	0.262	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	134.1	173.8	-154.7	71.7	0	0	0	109.6	D726 K727 D728 E729 C730	D726-N743 PolarHBondContact OD2-ND2 2.87Å; K727-N743 PolarHBondContact O-ND2 3.37Å; K727-N743 PolarHBondContact O-OD1 3.26Å; D728-N743 WeakPolarHBondContact CA-OD1 3.03Å; E729-N743 PolarHBondContact N-OD1 3.47Å; C730-N743 HydrophobicContact CB-CB 4.45Å; C730-N743 PolarHBondContact SG-N 2.91Å
744	T	75.4	Confident	76.5	Confident	54 Å²	54	59.3 Å²	59.3	33%	0.331	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	161.2	-178.5	61	0	0	0	0	109.4	G746 S747 V749	T744-G746 PolarHBondContact O-N 3.1Å; T744-S747 CarbonylContact C-O 3.14Å; T744-S747 VanDerWaalsContact C-O 3.26Å; T744-S747 VanDerWaalsContact CA-O 3.31Å; T744-S747 WeakPolarHBondContact CA-O 3.01Å; T744-S747 PolarHBondContact N-O 2.99Å; T744-S747 PolarHBondContact O-N 3.2Å; T744-S747 VanDerWaalsContact O-N 3.15Å; T744-S747 PolarHBondContact OG1-O 3.08Å; T744-V749 HydrophobicContact CG2-CG1 4.06Å
745	V	69	Low	75.3	Confident	102 Å²	102	57.5 Å²	57.5	62%	0.618	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	106.8	-175.8	-176.2	0	0	0	0	111	F724	F724-V745 HydrophobicContact CD2-CG1 3.47Å; F724-V745 VanDerWaalsContact CD2-CG1 3.47Å; F724-V745 HydrophobicContact CD2-CG2 4.23Å; F724-V745 HydrophobicContact CE2-CB 4.28Å; F724-V745 HydrophobicContact CE2-CG1 3.68Å; F724-V745 HydrophobicContact CE2-CG2 3.54Å; F724-V745 HydrophobicContact CG-CG1 4.26Å; F724-V745 HydrophobicContact CZ-CG2 4.17Å
746	G	67.4	Low	74.9	Confident	66 Å²	66	60.2 Å²	60.2	68%	0.68	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.3	8	-179.6	0	0	0	0	0	115.8	D726 T744	D726-G746 PolarHBondContact OD1-N 2.03Å; T744-G746 PolarHBondContact O-N 3.1Å
747	S	74.2	Confident	74.4	Confident	60 Å²	60	61.1 Å²	61.1	42%	0.42	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	178.9	-179.8	-171.7	0	0	0	0	110.8	T744	T744-S747 CarbonylContact C-O 3.14Å; T744-S747 VanDerWaalsContact C-O 3.26Å; T744-S747 VanDerWaalsContact CA-O 3.31Å; T744-S747 WeakPolarHBondContact CA-O 3.01Å; T744-S747 PolarHBondContact N-O 2.99Å; T744-S747 PolarHBondContact O-N 3.2Å; T744-S747 VanDerWaalsContact O-N 3.15Å; T744-S747 PolarHBondContact OG1-O 3.08Å
748	Y	83.4	Confident	73.6	Confident	69 Å²	69	63.5 Å²	63.5	27%	0.271	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	167.5	162.3	61.3	-77	0	0	0	110.4	E729 G735 C741 I742 H763	E729-Y748 HydrophobicContact CB-CD1 3.23Å; E729-Y748 HydrophobicContact CB-CE1 3.8Å; E729-Y748 HydrophobicContact CB-CG 3.86Å; E729-Y748 HydrophobicContact CG-CD1 3.55Å; E729-Y748 HydrophobicContact CG-CE1 3.78Å; G735-Y748 WeakPolarHBondContact O-CE2 3.26Å; G735-Y748 VanDerWaalsContact O-CZ 3.31Å; G735-Y748 PolarHBondContact O-OH 2.96Å; G735-Y748 VanDerWaalsContact O-OH 3.14Å; C741-Y748 VanDerWaalsContact SG-CD2 3.6Å; I742-Y748 CarbonylContact O-C 3.57Å; I742-Y748 WeakPolarHBondContact O-CA 3.05Å; I742-Y748 WeakPolarHBondContact O-CB 3.15Å; Y748-H763 AromaticContact CE2-CE1 3.99Å; Y748-H763 PolarHBondContact OH-CE1 2.73Å
749	V	82.5	Confident	73.3	Confident	69 Å²	69	62.7 Å²	62.7	42%	0.418	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	136.3	171.9	63.3	0	0	0	0	109.9	I742 T744	I742-V749 HydrophobicContact CB-CG1 3.93Å; I742-V749 HydrophobicContact CD1-CG1 4.36Å; I742-V749 PolarHBondContact N-O 2.84Å; I742-V749 PolarHBondContact O-N 2.72Å; T744-V749 HydrophobicContact CG2-CG1 4.06Å
750	C	82.1	Confident	73	Confident	8 Å²	8	69.4 Å²	69.4	5%	0.054	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.7	174.6	-57.6	0	0	0	0	110.5	C737 E740 L758 K762	C737-C750 WeakPolarHBondContact CA-SG 3.44Å; C737-C750 HydrophobicContact CB-CB 3.56Å; C737-C750 WeakPolarHBondContact CB-SG 3.37Å; C737-C750 WeakPolarHBondContact SG-CA 3.41Å; C737-C750 WeakPolarHBondContact SG-CB 3.44Å; C737-C750 CovalentContact SG-SG 2.03Å; C737-C750 PolarHBondContact SG-SG 3.21Å; E740-C750 CarbonylContact O-C 3.59Å; E740-C750 VanDerWaalsContact O-CA 3.31Å; E740-C750 WeakPolarHBondContact O-CA 3.37Å; C750-L758 HydrophobicContact CB-CD1 3.8Å; C750-K762 VanDerWaalsContact CB-O 3.3Å; C750-K762 WeakPolarHBondContact CB-O 3.49Å; C750-K762 PolarHBondContact SG-O 2.81Å; C750-K762 VanDerWaalsContact SG-O 3.34Å
751	Q	80	Confident	72.8	Confident	89 Å²	89	68.2 Å²	68.2	42%	0.416	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.4	172.5	-178.7	171.3	9.4	0	0	109.9	H739 E740 I742	H739-Q751 VanDerWaalsContact CB-O 3.32Å; H739-Q751 WeakPolarHBondContact CB-O 3.47Å; E740-Q751 HydrophobicContact CB-CB 4.24Å; E740-Q751 PolarHBondContact N-O 2.88Å; E740-Q751 PolarHBondContact O-N 2.97Å; I742-Q751 HydrophobicContact CD1-CB 4.09Å; I742-Q751 HydrophobicContact CG1-CB 4.32Å
752	C	77.2	Confident	72.5	Confident	16 Å²	16	74.6 Å²	74.6	11%	0.108	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-98	140.9	175.7	-63.6	0	0	0	0	111	F756 V757 L758 C765	C752-F756 HydrophobicContact CB-CB 3.95Å; C752-F756 VanDerWaalsContact CB-O 3.32Å; C752-F756 WeakPolarHBondContact CB-O 3.46Å; C752-V757 VanDerWaalsContact SG-C 3.58Å; C752-L758 VanDerWaalsContact SG-CA 3.54Å; C752-C765 WeakPolarHBondContact CA-SG 3.4Å; C752-C765 HydrophobicContact CB-CB 3.85Å; C752-C765 WeakPolarHBondContact CB-SG 3.48Å; C752-C765 VanDerWaalsContact SG-CA 3.52Å; C752-C765 WeakPolarHBondContact SG-CB 3.49Å; C752-C765 CovalentContact SG-SG 2.03Å; C752-C765 PolarHBondContact SG-SG 2.81Å
753	R	64.2	Low	72.3	Confident	159 Å²	159	74.2 Å²	74.2	60%	0.6	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-61.6	152	169.3	-65.9	174.5	-172.5	173.6	5.2	110.6	H739 F756	H739-R753 HydrophobicContact CB-CG 4.17Å; H739-R753 PolarHBondContact ND1-N 2.63Å; R753-F756 PolarHBondContact O-N 3.22Å; R753-F756 VanDerWaalsContact O-N 3.08Å
754	N	50.6	Low	72.5	Confident	73 Å²	73	75.1 Å²	75.1	39%	0.39	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	137.8	-176.6	-63.3	-19.6	0	0	0	112.4	W786	N754-W786 WeakPolarHBondContact CB-O 3.34Å; N754-W786 PolarHBondContact ND2-O 2.71Å
755	G	56.2	Low	72.5	Confident	21 Å²	21	73.1 Å²	73.1	22%	0.216	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-7	-170.3	0	0	0	0	0	114.5	A768	G755-A768 WeakPolarHBondContact O-CB 3.46Å; G755-A768 PolarHBondContact O-N 3.44Å
756	F	66.3	Low	72.6	Confident	70 Å²	70	72.9 Å²	72.9	31%	0.307	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	145.6	175.5	-60	-100.6	0	0	0	111.8	H739 C752 R753 C765 K766 E767	H739-F756 AromaticContact CE1-CD2 3.86Å; H739-F756 AromaticContact CE1-CG 3.84Å; C752-F756 HydrophobicContact CB-CB 3.95Å; C752-F756 VanDerWaalsContact CB-O 3.32Å; C752-F756 WeakPolarHBondContact CB-O 3.46Å; R753-F756 PolarHBondContact O-N 3.22Å; R753-F756 VanDerWaalsContact O-N 3.08Å; F756-C765 HydrophobicContact CB-CB 3.95Å; F756-C765 HydrophobicContact CD1-CB 4.43Å; F756-C765 HydrophobicContact CG-CB 4.45Å; F756-K766 CarbonylContact C-O 3.58Å; F756-K766 WeakPolarHBondContact CA-O 3.29Å; F756-K766 WeakPolarHBondContact CB-O 3.45Å; F756-E767 HydrophobicContact CD1-CG 4.2Å; F756-E767 HydrophobicContact CE1-CG 3.77Å; F756-E767 HydrophobicContact CZ-CG 4.39Å
757	V	66.7	Low	72.3	Confident	59 Å²	59	76.5 Å²	76.5	36%	0.358	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	154.1	171.1	-62.5	0	0	0	0	110.4	C752 H759 C765 K766 A768	C752-V757 VanDerWaalsContact SG-C 3.58Å; V757-H759 PolarHBondContact O-N 2.7Å; V757-C765 WeakPolarHBondContact O-CA 3.09Å; V757-K766 HydrophobicContact CG2-CD 4.1Å; V757-K766 VanDerWaalsContact CG2-CE 3.41Å; V757-K766 HydrophobicContact CG2-CG 3.57Å; V757-K766 PolarHBondContact N-O 3.41Å; V757-K766 WeakPolarHBondContact O-CG 3.48Å; V757-K766 PolarHBondContact O-N 2.81Å; V757-A768 HydrophobicContact CG1-CB 3.95Å
758	L	68.8	Low	71.4	Confident	59 Å²	59	75.1 Å²	75.1	31%	0.309	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	131.8	-178	-161.7	69.2	0	0	0	110.8	C750 C752 K762 D764	C750-L758 HydrophobicContact CB-CD1 3.8Å; C752-L758 VanDerWaalsContact SG-CA 3.54Å; L758-K762 HydrophobicContact CD2-CB 4.16Å; L758-D764 WeakPolarHBondContact CD1-O 3.3Å
759	H	72.8	Confident	70.3	Confident	77 Å²	77	79.5 Å²	79.5	36%	0.356	39%	0.391	S	S	.	.			trans	-72.7	162.1	177	-176	-110.5	0	0	0	110.8	V757 N761 K762 D764	V757-H759 PolarHBondContact O-N 2.7Å; H759-N761 PolarHBondContact ND1-ND2 3.3Å; H759-N761 PolarHBondContact ND1-OD1 2.95Å; H759-N761 VanDerWaalsContact ND1-OD1 3.13Å; H759-N761 PolarHBondContact O-N 3.26Å; H759-N761 VanDerWaalsContact O-N 3.1Å; H759-K762 PolarHBondContact O-N 3.14Å; H759-D764 HydrophobicContact CB-CB 3.87Å; H759-D764 WeakPolarHBondContact CB-O 3.37Å; H759-D764 PolarHBondContact N-O 3.26Å
760	E	76.1	Confident	69.7	Low	175 Å²	175	77.9 Å²	77.9	82%	0.818	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.5	-174.2	-64.7	-172.8	168.6	0	0	113.7	K762	E760-K762 PolarHBondContact O-N 3.4Å
761	N	76	Confident	69.6	Low	70 Å²	70	85.1 Å²	85.1	37%	0.374	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-2.3	173.9	68.1	2.6	0	0	0	114.2	H759 H763 D764	H759-N761 PolarHBondContact ND1-ND2 3.3Å; H759-N761 PolarHBondContact ND1-OD1 2.95Å; H759-N761 VanDerWaalsContact ND1-OD1 3.13Å; H759-N761 PolarHBondContact O-N 3.26Å; H759-N761 VanDerWaalsContact O-N 3.1Å; N761-H763 PolarHBondContact O-CD2 3.06Å; N761-H763 PolarHBondContact O-N 3.3Å; N761-H763 VanDerWaalsContact O-N 3.15Å; N761-H763 PolarHBondContact OD1-N 3.43Å; N761-D764 PolarHBondContact ND2-OD2 2.99Å; N761-D764 PolarHBondContact OD1-N 3.29Å
762	K	77.9	Confident	69.7	Low	151 Å²	151	84.8 Å²	84.8	66%	0.657	41%	0.414	S	S	*	.	S	Bend	trans	62.2	10.6	179.5	-54	-176.7	-179.9	-177.9	0	116.2	C750 L758 H759 E760	C750-K762 VanDerWaalsContact CB-O 3.3Å; C750-K762 WeakPolarHBondContact CB-O 3.49Å; C750-K762 PolarHBondContact SG-O 2.81Å; C750-K762 VanDerWaalsContact SG-O 3.34Å; L758-K762 HydrophobicContact CD2-CB 4.16Å; H759-K762 PolarHBondContact O-N 3.14Å; E760-K762 PolarHBondContact O-N 3.4Å
763	H	77.6	Confident	70.1	Confident	63 Å²	63	90.6 Å²	90.6	29%	0.292	44%	0.437	S	S	.	.	S	Bend	trans	-119.7	-39.9	-179.9	-79.9	-86.2	0	0	0	112.6	G735 G736 Q738 Y748 N761	G735-H763 PolarHBondContact O-CE1 3.34Å; G736-H763 PolarHBondContact O-ND1 3.24Å; Q738-H763 WeakPolarHBondContact CB-O 3.45Å; Q738-H763 PolarHBondContact N-O 2.71Å; Y748-H763 AromaticContact CE2-CE1 3.99Å; Y748-H763 PolarHBondContact OH-CE1 2.73Å; N761-H763 PolarHBondContact O-CD2 3.06Å; N761-H763 PolarHBondContact O-N 3.3Å; N761-H763 VanDerWaalsContact O-N 3.15Å; N761-H763 PolarHBondContact OD1-N 3.43Å
764	D	78.4	Confident	71.1	Confident	68 Å²	68	84 Å²	84	36%	0.364	41%	0.413	S	S	.	.	S	Bend	trans	-91.3	166.4	-178.1	-61.6	-27.4	0	0	0	112.1	Q738 L758 H759 N761	Q738-D764 VanDerWaalsContact OE1-CA 3.28Å; L758-D764 WeakPolarHBondContact CD1-O 3.3Å; H759-D764 HydrophobicContact CB-CB 3.87Å; H759-D764 WeakPolarHBondContact CB-O 3.37Å; H759-D764 PolarHBondContact N-O 3.26Å; N761-D764 PolarHBondContact ND2-OD2 2.99Å; N761-D764 PolarHBondContact OD1-N 3.29Å
765	C	74.8	Confident	72.7	Confident	12 Å²	12	86.7 Å²	86.7	8%	0.081	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	117.6	-176.5	-69.2	0	0	0	0	110.6	H739 C752 F756 V757	H739-C765 WeakPolarHBondContact ND1-CB 3.37Å; H739-C765 PolarHBondContact ND1-SG 2.84Å; C752-C765 WeakPolarHBondContact CA-SG 3.4Å; C752-C765 HydrophobicContact CB-CB 3.85Å; C752-C765 WeakPolarHBondContact CB-SG 3.48Å; C752-C765 VanDerWaalsContact SG-CA 3.52Å; C752-C765 WeakPolarHBondContact SG-CB 3.49Å; C752-C765 CovalentContact SG-SG 2.03Å; C752-C765 PolarHBondContact SG-SG 2.81Å; F756-C765 HydrophobicContact CB-CB 3.95Å; F756-C765 HydrophobicContact CD1-CB 4.43Å; F756-C765 HydrophobicContact CG-CB 4.45Å; V757-C765 WeakPolarHBondContact O-CA 3.09Å
766	K	71.3	Confident	74	Confident	96 Å²	96	88.1 Å²	88.1	42%	0.417	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	150.7	175.7	64.2	174.9	-177.4	173.4	0	110.5	F756 V757 A768	F756-K766 CarbonylContact C-O 3.58Å; F756-K766 WeakPolarHBondContact CA-O 3.29Å; F756-K766 WeakPolarHBondContact CB-O 3.45Å; V757-K766 HydrophobicContact CG2-CD 4.1Å; V757-K766 VanDerWaalsContact CG2-CE 3.41Å; V757-K766 HydrophobicContact CG2-CG 3.57Å; V757-K766 PolarHBondContact N-O 3.41Å; V757-K766 WeakPolarHBondContact O-CG 3.48Å; V757-K766 PolarHBondContact O-N 2.81Å; K766-A768 PolarHBondContact O-N 3.26Å
767	E	60.3	Low	74.7	Confident	142 Å²	142	86.1 Å²	86.1	66%	0.664	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.8	140.2	175.4	-71.1	-173	179.5	0	0	110.9	F756	F756-E767 HydrophobicContact CD1-CG 4.2Å; F756-E767 HydrophobicContact CE1-CG 3.77Å; F756-E767 HydrophobicContact CZ-CG 4.39Å
768	A	56.2	Low	75.6	Confident	31 Å²	31	88.1 Å²	88.1	26%	0.256	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-74.2	129.2	-179.7	0	0	0	0	0	111	G755 V757 K766	G755-A768 WeakPolarHBondContact O-CB 3.46Å; G755-A768 PolarHBondContact O-N 3.44Å; V757-A768 HydrophobicContact CG1-CB 3.95Å; K766-A768 PolarHBondContact O-N 3.26Å
769	E	60	Low	76.5	Confident	162 Å²	162	86.2 Å²	86.2	76%	0.757	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-65	134.6	167	-67.7	175	170.9	0	0	108.9	E771	E769-E771 PolarHBondContact O-N 3.44Å
770	C	71.1	Confident	77.2	Confident	34 Å²	34	89 Å²	89	23%	0.23	44%	0.439	C	S	.	.	S	Bend	trans	-84.3	14.3	-167.6	-114.9	0	0	0	0	114.7	C796 T797	C770-C796 HydrophobicContact CB-CB 3.64Å; C770-C796 WeakPolarHBondContact CB-SG 3.42Å; C770-C796 CarbonylContact O-C 3.58Å; C770-C796 WeakPolarHBondContact O-CA 3.4Å; C770-C796 WeakPolarHBondContact SG-CB 3.13Å; C770-C796 CovalentContact SG-SG 2.04Å; C770-C796 PolarHBondContact SG-SG 2.01Å; C770-T797 PolarHBondContact O-N 3.3Å
771	E	79.6	Confident	77.9	Confident	161 Å²	161	80.8 Å²	80.8	75%	0.752	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	122.4	174.5	-60.6	-176.1	-176.4	0	0	108.6	E769	E769-E771 PolarHBondContact O-N 3.44Å
772	Q	81.9	Confident	78.6	Confident	81 Å²	81	79.3 Å²	79.3	38%	0.379	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	133.1	-177.8	-65.5	-170.7	-15.3	0	0	112.1	T797 W798 E799	Q772-T797 PolarHBondContact N-O 3.34Å; Q772-W798 HydrophobicContact CB-CG 4.5Å; Q772-W798 CarbonylContact O-C 3.38Å; Q772-W798 WeakPolarHBondContact O-CA 3.39Å; Q772-W798 VanDerWaalsContact OE1-NE1 3.16Å; Q772-E799 PolarHBondContact O-N 3.46Å
773	K	85.6	Confident	79.1	Confident	138 Å²	138	72.1 Å²	72.1	60%	0.6	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.4	171.6	-67.4	177.9	178.7	-82.9	0	109	E799	K773-E799 HydrophobicContact CG-CB 4.3Å; K773-E799 IonicContact NZ-OE1 3.09Å; K773-E799 PolarHBondContact NZ-OE1 3.34Å; K773-E799 IonicContact NZ-OE2 2.82Å; K773-E799 PolarHBondContact NZ-OE2 2.92Å
774	I	86	Confident	79.4	Confident	20 Å²	20	70 Å²	70	10%	0.103	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	113.6	-172.7	-63	177.9	0	0	0	108.6	I781 W798 E799 I800 S801 H879	I774-I781 HydrophobicContact CD1-CD1 3.93Å; I774-I781 HydrophobicContact CD1-CG1 3.91Å; I774-W798 HydrophobicContact CD1-CB 4.39Å; I774-E799 PolarHBondContact N-O 3.31Å; I774-I800 HydrophobicContact CB-CG1 4.39Å; I774-I800 HydrophobicContact CB-CG2 4.43Å; I774-I800 HydrophobicContact CD1-CG1 4.4Å; I774-I800 HydrophobicContact CG2-CG2 4.18Å; I774-I800 WeakPolarHBondContact O-CA 3.43Å; I774-S801 PolarHBondContact O-N 3.18Å; I774-H879 WeakPolarHBondContact CG2-CE1 3.25Å; I774-H879 VanDerWaalsContact CG2-NE2 3.33Å; I774-H879 WeakPolarHBondContact CG2-NE2 3.47Å
775	H	84.1	Confident	79.6	Confident	130 Å²	130	69.6 Å²	69.6	60%	0.602	35%	0.353	S	S	*	.			trans	-110.1	1.6	175.8	-61.2	-64.8	0	0	0	113
776	S	82.9	Confident	79.9	Confident	52 Å²	52	70.5 Å²	70.5	36%	0.364	36%	0.355	S	S	.	.	S	Bend	trans	-77.7	142.2	178.9	65.6	0	0	0	0	111.3	N778 H879	S776-N778 WeakPolarHBondContact CB-O 3.08Å; S776-N778 PolarHBondContact O-N 2.8Å; S776-N778 PolarHBondContact OG-O 2.92Å; S776-H879 PolarHBondContact O-NE2 3.21Å; S776-H879 PolarHBondContact OG-CE1 2.8Å; S776-H879 PolarHBondContact OG-NE2 3.12Å
777	P	80.4	Confident	80.3	Confident	27 Å²	27	69.3 Å²	69.3	18%	0.175	36%	0.356	C	S	.	.	S	Bend	trans	-68.6	-20.7	-178.7	30.1	-37.6	0	0	0	112.9	S880 T881 A900 Q901	P777-S880 CarbonylContact O-C 3.48Å; P777-S880 WeakPolarHBondContact O-CA 3.41Å; P777-T881 HydrophobicContact CB-CG2 4.17Å; P777-T881 WeakPolarHBondContact O-CG2 3.45Å; P777-T881 PolarHBondContact O-N 3.46Å; P777-T881 PolarHBondContact O-OG1 3.03Å; P777-A900 HydrophobicContact CB-CB 3.77Å; P777-Q901 HydrophobicContact CB-CG 4.36Å; P777-Q901 HydrophobicContact CG-CG 3.8Å
778	N	86.6	Confident	81.3	Confident	101 Å²	101	68.4 Å²	68.4	54%	0.54	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	169.8	170.8	57.9	31.8	0	0	0	110.6	S776 H879	S776-N778 WeakPolarHBondContact CB-O 3.08Å; S776-N778 PolarHBondContact O-N 2.8Å; S776-N778 PolarHBondContact OG-O 2.92Å; N778-H879 VanDerWaalsContact C-NE2 3.3Å; N778-H879 CarbonylContact C-O 3.55Å; N778-H879 WeakPolarHBondContact CA-O 3.21Å; N778-H879 PolarHBondContact O-CE1 2.68Å; N778-H879 PolarHBondContact O-NE2 2.83Å
779	G	87.3	Confident	82.6	Confident	20 Å²	20	73.1 Å²	73.1	21%	0.206	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-169.8	175.9	0	0	0	0	0	112.7	T878 H879	G779-T878 CarbonylContact O-C 3.36Å; G779-T878 WeakPolarHBondContact O-CA 3.13Å; G779-T878 WeakPolarHBondContact O-CG2 3.45Å; G779-H879 VanDerWaalsContact CA-CE1 3.42Å; G779-H879 WeakPolarHBondContact CA-CE1 3.1Å; G779-H879 PolarHBondContact N-CE1 2.71Å; G779-H879 VanDerWaalsContact N-CE1 3.31Å; G779-H879 PolarHBondContact N-O 3.45Å; G779-H879 PolarHBondContact O-N 2.82Å; G779-H879 PolarHBondContact O-ND1 2.68Å
780	F	88.1	Confident	83.9	Confident	136 Å²	136	65.5 Å²	65.5	60%	0.596	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.4	178.3	-62.3	-79.3	0	0	0	111	Q876 A877 T878	F780-Q876 HydrophobicContact CD1-CG 4.35Å; F780-A877 CarbonylContact C-O 3.56Å; F780-A877 WeakPolarHBondContact CA-O 3.28Å; F780-T878 HydrophobicContact CE1-CG2 4.32Å; F780-T878 VanDerWaalsContact CE1-OG1 3.26Å; F780-T878 WeakPolarHBondContact CE1-OG1 3.48Å
781	I	89.9	Confident	84.6	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.01	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	126.8	172.8	-55.5	-179	0	0	0	106.6	I774 W798 I800 L810 L862 F875 Q876 A877 H879	I774-I781 HydrophobicContact CD1-CD1 3.93Å; I774-I781 HydrophobicContact CD1-CG1 3.91Å; I781-W798 HydrophobicContact CG2-CD2 3.81Å; I781-W798 HydrophobicContact CG2-CE3 4.48Å; I781-W798 HydrophobicContact CG2-CG 3.92Å; I781-W798 HydrophobicContact CG2-CZ2 4.22Å; I781-I800 HydrophobicContact CD1-CD1 3.5Å; I781-I800 VanDerWaalsContact CD1-CD1 3.5Å; I781-I800 HydrophobicContact CD1-CG1 4.14Å; I781-L810 HydrophobicContact CD1-CD1 4.07Å; I781-L862 HydrophobicContact CD1-CD2 4.08Å; I781-L862 HydrophobicContact CG2-CD2 4.43Å; I781-F875 HydrophobicContact CG2-CE2 4.09Å; I781-Q876 WeakPolarHBondContact O-CA 3.4Å; I781-A877 PolarHBondContact N-O 3.5Å; I781-A877 PolarHBondContact O-N 2.81Å; I781-H879 HydrophobicContact CD1-CB 4.12Å
782	T	90.2	Very high	84.9	Confident	38 Å²	38	60.5 Å²	60.5	23%	0.233	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.7	-179.3	47.3	0	0	0	0	110.4	W786 W798 F875 Q876	T782-W786 HydrophobicContact CG2-CB 4.48Å; T782-W786 HydrophobicContact CG2-CD2 4.14Å; T782-W786 HydrophobicContact CG2-CE3 3.74Å; T782-W786 HydrophobicContact CG2-CG 4.44Å; T782-W786 HydrophobicContact CG2-CZ3 4.44Å; T782-W798 WeakPolarHBondContact O-CZ2 3.37Å; T782-F875 WeakPolarHBondContact CA-O 3.26Å; T782-Q876 HydrophobicContact CG2-CB 4.11Å; T782-Q876 HydrophobicContact CG2-CG 3.95Å
783	S	89.6	Confident	85.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.334	C	S	.	.			trans	-62.7	151.3	164.7	53.2	0	0	0	0	110.3	N785 W786 K873 G874 F875	S783-N785 PolarHBondContact O-N 2.86Å; S783-W786 VanDerWaalsContact O-CB 3.29Å; S783-W786 WeakPolarHBondContact O-CB 3.42Å; S783-W786 PolarHBondContact O-N 3.19Å; S783-W786 VanDerWaalsContact O-N 3.1Å; S783-K873 PolarHBondContact OG-O 3.38Å; S783-G874 VanDerWaalsContact OG-CA 3.29Å; S783-G874 WeakPolarHBondContact OG-CA 3.31Å; S783-F875 PolarHBondContact N-O 3.42Å; S783-F875 PolarHBondContact OG-N 2.84Å; S783-F875 PolarHBondContact OG-O 2.82Å
784	P	84.1	Confident	85.1	Confident	20 Å²	20	63.2 Å²	63.2	13%	0.13	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.5	141.3	177.3	-22.8	32.5	0	0	0	111.4	W786 Y790 P791 C796	P784-W786 PolarHBondContact O-N 2.76Å; P784-Y790 VanDerWaalsContact O-CA 3.3Å; P784-Y790 WeakPolarHBondContact O-CA 3.39Å; P784-Y790 WeakPolarHBondContact O-CB 3.25Å; P784-P791 HydrophobicContact CB-CG 4.37Å; P784-C796 HydrophobicContact CG-CB 4.5Å; P784-C796 WeakPolarHBondContact CG-SG 3.38Å
785	N	82.1	Confident	85.3	Confident	59 Å²	59	67 Å²	67	32%	0.316	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	-3.9	-175.5	-52.6	-12.8	0	0	0	117.3	S783 D788 K789	S783-N785 PolarHBondContact O-N 2.86Å; N785-D788 CarbonylContact C-O 3.33Å; N785-D788 HydrophobicContact CB-CB 4.39Å; N785-D788 CarbonylContact O-C 3.56Å; N785-D788 WeakPolarHBondContact O-CA 3.5Å; N785-D788 VanDerWaalsContact O-CB 3.32Å; N785-D788 WeakPolarHBondContact O-CB 3.24Å; N785-D788 PolarHBondContact O-N 3.44Å; N785-K789 WeakPolarHBondContact CB-O 3.47Å; N785-K789 PolarHBondContact ND2-O 2.93Å
786	W	80.1	Confident	85.5	Confident	31 Å²	31	60.8 Å²	60.8	12%	0.117	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	134.4	-179.5	-178.3	91.8	0	0	0	111.2	N754 T782 S783 P784 E814 Q876	N754-W786 WeakPolarHBondContact CB-O 3.34Å; N754-W786 PolarHBondContact ND2-O 2.71Å; T782-W786 HydrophobicContact CG2-CB 4.48Å; T782-W786 HydrophobicContact CG2-CD2 4.14Å; T782-W786 HydrophobicContact CG2-CE3 3.74Å; T782-W786 HydrophobicContact CG2-CG 4.44Å; T782-W786 HydrophobicContact CG2-CZ3 4.44Å; S783-W786 VanDerWaalsContact O-CB 3.29Å; S783-W786 WeakPolarHBondContact O-CB 3.42Å; S783-W786 PolarHBondContact O-N 3.19Å; S783-W786 VanDerWaalsContact O-N 3.1Å; P784-W786 PolarHBondContact O-N 2.76Å; W786-E814 HydrophobicContact CZ2-CG 4.32Å; W786-E814 PolarHBondContact NE1-OE2 3.32Å; W786-Q876 HydrophobicContact CD2-CB 4.05Å; W786-Q876 HydrophobicContact CE3-CB 4.41Å; W786-Q876 HydrophobicContact CH2-CB 4.13Å; W786-Q876 VanDerWaalsContact CH2-CD 3.45Å; W786-Q876 HydrophobicContact CH2-CG 4.32Å; W786-Q876 HydrophobicContact CZ2-CB 3.72Å; W786-Q876 HydrophobicContact CZ2-CG 4.39Å; W786-Q876 HydrophobicContact CZ3-CB 4.45Å; W786-Q876 HydrophobicContact CZ3-CG 4.5Å
787	P	80.9	Confident	85.9	Confident	70 Å²	70	59.6 Å²	59.6	46%	0.455	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	cis	-86.6	-1	11	36.2	-38.2	0	0	0	115.3
788	D	81.3	Confident	86.5	Confident	123 Å²	123	58.8 Å²	58.8	66%	0.658	30%	0.295	S	S	*	.	S	Bend	trans	-71.8	171.5	169.2	-73	-48.8	0	0	0	110.9	N785 Y790	N785-D788 CarbonylContact C-O 3.33Å; N785-D788 HydrophobicContact CB-CB 4.39Å; N785-D788 CarbonylContact O-C 3.56Å; N785-D788 WeakPolarHBondContact O-CA 3.5Å; N785-D788 VanDerWaalsContact O-CB 3.32Å; N785-D788 WeakPolarHBondContact O-CB 3.24Å; N785-D788 PolarHBondContact O-N 3.44Å; D788-Y790 PolarHBondContact O-N 2.89Å
789	K	83.3	Confident	86.8	Confident	131 Å²	131	55.6 Å²	55.6	57%	0.57	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-67.6	133.7	-175.4	-66.4	-179	169.5	-145.5	0	112.2	N785 Q871 R872	N785-K789 WeakPolarHBondContact CB-O 3.47Å; N785-K789 PolarHBondContact ND2-O 2.93Å; K789-Q871 HydrophobicContact CB-CB 4.12Å; K789-Q871 HydrophobicContact CD-CB 4.45Å; K789-Q871 WeakPolarHBondContact CD-O 3.48Å; K789-Q871 WeakPolarHBondContact CE-O 3.24Å; K789-Q871 PolarHBondContact NZ-O 2.95Å; K789-R872 WeakPolarHBondContact CA-O 3.25Å
790	Y	86.9	Confident	87	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.008	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-62	154.3	172.6	52.9	-102	0	0	0	111.4	P784 D788 E818 D826 F864 Q871 R872 G874	P784-Y790 VanDerWaalsContact O-CA 3.3Å; P784-Y790 WeakPolarHBondContact O-CA 3.39Å; P784-Y790 WeakPolarHBondContact O-CB 3.25Å; D788-Y790 PolarHBondContact O-N 2.89Å; Y790-E818 PolarHBondContact OH-N 3.29Å; Y790-D826 HydrophobicContact CE2-CB 4.4Å; Y790-D826 WeakPolarHBondContact CE2-OD2 3.24Å; Y790-D826 PolarHBondContact OH-OD2 2.83Å; Y790-F864 AromaticContact CD1-CZ 3.92Å; Y790-F864 HydrophobicContact CD1-CZ 3.92Å; Y790-F864 HydrophobicContact CD2-CE1 4.21Å; Y790-F864 AromaticContact CD2-CZ 3.77Å; Y790-F864 HydrophobicContact CD2-CZ 3.77Å; Y790-F864 HydrophobicContact CE1-CZ 4.14Å; Y790-F864 HydrophobicContact CE2-CZ 4.02Å; Y790-F864 HydrophobicContact CG-CE1 4.06Å; Y790-F864 AromaticContact CG-CZ 3.74Å; Y790-F864 HydrophobicContact CG-CZ 3.74Å; Y790-Q871 HydrophobicContact CD2-CB 4.13Å; Y790-Q871 HydrophobicContact CD2-CG 4.08Å; Y790-Q871 HydrophobicContact CE2-CB 4.01Å; Y790-Q871 HydrophobicContact CE2-CG 4.08Å; Y790-Q871 VanDerWaalsContact O-CB 3.24Å; Y790-Q871 WeakPolarHBondContact O-CB 2.99Å; Y790-Q871 WeakPolarHBondContact O-CG 3.42Å; Y790-R872 WeakPolarHBondContact CD1-O 3.38Å; Y790-R872 HydrophobicContact CE1-CB 3.86Å; Y790-R872 WeakPolarHBondContact CE1-O 3.19Å; Y790-R872 VanDerWaalsContact CZ-N 3.33Å; Y790-R872 PolarHBondContact N-O 3.26Å; Y790-R872 VanDerWaalsContact N-O 3.15Å; Y790-R872 PolarHBondContact OH-N 3.44Å; Y790-G874 VanDerWaalsContact CD1-CA 3.4Å
791	P	85.2	Confident	87.1	Confident	34 Å²	34	49.1 Å²	49.1	22%	0.221	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-75.1	153.8	179.2	-8.1	23.4	0	0	0	112.3	P784 K794 S866	P784-P791 HydrophobicContact CB-CG 4.37Å; P791-K794 HydrophobicContact CB-CG 3.69Å; P791-K794 HydrophobicContact CG-CG 3.86Å; P791-S866 PolarHBondContact O-OG 2.86Å
792	S	86.1	Confident	86.9	Confident	55 Å²	55	49.5 Å²	49.5	39%	0.385	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	149.6	167.7	63.2	0	0	0	0	112	K794 D867 Q871	S792-K794 VanDerWaalsContact C-N 3.3Å; S792-K794 PolarHBondContact O-N 2.75Å; S792-D867 CarbonylContact C-O 3.59Å; S792-D867 VanDerWaalsContact CA-O 3.3Å; S792-D867 WeakPolarHBondContact CA-O 3.23Å; S792-D867 WeakPolarHBondContact CB-O 3.24Å; S792-Q871 VanDerWaalsContact CB-NE2 3.31Å
793	R	85.8	Confident	86.7	Confident	195 Å²	195	49.6 Å²	49.6	74%	0.736	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.8	41.4	173.4	-53.9	-177.6	-177.8	171.8	0.6	113.3	S866 D867 A868	R793-S866 VanDerWaalsContact CA-O 3.23Å; R793-S866 WeakPolarHBondContact CA-O 3.49Å; R793-S866 PolarHBondContact N-O 2.63Å; R793-S866 PolarHBondContact N-OG 3.42Å; R793-D867 PolarHBondContact N-O 3.03Å; R793-A868 HydrophobicContact CG-CB 4.47Å
794	K	85.3	Confident	86.4	Confident	81 Å²	81	52.3 Å²	52.3	35%	0.352	27%	0.267	S	S	.	.			trans	-105.4	143.8	174.4	-76	-70.7	-174.9	169.8	0	110.4	P791 S792 I865 S866	P791-K794 HydrophobicContact CB-CG 3.69Å; P791-K794 HydrophobicContact CG-CG 3.86Å; S792-K794 VanDerWaalsContact C-N 3.3Å; S792-K794 PolarHBondContact O-N 2.75Å; K794-I865 CarbonylContact O-C 3.59Å; K794-I865 WeakPolarHBondContact O-CA 2.87Å; K794-S866 PolarHBondContact N-OG 3.41Å; K794-S866 PolarHBondContact O-N 3.33Å
795	E	90.2	Very high	86.1	Confident	99 Å²	99	51.8 Å²	51.8	46%	0.463	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.2	169.7	178	166.5	-158.6	0	0	106.4	R863 F864	E795-R863 IonicContact OE1-CZ 3.12Å; E795-R863 IonicContact OE1-NE 2.96Å; E795-R863 PolarHBondContact OE1-NE 2.71Å; E795-R863 IonicContact OE1-NH2 2.67Å; E795-R863 PolarHBondContact OE1-NH2 3.39Å; E795-F864 WeakPolarHBondContact CA-O 3.24Å
796	C	89.6	Confident	86.3	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.007	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	137.4	-175.6	-53.4	0	0	0	0	109.6	C770 P784 W798 R863 F864	C770-C796 HydrophobicContact CB-CB 3.64Å; C770-C796 WeakPolarHBondContact CB-SG 3.42Å; C770-C796 CarbonylContact O-C 3.58Å; C770-C796 WeakPolarHBondContact O-CA 3.4Å; C770-C796 WeakPolarHBondContact SG-CB 3.13Å; C770-C796 CovalentContact SG-SG 2.04Å; C770-C796 PolarHBondContact SG-SG 2.01Å; P784-C796 HydrophobicContact CG-CB 4.5Å; P784-C796 WeakPolarHBondContact CG-SG 3.38Å; C796-W798 HydrophobicContact CB-CH2 3.67Å; C796-W798 HydrophobicContact CB-CZ2 4.15Å; C796-W798 HydrophobicContact CB-CZ3 4.09Å; C796-W798 WeakPolarHBondContact O-CZ3 3.14Å; C796-R863 WeakPolarHBondContact O-CA 3.42Å; C796-F864 PolarHBondContact N-O 3.3Å; C796-F864 PolarHBondContact O-N 3.02Å
797	T	91.4	Very high	86.7	Confident	27 Å²	27	50.6 Å²	50.6	17%	0.166	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.4	-172.4	62	0	0	0	0	111.9	C770 Q772 F861 L862 R863	C770-T797 PolarHBondContact O-N 3.3Å; Q772-T797 PolarHBondContact N-O 3.34Å; T797-F861 HydrophobicContact CG2-CE2 4.37Å; T797-F861 HydrophobicContact CG2-CZ 3.77Å; T797-L862 VanDerWaalsContact CA-O 3.25Å; T797-L862 WeakPolarHBondContact CA-O 3.22Å; T797-R863 HydrophobicContact CG2-CG 4.24Å
798	W	92.6	Very high	87.3	Confident	9 Å²	9	47.3 Å²	47.3	3%	0.034	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.1	175.9	-56.7	-97.6	0	0	0	109.9	Q772 I774 I781 T782 C796 F861 L862 F864 F875	Q772-W798 HydrophobicContact CB-CG 4.5Å; Q772-W798 CarbonylContact O-C 3.38Å; Q772-W798 WeakPolarHBondContact O-CA 3.39Å; Q772-W798 VanDerWaalsContact OE1-NE1 3.16Å; I774-W798 HydrophobicContact CD1-CB 4.39Å; I781-W798 HydrophobicContact CG2-CD2 3.81Å; I781-W798 HydrophobicContact CG2-CE3 4.48Å; I781-W798 HydrophobicContact CG2-CG 3.92Å; I781-W798 HydrophobicContact CG2-CZ2 4.22Å; T782-W798 WeakPolarHBondContact O-CZ2 3.37Å; C796-W798 HydrophobicContact CB-CH2 3.67Å; C796-W798 HydrophobicContact CB-CZ2 4.15Å; C796-W798 HydrophobicContact CB-CZ3 4.09Å; C796-W798 WeakPolarHBondContact O-CZ3 3.14Å; W798-F861 CarbonylContact O-C 3.6Å; W798-F861 WeakPolarHBondContact O-CA 3.49Å; W798-L862 HydrophobicContact CB-CB 4.22Å; W798-L862 HydrophobicContact CE3-CB 3.85Å; W798-L862 PolarHBondContact N-O 2.96Å; W798-L862 PolarHBondContact O-N 2.87Å; W798-F864 HydrophobicContact CH2-CB 3.9Å; W798-F864 HydrophobicContact CZ3-CB 3.67Å; W798-F875 AromaticContact CH2-CZ 3.8Å; W798-F875 HydrophobicContact CH2-CZ 3.8Å; W798-F875 HydrophobicContact CZ3-CZ 4.02Å
799	E	92.1	Very high	87.8	Confident	34 Å²	34	43.6 Å²	43.6	16%	0.159	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	101	174.2	-176.5	-170.7	138.9	0	0	108.7	Q772 K773 I774 F861	Q772-E799 PolarHBondContact O-N 3.46Å; K773-E799 HydrophobicContact CG-CB 4.3Å; K773-E799 IonicContact NZ-OE1 3.09Å; K773-E799 PolarHBondContact NZ-OE1 3.34Å; K773-E799 IonicContact NZ-OE2 2.82Å; K773-E799 PolarHBondContact NZ-OE2 2.92Å; I774-E799 PolarHBondContact N-O 3.31Å; E799-F861 HydrophobicContact CB-CD2 4.37Å
800	I	92.2	Very high	88.3	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.015	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	122.8	179.1	-45.6	172.2	0	0	0	108.8	I774 I781 V808 K859 M860 L862 H879	I774-I800 HydrophobicContact CB-CG1 4.39Å; I774-I800 HydrophobicContact CB-CG2 4.43Å; I774-I800 HydrophobicContact CD1-CG1 4.4Å; I774-I800 HydrophobicContact CG2-CG2 4.18Å; I774-I800 WeakPolarHBondContact O-CA 3.43Å; I781-I800 HydrophobicContact CD1-CD1 3.5Å; I781-I800 VanDerWaalsContact CD1-CD1 3.5Å; I781-I800 HydrophobicContact CD1-CG1 4.14Å; I800-V808 HydrophobicContact CB-CG1 4.23Å; I800-V808 HydrophobicContact CB-CG2 4.47Å; I800-V808 HydrophobicContact CD1-CG1 3.99Å; I800-V808 HydrophobicContact CG2-CG1 3.8Å; I800-V808 HydrophobicContact CG2-CG2 3.97Å; I800-K859 VanDerWaalsContact O-CA 3.29Å; I800-K859 WeakPolarHBondContact O-CA 3.4Å; I800-M860 HydrophobicContact CB-CB 4.42Å; I800-M860 WeakPolarHBondContact CB-O 3.02Å; I800-M860 HydrophobicContact CD1-CB 4.48Å; I800-M860 HydrophobicContact CD1-SD 4.36Å; I800-M860 PolarHBondContact N-O 2.61Å; I800-M860 PolarHBondContact O-N 3.15Å; I800-L862 HydrophobicContact CD1-CD1 3.53Å; I800-L862 HydrophobicContact CG1-CD1 4.09Å; I800-H879 HydrophobicContact CD1-CB 4.15Å
801	S	89.6	Confident	88.7	Confident	17 Å²	17	39.3 Å²	39.3	12%	0.119	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.9	175	-75.3	0	0	0	0	110.7	I774	I774-S801 PolarHBondContact O-N 3.18Å
802	A	87.3	Confident	89.1	Confident	11 Å²	11	38 Å²	38	9%	0.091	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-89.1	164.1	173.3	0	0	0	0	0	112.5	Q806 V808 N858 T881	A802-Q806 HydrophobicContact CB-CB 4.49Å; A802-V808 HydrophobicContact CB-CG2 3.85Å; A802-N858 HydrophobicContact CB-CB 4.2Å; A802-N858 PolarHBondContact N-O 2.83Å; A802-N858 PolarHBondContact O-ND2 3.32Å; A802-T881 HydrophobicContact CB-CG2 3.53Å
803	T	86	Confident	89.3	Confident	39 Å²	39	38.9 Å²	38.9	24%	0.239	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-55.1	137.5	172.6	-52.8	0	0	0	0	111.4	G805 Q806 Y897 A900	T803-G805 PolarHBondContact O-N 3.16Å; T803-Q806 WeakPolarHBondContact O-CB 2.96Å; T803-Q806 PolarHBondContact O-N 3.39Å; T803-Y897 HydrophobicContact CG2-CD2 3.7Å; T803-Y897 HydrophobicContact CG2-CE2 4.44Å; T803-Y897 HydrophobicContact CG2-CG 4.12Å; T803-A900 PolarHBondContact OG1-O 3.13Å
804	P	82.1	Confident	89.6	Confident	58 Å²	58	33.1 Å²	33.1	38%	0.377	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	133.6	-178.1	-29.8	36.7	0	0	0	113.8	Q806 D895 Y897	P804-Q806 VanDerWaalsContact C-N 3.3Å; P804-Q806 PolarHBondContact O-N 3.13Å; P804-D895 WeakPolarHBondContact CB-O 3.43Å; P804-Y897 HydrophobicContact CB-CD2 4.45Å; P804-Y897 HydrophobicContact CB-CE2 4.36Å; P804-Y897 HydrophobicContact CG-CE2 4.38Å
805	G	77.1	Confident	90	Very high	8 Å²	8	30 Å²	30	8%	0.082	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.2	-11.2	-176	0	0	0	0	0	115.1	T803 W915	T803-G805 PolarHBondContact O-N 3.16Å; G805-W915 VanDerWaalsContact O-CD1 3.31Å; G805-W915 PolarHBondContact O-NE1 2.8Å
806	Q	87.3	Confident	90.2	Very high	5 Å²	5	27.8 Å²	27.8	2%	0.023	15%	0.147	C	C	.	.			trans	-90.6	160.9	170.1	-52.2	-69.8	-39.2	0	0	110.1	A802 T803 P804 N858 T881 C883 Y897 S898 A900	A802-Q806 HydrophobicContact CB-CB 4.49Å; T803-Q806 WeakPolarHBondContact O-CB 2.96Å; T803-Q806 PolarHBondContact O-N 3.39Å; P804-Q806 VanDerWaalsContact C-N 3.3Å; P804-Q806 PolarHBondContact O-N 3.13Å; Q806-N858 WeakPolarHBondContact O-CA 3.45Å; Q806-N858 WeakPolarHBondContact O-CB 3.32Å; Q806-N858 PolarHBondContact O-N 2.66Å; Q806-T881 HydrophobicContact CB-CG2 4.49Å; Q806-C883 VanDerWaalsContact OE1-CA 3.25Å; Q806-Y897 PolarHBondContact NE2-O 3.27Å; Q806-S898 PolarHBondContact NE2-O 3.26Å; Q806-A900 HydrophobicContact CG-CB 4.16Å
807	R	89.4	Confident	90.4	Very high	60 Å²	60	27.9 Å²	27.9	23%	0.226	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.3	179.9	-66.3	169.6	65.9	-153.5	-0.1	110.8	I854 A855 G857 T881 E882 G884	R807-I854 HydrophobicContact CB-CG2 4.36Å; R807-A855 VanDerWaalsContact CZ-O 3.3Å; R807-A855 PolarHBondContact NE-O 3.45Å; R807-A855 PolarHBondContact NH2-O 3.5Å; R807-G857 WeakPolarHBondContact CA-O 3.31Å; R807-T881 CarbonylContact O-C 3.57Å; R807-T881 VanDerWaalsContact O-CA 3.3Å; R807-T881 WeakPolarHBondContact O-CA 3.33Å; R807-E882 PolarHBondContact N-O 2.97Å; R807-E882 PolarHBondContact O-N 2.87Å; R807-G884 WeakPolarHBondContact CD-O 3.36Å; R807-G884 WeakPolarHBondContact CG-O 3.37Å
808	V	91.4	Very high	90.5	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	126.7	173.9	-177.2	0	0	0	0	109.7	I800 A802 I854 A855 M860	I800-V808 HydrophobicContact CB-CG1 4.23Å; I800-V808 HydrophobicContact CB-CG2 4.47Å; I800-V808 HydrophobicContact CD1-CG1 3.99Å; I800-V808 HydrophobicContact CG2-CG1 3.8Å; I800-V808 HydrophobicContact CG2-CG2 3.97Å; A802-V808 HydrophobicContact CB-CG2 3.85Å; V808-I854 CarbonylContact O-C 3.57Å; V808-I854 WeakPolarHBondContact O-CA 3.48Å; V808-A855 HydrophobicContact CB-CB 4.29Å; V808-A855 PolarHBondContact O-N 2.85Å; V808-M860 HydrophobicContact CB-CB 3.9Å; V808-M860 HydrophobicContact CB-CE 4.1Å; V808-M860 HydrophobicContact CG1-CB 3.84Å; V808-M860 HydrophobicContact CG1-CE 3.9Å; V808-M860 HydrophobicContact CG1-SD 3.96Å; V808-M860 HydrophobicContact CG2-CB 4.28Å; V808-M860 VanDerWaalsContact O-CE 3.23Å; V808-M860 WeakPolarHBondContact O-CE 3.5Å
809	K	92.6	Very high	90.4	Very high	46 Å²	46	34 Å²	34	20%	0.2	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	140.4	167.3	172.9	167.2	170.9	176.4	0	110.2	T811 L853 I854 H879 S880 E882	K809-T811 WeakPolarHBondContact CE-OG1 3.46Å; K809-L853 CarbonylContact C-O 3.54Å; K809-L853 WeakPolarHBondContact CA-O 3.5Å; K809-I854 HydrophobicContact CB-CG1 4.24Å; K809-I854 HydrophobicContact CB-CG2 4.3Å; K809-I854 HydrophobicContact CD-CD1 4.37Å; K809-I854 HydrophobicContact CD-CG1 4.14Å; K809-I854 HydrophobicContact CG-CG1 4.05Å; K809-H879 CarbonylContact O-C 3.59Å; K809-H879 VanDerWaalsContact O-CA 3.31Å; K809-H879 WeakPolarHBondContact O-CA 3.37Å; K809-S880 PolarHBondContact N-O 3.35Å; K809-S880 PolarHBondContact O-N 2.02Å; K809-E882 HydrophobicContact CB-CG 4.14Å; K809-E882 HydrophobicContact CD-CG 3.9Å; K809-E882 WeakPolarHBondContact CD-OE1 3.02Å; K809-E882 WeakPolarHBondContact CD-OE2 3.48Å; K809-E882 WeakPolarHBondContact CE-OE1 3.33Å; K809-E882 IonicContact NZ-OE1 2.72Å; K809-E882 PolarHBondContact NZ-OE1 2.86Å
810	L	94.1	Very high	90.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.2	175.9	-172.9	72.5	0	0	0	108.5	I781 F812 V830 P852 L853 M860 L862 A877 H879	I781-L810 HydrophobicContact CD1-CD1 4.07Å; L810-F812 HydrophobicContact CD2-CE1 4.44Å; L810-F812 HydrophobicContact CD2-CE2 3.93Å; L810-F812 HydrophobicContact CD2-CZ 3.6Å; L810-F812 HydrophobicContact CG-CE2 4.23Å; L810-F812 HydrophobicContact CG-CZ 4.19Å; L810-V830 HydrophobicContact CD2-CG1 4.26Å; L810-V830 HydrophobicContact CD2-CG2 4.06Å; L810-P852 CarbonylContact O-C 3.56Å; L810-P852 WeakPolarHBondContact O-CA 3.28Å; L810-L853 PolarHBondContact N-O 3.39Å; L810-L853 PolarHBondContact O-N 3.26Å; L810-M860 HydrophobicContact CB-CE 4.3Å; L810-M860 HydrophobicContact CB-SD 3.95Å; L810-M860 HydrophobicContact CD2-SD 4.38Å; L810-L862 HydrophobicContact CD1-CD2 4.19Å; L810-L862 HydrophobicContact CD2-CD2 3.75Å; L810-L862 HydrophobicContact CD2-CG 4.37Å; L810-A877 HydrophobicContact CD1-CB 3.7Å; L810-A877 HydrophobicContact CG-CB 4.16Å; L810-H879 HydrophobicContact CD1-CB 4.34Å
811	T	94.3	Very high	90	Very high	42 Å²	42	44 Å²	44	26%	0.258	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.7	-179.1	-56.7	0	0	0	0	108.9	K809 P852 A877 T878	K809-T811 WeakPolarHBondContact CE-OG1 3.46Å; T811-P852 HydrophobicContact CG2-CG 4.3Å; T811-A877 CarbonylContact O-C 3.53Å; T811-A877 VanDerWaalsContact O-CA 3.29Å; T811-A877 WeakPolarHBondContact O-CA 3.42Å; T811-T878 PolarHBondContact N-O 3.05Å; T811-T878 PolarHBondContact O-N 2.9Å
812	F	94.1	Very high	89.9	Confident	8 Å²	8	50.4 Å²	50.4	4%	0.035	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.8	-178.5	-66.8	-88.2	0	0	0	111.5	L810 F815 L828 L844 L849 P850 F875 A877	L810-F812 HydrophobicContact CD2-CE1 4.44Å; L810-F812 HydrophobicContact CD2-CE2 3.93Å; L810-F812 HydrophobicContact CD2-CZ 3.6Å; L810-F812 HydrophobicContact CG-CE2 4.23Å; L810-F812 HydrophobicContact CG-CZ 4.19Å; F812-F815 AromaticContact CD1-CD2 3.64Å; F812-F815 HydrophobicContact CD1-CD2 3.64Å; F812-F815 HydrophobicContact CD1-CE2 4.28Å; F812-F815 AromaticContact CE1-CD2 3.83Å; F812-F815 HydrophobicContact CE1-CD2 3.83Å; F812-F815 AromaticContact CE1-CE2 4Å; F812-F815 HydrophobicContact CE1-CE2 4Å; F812-F815 HydrophobicContact CG-CD2 4.38Å; F812-L828 HydrophobicContact CE1-CD2 3.59Å; F812-L828 HydrophobicContact CZ-CD2 3.67Å; F812-L844 HydrophobicContact CE2-CD1 3.74Å; F812-L844 HydrophobicContact CZ-CD1 3.6Å; F812-L849 HydrophobicContact CB-CD1 3.81Å; F812-L849 HydrophobicContact CB-CG 4.25Å; F812-P850 HydrophobicContact CD1-CG 4.42Å; F812-P850 HydrophobicContact CD2-CB 3.62Å; F812-P850 HydrophobicContact CD2-CG 3.77Å; F812-P850 HydrophobicContact CE2-CB 3.89Å; F812-P850 HydrophobicContact CE2-CG 4.05Å; F812-P850 HydrophobicContact CG-CB 4.29Å; F812-P850 HydrophobicContact CG-CG 3.98Å; F812-P850 HydrophobicContact CZ-CG 4.49Å; F812-F875 HydrophobicContact CE1-CD2 4.3Å; F812-A877 HydrophobicContact CD1-CB 3.71Å; F812-A877 HydrophobicContact CE1-CB 3.86Å; F812-A877 HydrophobicContact CG-CB 4.3Å
813	N	91.1	Very high	90	Very high	72 Å²	72	50.7 Å²	50.7	39%	0.385	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-45.6	175.7	-56.9	88.1	0	0	0	110.4	Q876 T878	N813-Q876 HydrophobicContact CB-CG 4.39Å; N813-Q876 PolarHBondContact N-O 3.39Å; N813-T878 PolarHBondContact ND2-OG1 3.21Å; N813-T878 PolarHBondContact OD1-N 2.76Å; N813-T878 VanDerWaalsContact OD1-N 3.09Å; N813-T878 PolarHBondContact OD1-OG1 3Å
814	E	91.5	Very high	90.1	Very high	75 Å²	75	51.6 Å²	51.6	35%	0.35	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.9	168.7	-72.9	-157.9	162.1	0	0	110.4	W786 F875 Q876	W786-E814 HydrophobicContact CZ2-CG 4.32Å; W786-E814 PolarHBondContact NE1-OE2 3.32Å; E814-F875 VanDerWaalsContact O-CA 3.27Å; E814-F875 WeakPolarHBondContact O-CA 3.25Å; E814-F875 WeakPolarHBondContact O-CB 3.36Å; E814-Q876 PolarHBondContact N-O 3.43Å; E814-Q876 VanDerWaalsContact N-O 3.12Å; E814-Q876 PolarHBondContact O-N 2.74Å
815	F	94.4	Very high	90.5	Very high	14 Å²	14	54 Å²	54	6%	0.061	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	106.4	177.8	-165.3	-91.9	0	0	0	111.5	F812 I817 L828 L844 G846 N847 L849 P850 F875	F812-F815 AromaticContact CD1-CD2 3.64Å; F812-F815 HydrophobicContact CD1-CD2 3.64Å; F812-F815 HydrophobicContact CD1-CE2 4.28Å; F812-F815 AromaticContact CE1-CD2 3.83Å; F812-F815 HydrophobicContact CE1-CD2 3.83Å; F812-F815 AromaticContact CE1-CE2 4Å; F812-F815 HydrophobicContact CE1-CE2 4Å; F812-F815 HydrophobicContact CG-CD2 4.38Å; F815-I817 HydrophobicContact CD2-CD1 4.43Å; F815-I817 HydrophobicContact CE1-CB 4.39Å; F815-I817 HydrophobicContact CE1-CD1 4.2Å; F815-I817 HydrophobicContact CE1-CG1 4.24Å; F815-I817 HydrophobicContact CE2-CD1 3.56Å; F815-I817 HydrophobicContact CE2-CG1 4.19Å; F815-I817 HydrophobicContact CZ-CB 4.4Å; F815-I817 HydrophobicContact CZ-CD1 3.41Å; F815-I817 VanDerWaalsContact CZ-CD1 3.41Å; F815-I817 HydrophobicContact CZ-CG1 3.92Å; F815-L828 HydrophobicContact CE2-CD2 4.22Å; F815-L844 HydrophobicContact CE1-CB 4.29Å; F815-L844 HydrophobicContact CE2-CB 4.06Å; F815-L844 HydrophobicContact CZ-CB 3.48Å; F815-L844 VanDerWaalsContact CZ-CB 3.48Å; F815-G846 WeakPolarHBondContact CD1-O 3.2Å; F815-G846 WeakPolarHBondContact CE1-O 3.42Å; F815-N847 CarbonylContact O-C 3.6Å; F815-N847 WeakPolarHBondContact O-CA 3.41Å; F815-L849 HydrophobicContact CB-CD1 4.01Å; F815-P850 HydrophobicContact CB-CG 4.46Å; F815-P850 HydrophobicContact CD1-CG 3.97Å; F815-P850 HydrophobicContact CD2-CG 3.84Å; F815-P850 HydrophobicContact CE1-CG 4.13Å; F815-P850 HydrophobicContact CE2-CG 4.01Å; F815-P850 HydrophobicContact CG-CG 3.83Å; F815-P850 HydrophobicContact CZ-CG 4.15Å; F815-F875 HydrophobicContact CD2-CB 3.68Å; F815-F875 HydrophobicContact CD2-CG 4.47Å; F815-F875 HydrophobicContact CE2-CB 4.25Å
816	E	93.9	Very high	91.3	Very high	54 Å²	54	53.6 Å²	53.6	25%	0.252	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	92.2	171.9	-164.9	-164.4	162.1	0	0	109.3	N847 R872 K873 G874	E816-N847 HydrophobicContact CG-CB 4.22Å; E816-R872 HydrophobicContact CB-CB 4.47Å; E816-R872 HydrophobicContact CG-CB 4.01Å; E816-R872 HydrophobicContact CG-CG 4.32Å; E816-R872 WeakPolarHBondContact O-CB 3.41Å; E816-R872 WeakPolarHBondContact OE1-CD 3.49Å; E816-R872 IonicContact OE1-CZ 3.85Å; E816-R872 IonicContact OE1-NH1 2.93Å; E816-R872 PolarHBondContact OE1-NH1 2.88Å; E816-K873 HydrophobicContact CB-CB 4.44Å; E816-G874 CarbonylContact C-O 3.59Å; E816-G874 PolarHBondContact N-O 2.89Å; E816-G874 VanDerWaalsContact O-CA 3.26Å; E816-G874 WeakPolarHBondContact O-CA 3.39Å; E816-G874 PolarHBondContact O-N 3.24Å
817	I	93.9	Very high	91.7	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.015	26%	0.261	C	S	.	.			trans	-108.1	163.4	172.1	-59.8	-177	0	0	0	108.3	F815 Q819 D826 L828 C845 G846 F864 F875	F815-I817 HydrophobicContact CD2-CD1 4.43Å; F815-I817 HydrophobicContact CE1-CB 4.39Å; F815-I817 HydrophobicContact CE1-CD1 4.2Å; F815-I817 HydrophobicContact CE1-CG1 4.24Å; F815-I817 HydrophobicContact CE2-CD1 3.56Å; F815-I817 HydrophobicContact CE2-CG1 4.19Å; F815-I817 HydrophobicContact CZ-CB 4.4Å; F815-I817 HydrophobicContact CZ-CD1 3.41Å; F815-I817 VanDerWaalsContact CZ-CD1 3.41Å; F815-I817 HydrophobicContact CZ-CG1 3.92Å; I817-Q819 PolarHBondContact O-N 3.2Å; I817-D826 VanDerWaalsContact CG2-C 3.48Å; I817-D826 HydrophobicContact CG2-CB 3.49Å; I817-D826 VanDerWaalsContact CG2-CB 3.49Å; I817-D826 VanDerWaalsContact CG2-O 3.29Å; I817-D826 WeakPolarHBondContact CG2-O 3.48Å; I817-L828 HydrophobicContact CD1-CB 4.05Å; I817-C845 HydrophobicContact CG2-CB 4.3Å; I817-G846 PolarHBondContact N-O 2.94Å; I817-G846 CarbonylContact O-C 3.47Å; I817-G846 WeakPolarHBondContact O-CA 3.05Å; I817-G846 PolarHBondContact O-N 3.27Å; I817-F864 HydrophobicContact CD1-CD2 4.19Å; I817-F864 HydrophobicContact CD1-CE2 3.93Å; I817-F864 HydrophobicContact CG1-CE2 4.41Å; I817-F864 HydrophobicContact CG2-CE2 4.35Å; I817-F875 HydrophobicContact CD1-CD1 3.95Å
818	E	93.8	Very high	91.9	Very high	23 Å²	23	51 Å²	51	11%	0.107	25%	0.25	C	S	.	.			trans	-53.4	142.3	174	-171.7	177.3	-159.7	0	0	111.5	Y790 Y825 D826 C845 G846 V870	Y790-E818 PolarHBondContact OH-N 3.29Å; E818-Y825 HydrophobicContact CG-CD2 4.33Å; E818-Y825 WeakPolarHBondContact OE2-CB 3.48Å; E818-Y825 WeakPolarHBondContact OE2-CD2 3.35Å; E818-D826 HydrophobicContact CB-CB 3.88Å; E818-C845 WeakPolarHBondContact O-CB 3.36Å; E818-G846 PolarHBondContact O-N 3.2Å; E818-V870 VanDerWaalsContact CD-CB 3.48Å; E818-V870 HydrophobicContact CG-CB 4.15Å; E818-V870 HydrophobicContact CG-CG1 3.86Å; E818-V870 VanDerWaalsContact OE1-CB 3.25Å; E818-V870 WeakPolarHBondContact OE1-CB 2.94Å; E818-V870 WeakPolarHBondContact OE1-CG1 3.3Å; E818-V870 WeakPolarHBondContact OE1-CG2 3Å
819	Q	90	Very high	92.1	Very high	142 Å²	142	51.9 Å²	51.9	66%	0.664	25%	0.254	S	S	*	.			trans	-96.6	116.9	-176.8	-169.8	165	30.6	0	0	111.5	I817	I817-Q819 PolarHBondContact O-N 3.2Å
820	H	91.6	Very high	92.3	Very high	53 Å²	53	49.7 Å²	49.7	25%	0.245	25%	0.245	C	C	.	.			trans	-134.7	147.8	172.6	-176.5	-96.3	0	0	0	110.6	E822 C823 A824 Y825 C845	H820-E822 VanDerWaalsContact C-N 3.26Å; H820-E822 PolarHBondContact ND1-N 3.44Å; H820-E822 PolarHBondContact O-N 3.08Å; H820-C823 PolarHBondContact ND1-N 3.41Å; H820-C823 PolarHBondContact O-N 3.24Å; H820-A824 WeakPolarHBondContact ND1-CB 3.27Å; H820-A824 PolarHBondContact ND1-N 3.4Å; H820-Y825 HydrophobicContact CB-CD2 3.94Å; H820-Y825 HydrophobicContact CB-CE2 4.33Å; H820-Y825 HydrophobicContact CB-CG 4.45Å; H820-Y825 AromaticContact CD2-CD2 3.94Å; H820-Y825 AromaticContact CD2-CE2 3.51Å; H820-Y825 AromaticContact CD2-CZ 3.71Å; H820-C845 PolarHBondContact O-SG 2.87Å; H820-C845 VanDerWaalsContact O-SG 3.37Å
821	Q	84.8	Confident	92.4	Very high	193 Å²	193	50 Å²	50	90%	0.902	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-34.6	-175.5	-176.5	172.6	-6.9	0	0	113.4
822	E	87.1	Confident	92.3	Very high	152 Å²	152	49.2 Å²	49.2	71%	0.71	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.2	13.8	177.6	-58.9	-174.8	117	0	0	112.9	H820 A824	H820-E822 VanDerWaalsContact C-N 3.26Å; H820-E822 PolarHBondContact ND1-N 3.44Å; H820-E822 PolarHBondContact O-N 3.08Å; E822-A824 PolarHBondContact O-N 2.9Å
823	C	90.1	Very high	92	Very high	17 Å²	17	49.4 Å²	49.4	12%	0.115	25%	0.245	C	C	.	.			trans	48.8	54.5	-175.2	-59.9	0	0	0	0	112.8	H820 H827 R843 C845	H820-C823 PolarHBondContact ND1-N 3.41Å; H820-C823 PolarHBondContact O-N 3.24Å; C823-H827 HydrophobicContact CB-CB 4.01Å; C823-H827 PolarHBondContact O-ND1 3.34Å; C823-R843 HydrophobicContact CB-CG 3.99Å; C823-R843 PolarHBondContact O-NH1 2.86Å; C823-C845 WeakPolarHBondContact CA-SG 3.38Å; C823-C845 HydrophobicContact CB-CB 3.56Å; C823-C845 WeakPolarHBondContact CB-SG 3.45Å; C823-C845 WeakPolarHBondContact SG-CB 3.46Å; C823-C845 PolarHBondContact SG-N 2.87Å; C823-C845 VanDerWaalsContact SG-N 3.41Å; C823-C845 CovalentContact SG-SG 2.03Å; C823-C845 PolarHBondContact SG-SG 2.78Å
824	A	88.2	Confident	91.8	Very high	57 Å²	57	50.3 Å²	50.3	47%	0.471	25%	0.247	S	C	.	.			trans	-98.5	-16.6	-172.8	0	0	0	0	0	113.8	H820 E822	H820-A824 WeakPolarHBondContact ND1-CB 3.27Å; H820-A824 PolarHBondContact ND1-N 3.4Å; E822-A824 PolarHBondContact O-N 2.9Å
825	Y	90.4	Very high	91.7	Very high	108 Å²	108	49.8 Å²	49.8	42%	0.424	25%	0.249	S	C	.	.	S	Bend	trans	-90.3	-126.7	169.6	-48.6	-37.6	0	0	0	108.5	E818 H820 H827	E818-Y825 HydrophobicContact CG-CD2 4.33Å; E818-Y825 WeakPolarHBondContact OE2-CB 3.48Å; E818-Y825 WeakPolarHBondContact OE2-CD2 3.35Å; H820-Y825 HydrophobicContact CB-CD2 3.94Å; H820-Y825 HydrophobicContact CB-CE2 4.33Å; H820-Y825 HydrophobicContact CB-CG 4.45Å; H820-Y825 AromaticContact CD2-CD2 3.94Å; H820-Y825 AromaticContact CD2-CE2 3.51Å; H820-Y825 AromaticContact CD2-CZ 3.71Å; Y825-H827 PolarHBondContact O-N 3.4Å; Y825-H827 PolarHBondContact O-ND1 3.1Å
826	D	93.3	Very high	91.3	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	27%	0.268	C	S	.	.	S	Bend	trans	-62.6	132.3	175	-53.7	-25.4	0	0	0	111.9	Y790 I817 E818 C845 I865 S866 D867	Y790-D826 HydrophobicContact CE2-CB 4.4Å; Y790-D826 WeakPolarHBondContact CE2-OD2 3.24Å; Y790-D826 PolarHBondContact OH-OD2 2.83Å; I817-D826 VanDerWaalsContact CG2-C 3.48Å; I817-D826 HydrophobicContact CG2-CB 3.49Å; I817-D826 VanDerWaalsContact CG2-CB 3.49Å; I817-D826 VanDerWaalsContact CG2-O 3.29Å; I817-D826 WeakPolarHBondContact CG2-O 3.48Å; E818-D826 HydrophobicContact CB-CB 3.88Å; D826-C845 WeakPolarHBondContact O-CB 3.49Å; D826-I865 WeakPolarHBondContact CA-O 3.44Å; D826-S866 WeakPolarHBondContact OD1-CA 3.13Å; D826-S866 WeakPolarHBondContact OD1-CB 3.05Å; D826-D867 PolarHBondContact OD1-N 3.5Å
827	H	95	Very high	91	Very high	11 Å²	11	60 Å²	60	5%	0.051	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	158.2	179.3	61.4	-82.2	0	0	0	113.6	C823 Y825 E829 R843 L844 C845 F864 I865	C823-H827 HydrophobicContact CB-CB 4.01Å; C823-H827 PolarHBondContact O-ND1 3.34Å; Y825-H827 PolarHBondContact O-N 3.4Å; Y825-H827 PolarHBondContact O-ND1 3.1Å; H827-E829 IonicContact CD2-OE1 3.95Å; H827-E829 IonicContact NE2-OE1 3.71Å; H827-R843 HydrophobicContact CB-CG 4.31Å; H827-R843 PolarHBondContact NE2-NH2 3.28Å; H827-R843 VanDerWaalsContact NE2-NH2 3.16Å; H827-L844 WeakPolarHBondContact CA-O 3.34Å; H827-C845 HydrophobicContact CB-CB 4.35Å; H827-F864 VanDerWaalsContact O-CD2 3.31Å; H827-F864 WeakPolarHBondContact O-CD2 3.2Å; H827-I865 PolarHBondContact N-O 3.4Å; H827-I865 PolarHBondContact O-N 2.84Å
828	L	95.1	Very high	90.9	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	121.4	170.6	175	66.6	0	0	0	109.7	F812 F815 I817 V830 R843 L844 L862 F864 F875	F812-L828 HydrophobicContact CE1-CD2 3.59Å; F812-L828 HydrophobicContact CZ-CD2 3.67Å; F815-L828 HydrophobicContact CE2-CD2 4.22Å; I817-L828 HydrophobicContact CD1-CB 4.05Å; L828-V830 HydrophobicContact CD2-CG2 4.42Å; L828-V830 HydrophobicContact CG-CG2 4.2Å; L828-R843 CarbonylContact O-C 3.45Å; L828-R843 WeakPolarHBondContact O-CA 3.02Å; L828-L844 HydrophobicContact CB-CB 4.47Å; L828-L844 HydrophobicContact CD2-CD1 4.44Å; L828-L844 PolarHBondContact N-O 2.98Å; L828-L844 PolarHBondContact O-N 2.86Å; L828-L862 HydrophobicContact CD1-CB 4.32Å; L828-F864 HydrophobicContact CB-CD2 4.5Å; L828-F864 HydrophobicContact CD1-CB 4.1Å; L828-F875 HydrophobicContact CD1-CE1 4.17Å; L828-F875 HydrophobicContact CD1-CZ 3.9Å; L828-F875 HydrophobicContact CD2-CD1 4.34Å; L828-F875 HydrophobicContact CD2-CD2 4.33Å; L828-F875 HydrophobicContact CD2-CE1 4.12Å; L828-F875 HydrophobicContact CD2-CE2 4.11Å; L828-F875 HydrophobicContact CD2-CG 4.45Å; L828-F875 HydrophobicContact CD2-CZ 4Å
829	E	94.9	Very high	90.8	Very high	18 Å²	18	64.5 Å²	64.5	8%	0.084	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	138.2	169.2	-80.2	167.8	173.5	0	0	110.8	H827 F831 R843 L862 R863	H827-E829 IonicContact CD2-OE1 3.95Å; H827-E829 IonicContact NE2-OE1 3.71Å; E829-F831 HydrophobicContact CB-CD2 4.3Å; E829-F831 HydrophobicContact CB-CE2 3.5Å; E829-F831 VanDerWaalsContact CB-CE2 3.5Å; E829-F831 HydrophobicContact CB-CZ 3.88Å; E829-F831 HydrophobicContact CG-CZ 4.45Å; E829-F831 WeakPolarHBondContact OE2-CZ 3.21Å; E829-R843 HydrophobicContact CG-CB 4.15Å; E829-R843 HydrophobicContact CG-CG 4.06Å; E829-R843 IonicContact OE1-CZ 3.17Å; E829-R843 IonicContact OE1-NE 2.81Å; E829-R843 PolarHBondContact OE1-NE 3.36Å; E829-R843 IonicContact OE1-NH2 2.69Å; E829-R843 PolarHBondContact OE1-NH2 2.71Å; E829-L862 CarbonylContact O-C 3.47Å; E829-L862 WeakPolarHBondContact O-CA 3.17Å; E829-R863 HydrophobicContact CB-CB 4.43Å; E829-R863 PolarHBondContact N-O 3.18Å; E829-R863 PolarHBondContact O-N 2.9Å
830	V	96.2	Very high	90.8	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	127.6	177.7	-171.7	0	0	0	0	108.7	L810 L828 L841 G842 L844 L853 M860 L862	L810-V830 HydrophobicContact CD2-CG1 4.26Å; L810-V830 HydrophobicContact CD2-CG2 4.06Å; L828-V830 HydrophobicContact CD2-CG2 4.42Å; L828-V830 HydrophobicContact CG-CG2 4.2Å; V830-L841 HydrophobicContact CB-CB 4.49Å; V830-L841 HydrophobicContact CG1-CB 4.4Å; V830-L841 HydrophobicContact CG1-CD1 4.23Å; V830-L841 PolarHBondContact O-N 3.4Å; V830-G842 PolarHBondContact N-O 3.48Å; V830-G842 PolarHBondContact O-N 2.97Å; V830-L844 HydrophobicContact CG2-CD1 4.37Å; V830-L853 HydrophobicContact CB-CD1 3.82Å; V830-L853 HydrophobicContact CG1-CD1 4.01Å; V830-L853 HydrophobicContact CG2-CD1 3.83Å; V830-M860 HydrophobicContact CG1-CE 4.48Å; V830-M860 HydrophobicContact CG1-CG 3.85Å; V830-M860 HydrophobicContact CG1-SD 3.61Å; V830-L862 HydrophobicContact CG1-CD1 4.46Å; V830-L862 HydrophobicContact CG1-CG 4.31Å; V830-L862 HydrophobicContact CG2-CG 4.28Å
831	F	95.8	Very high	90.9	Very high	7 Å²	7	62.4 Å²	62.4	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.5	-171.5	-58.9	-99.8	0	0	0	111.7	E829 G833 E836 S838 P839 I840 M860 F861 R863	E829-F831 HydrophobicContact CB-CD2 4.3Å; E829-F831 HydrophobicContact CB-CE2 3.5Å; E829-F831 VanDerWaalsContact CB-CE2 3.5Å; E829-F831 HydrophobicContact CB-CZ 3.88Å; E829-F831 HydrophobicContact CG-CZ 4.45Å; E829-F831 WeakPolarHBondContact OE2-CZ 3.21Å; F831-G833 PolarHBondContact O-N 3.35Å; F831-E836 HydrophobicContact CE1-CB 4.38Å; F831-E836 VanDerWaalsContact CE1-O 3.23Å; F831-E836 WeakPolarHBondContact CE1-O 3.46Å; F831-E836 HydrophobicContact CZ-CB 4.21Å; F831-S838 WeakPolarHBondContact CD1-O 3.49Å; F831-P839 CarbonylContact C-O 3.58Å; F831-P839 WeakPolarHBondContact CA-O 3.24Å; F831-I840 HydrophobicContact CD1-CG1 3.64Å; F831-I840 HydrophobicContact CE1-CD1 4.04Å; F831-I840 HydrophobicContact CE1-CG1 3.5Å; F831-I840 HydrophobicContact CZ-CG1 4.32Å; F831-M860 WeakPolarHBondContact O-CA 3.44Å; F831-F861 HydrophobicContact CB-CB 4.26Å; F831-F861 AromaticContact CD2-CD1 3.66Å; F831-F861 HydrophobicContact CD2-CD1 3.66Å; F831-F861 HydrophobicContact CD2-CE1 4.36Å; F831-F861 WeakPolarHBondContact CD2-O 3.18Å; F831-F861 HydrophobicContact CE2-CD1 4.12Å; F831-F861 HydrophobicContact CE2-CE1 4.37Å; F831-F861 HydrophobicContact CG-CD1 4.28Å; F831-F861 PolarHBondContact N-O 2.77Å; F831-F861 PolarHBondContact O-N 3.04Å; F831-F861 VanDerWaalsContact O-N 3.11Å; F831-R863 HydrophobicContact CE2-CB 4.16Å
832	D	92.1	Very high	91.1	Very high	25 Å²	25	54 Å²	54	13%	0.134	28%	0.284	C	S	.	.	S	Bend	trans	-81.4	76.6	178.7	-163.5	14	0	0	0	111.2	S838 P839 L841 A855 T856	D832-S838 WeakPolarHBondContact O-CB 3.15Å; D832-S838 PolarHBondContact O-OG 2.72Å; D832-P839 HydrophobicContact CB-CB 4.42Å; D832-P839 PolarHBondContact N-O 2.95Å; D832-L841 HydrophobicContact CB-CD1 4.21Å; D832-L841 HydrophobicContact CB-CD2 3.82Å; D832-L841 HydrophobicContact CB-CG 3.85Å; D832-A855 VanDerWaalsContact OD1-CA 3.29Å; D832-A855 WeakPolarHBondContact OD1-CA 3.33Å; D832-A855 WeakPolarHBondContact OD1-CB 3.32Å; D832-T856 VanDerWaalsContact CG-OG1 3.3Å; D832-T856 PolarHBondContact OD1-N 3Å; D832-T856 PolarHBondContact OD1-OG1 2.92Å; D832-T856 WeakPolarHBondContact OD2-CB 3.38Å; D832-T856 WeakPolarHBondContact OD2-CG2 3.37Å; D832-T856 PolarHBondContact OD2-N 2.9Å; D832-T856 PolarHBondContact OD2-OG1 2.82Å
833	G	89.3	Confident	91.5	Very high	13 Å²	13	52 Å²	52	13%	0.134	27%	0.27	C	S	.	.	S	Bend	trans	145.1	-148.9	175.8	0	0	0	0	0	113.2	F831 S838 K859 M860 F861	F831-G833 PolarHBondContact O-N 3.35Å; G833-S838 WeakPolarHBondContact CA-OG 3.41Å; G833-K859 WeakPolarHBondContact CA-O 3.34Å; G833-K859 PolarHBondContact N-O 3.39Å; G833-K859 CarbonylContact O-C 3.53Å; G833-M860 CarbonylContact O-C 3.57Å; G833-M860 VanDerWaalsContact O-CA 3.24Å; G833-M860 WeakPolarHBondContact O-CA 3.21Å; G833-M860 PolarHBondContact O-N 2.87Å; G833-F861 WeakPolarHBondContact O-CB 3.31Å; G833-F861 PolarHBondContact O-N 2.88Å
834	E	85.9	Confident	91.7	Very high	91 Å²	91	52.5 Å²	52.5	43%	0.425	27%	0.272	S	S	.	.	S	Bend	trans	-92.8	-16.1	-164.2	-173.4	161.3	-158.8	0	0	114.8	K859	E834-K859 HydrophobicContact CB-CD 3.77Å; E834-K859 HydrophobicContact CG-CD 3.96Å; E834-K859 IonicContact OE1-NZ 3.89Å; E834-K859 PolarHBondContact OE1-NZ 2.95Å; E834-K859 IonicContact OE2-NZ 2.73Å; E834-K859 PolarHBondContact OE2-NZ 2.79Å
835	T	89.2	Confident	92	Very high	64 Å²	64	50.9 Å²	50.9	39%	0.393	26%	0.257	S	S	.	.	S	Bend	trans	-147.8	165.5	-170.2	67.7	0	0	0	0	112.5	K837 S838	T835-K837 PolarHBondContact O-N 2.92Å; T835-K837 PolarHBondContact OG1-N 3.31Å; T835-S838 VanDerWaalsContact O-CB 3.31Å; T835-S838 WeakPolarHBondContact O-CB 3.46Å; T835-S838 PolarHBondContact O-N 2.78Å
836	E	86.6	Confident	92.1	Very high	98 Å²	98	45.9 Å²	45.9	46%	0.458	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-9.6	169.5	57.8	166.9	-162.7	0	0	115.4	F831 F861 R863	F831-E836 HydrophobicContact CE1-CB 4.38Å; F831-E836 VanDerWaalsContact CE1-O 3.23Å; F831-E836 WeakPolarHBondContact CE1-O 3.46Å; F831-E836 HydrophobicContact CZ-CB 4.21Å; E836-F861 HydrophobicContact CB-CE1 4.09Å; E836-R863 IonicContact OE2-CZ 3.49Å; E836-R863 IonicContact OE2-NH1 2.77Å; E836-R863 PolarHBondContact OE2-NH1 3.29Å; E836-R863 IonicContact OE2-NH2 3.67Å
837	K	87.3	Confident	91.9	Very high	184 Å²	184	51 Å²	51	80%	0.8	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.6	175.9	-61.4	177.3	-176.2	170.3	0	113.4	T835	T835-K837 PolarHBondContact O-N 2.92Å; T835-K837 PolarHBondContact OG1-N 3.31Å
838	S	91.3	Very high	91.8	Very high	29 Å²	29	57.4 Å²	57.4	20%	0.203	29%	0.293	C	S	.	.	S	Bend	trans	-70.1	163.5	174.8	-90.8	0	0	0	0	112	F831 D832 G833 T835	F831-S838 WeakPolarHBondContact CD1-O 3.49Å; D832-S838 WeakPolarHBondContact O-CB 3.15Å; D832-S838 PolarHBondContact O-OG 2.72Å; G833-S838 WeakPolarHBondContact CA-OG 3.41Å; T835-S838 VanDerWaalsContact O-CB 3.31Å; T835-S838 WeakPolarHBondContact O-CB 3.46Å; T835-S838 PolarHBondContact O-N 2.78Å
839	P	91.8	Very high	91.6	Very high	91 Å²	91	61.5 Å²	61.5	59%	0.591	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-57.7	138.3	170.6	-22.2	34	0	0	0	111.5	F831 D832	F831-P839 CarbonylContact C-O 3.58Å; F831-P839 WeakPolarHBondContact CA-O 3.24Å; D832-P839 HydrophobicContact CB-CB 4.42Å; D832-P839 PolarHBondContact N-O 2.95Å
840	I	91.7	Very high	91.5	Very high	97 Å²	97	61.4 Å²	61.4	50%	0.497	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.4	176.9	-65.3	168.7	0	0	0	109.4	F831	F831-I840 HydrophobicContact CD1-CG1 3.64Å; F831-I840 HydrophobicContact CE1-CD1 4.04Å; F831-I840 HydrophobicContact CE1-CG1 3.5Å; F831-I840 HydrophobicContact CZ-CG1 4.32Å
841	L	92.3	Very high	91.4	Very high	55 Å²	55	66.9 Å²	66.9	29%	0.288	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-35.5	169.7	-66.3	175.5	0	0	0	111.5	V830 D832 L853 A855 M860	V830-L841 HydrophobicContact CB-CB 4.49Å; V830-L841 HydrophobicContact CG1-CB 4.4Å; V830-L841 HydrophobicContact CG1-CD1 4.23Å; V830-L841 PolarHBondContact O-N 3.4Å; D832-L841 HydrophobicContact CB-CD1 4.21Å; D832-L841 HydrophobicContact CB-CD2 3.82Å; D832-L841 HydrophobicContact CB-CG 3.85Å; L841-L853 HydrophobicContact CB-CD1 4.37Å; L841-A855 HydrophobicContact CD1-CB 4.5Å; L841-M860 HydrophobicContact CD1-CE 3.92Å
842	G	90	Very high	91.2	Very high	15 Å²	15	69.8 Å²	69.8	16%	0.155	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172	150.6	174.5	0	0	0	0	0	113.4	V830	V830-G842 PolarHBondContact N-O 3.48Å; V830-G842 PolarHBondContact O-N 2.97Å
843	R	94.1	Very high	91.2	Very high	110 Å²	110	70 Å²	70	42%	0.415	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	122.9	163.5	177.7	-175.1	-102.7	-140.8	0.5	107.2	C823 H827 L828 E829	C823-R843 HydrophobicContact CB-CG 3.99Å; C823-R843 PolarHBondContact O-NH1 2.86Å; H827-R843 HydrophobicContact CB-CG 4.31Å; H827-R843 PolarHBondContact NE2-NH2 3.28Å; H827-R843 VanDerWaalsContact NE2-NH2 3.16Å; L828-R843 CarbonylContact O-C 3.45Å; L828-R843 WeakPolarHBondContact O-CA 3.02Å; E829-R843 HydrophobicContact CG-CB 4.15Å; E829-R843 HydrophobicContact CG-CG 4.06Å; E829-R843 IonicContact OE1-CZ 3.17Å; E829-R843 IonicContact OE1-NE 2.81Å; E829-R843 PolarHBondContact OE1-NE 3.36Å; E829-R843 IonicContact OE1-NH2 2.69Å; E829-R843 PolarHBondContact OE1-NH2 2.71Å
844	L	94.8	Very high	91.3	Very high	29 Å²	29	72 Å²	72	15%	0.152	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	135.1	-162.8	-53.1	173	0	0	0	110.6	F812 F815 H827 L828 V830 P850 L853	F812-L844 HydrophobicContact CE2-CD1 3.74Å; F812-L844 HydrophobicContact CZ-CD1 3.6Å; F815-L844 HydrophobicContact CE1-CB 4.29Å; F815-L844 HydrophobicContact CE2-CB 4.06Å; F815-L844 HydrophobicContact CZ-CB 3.48Å; F815-L844 VanDerWaalsContact CZ-CB 3.48Å; H827-L844 WeakPolarHBondContact CA-O 3.34Å; L828-L844 HydrophobicContact CB-CB 4.47Å; L828-L844 HydrophobicContact CD2-CD1 4.44Å; L828-L844 PolarHBondContact N-O 2.98Å; L828-L844 PolarHBondContact O-N 2.86Å; V830-L844 HydrophobicContact CG2-CD1 4.37Å; L844-P850 HydrophobicContact CB-CG 4.47Å; L844-P850 HydrophobicContact CD1-CB 3.96Å; L844-P850 HydrophobicContact CD1-CG 3.89Å; L844-P850 HydrophobicContact CD2-CB 4.05Å; L844-P850 HydrophobicContact CD2-CG 4.28Å; L844-P850 HydrophobicContact CG-CG 4.45Å; L844-L853 HydrophobicContact CD1-CD1 4.13Å
845	C	94.1	Very high	91.6	Very high	23 Å²	23	67.7 Å²	67.7	16%	0.155	35%	0.352	C	S	.	.			trans	-157.8	175.4	175	73.1	0	0	0	0	111.3	I817 E818 H820 C823 D826 H827	I817-C845 HydrophobicContact CG2-CB 4.3Å; E818-C845 WeakPolarHBondContact O-CB 3.36Å; H820-C845 PolarHBondContact O-SG 2.87Å; H820-C845 VanDerWaalsContact O-SG 3.37Å; C823-C845 WeakPolarHBondContact CA-SG 3.38Å; C823-C845 HydrophobicContact CB-CB 3.56Å; C823-C845 WeakPolarHBondContact CB-SG 3.45Å; C823-C845 WeakPolarHBondContact SG-CB 3.46Å; C823-C845 PolarHBondContact SG-N 2.87Å; C823-C845 VanDerWaalsContact SG-N 3.41Å; C823-C845 CovalentContact SG-SG 2.03Å; C823-C845 PolarHBondContact SG-SG 2.78Å; D826-C845 WeakPolarHBondContact O-CB 3.49Å; H827-C845 HydrophobicContact CB-CB 4.35Å
846	G	92.4	Very high	91.5	Very high	2 Å²	2	69 Å²	69	2%	0.021	36%	0.36	C	S	.	.	S	Bend	trans	77.7	-161.1	-175	0	0	0	0	0	114.3	F815 I817 E818	F815-G846 WeakPolarHBondContact CD1-O 3.2Å; F815-G846 WeakPolarHBondContact CE1-O 3.42Å; I817-G846 PolarHBondContact N-O 2.94Å; I817-G846 CarbonylContact O-C 3.47Å; I817-G846 WeakPolarHBondContact O-CA 3.05Å; I817-G846 PolarHBondContact O-N 3.27Å; E818-G846 PolarHBondContact O-N 3.2Å
847	N	91.1	Very high	91.4	Very high	108 Å²	108	65.5 Å²	65.5	58%	0.578	35%	0.35	S	S	*	.	S	Bend	trans	-113	7.6	-171.8	68.8	-16.3	0	0	0	114.7	F815 E816	F815-N847 CarbonylContact O-C 3.6Å; F815-N847 WeakPolarHBondContact O-CA 3.41Å; E816-N847 HydrophobicContact CG-CB 4.22Å
848	K	91.6	Very high	91.5	Very high	147 Å²	147	59.1 Å²	59.1	64%	0.639	33%	0.325	S	S	*	.	S	Bend	trans	-82.4	125	172.8	-171.9	-159.2	170.4	-155.6	0	107.9	P850 D851	K848-P850 VanDerWaalsContact O-CD 3.3Å; K848-P850 WeakPolarHBondContact O-CD 3.33Å; K848-D851 IonicContact NZ-OD2 3.99Å
849	L	91.1	Very high	91.5	Very high	85 Å²	85	60.3 Å²	60.3	45%	0.445	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-57.7	122.4	172.3	-160.3	71.3	0	0	0	109.7	F812 F815	F812-L849 HydrophobicContact CB-CD1 3.81Å; F812-L849 HydrophobicContact CB-CG 4.25Å; F815-L849 HydrophobicContact CB-CD1 4.01Å
850	P	93.7	Very high	91.6	Very high	17 Å²	17	56 Å²	56	11%	0.11	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-70.4	149.4	178.1	-18.4	30.9	0	0	0	112.4	F812 F815 L844 K848	F812-P850 HydrophobicContact CD1-CG 4.42Å; F812-P850 HydrophobicContact CD2-CB 3.62Å; F812-P850 HydrophobicContact CD2-CG 3.77Å; F812-P850 HydrophobicContact CE2-CB 3.89Å; F812-P850 HydrophobicContact CE2-CG 4.05Å; F812-P850 HydrophobicContact CG-CB 4.29Å; F812-P850 HydrophobicContact CG-CG 3.98Å; F812-P850 HydrophobicContact CZ-CG 4.49Å; F815-P850 HydrophobicContact CB-CG 4.46Å; F815-P850 HydrophobicContact CD1-CG 3.97Å; F815-P850 HydrophobicContact CD2-CG 3.84Å; F815-P850 HydrophobicContact CE1-CG 4.13Å; F815-P850 HydrophobicContact CE2-CG 4.01Å; F815-P850 HydrophobicContact CG-CG 3.83Å; F815-P850 HydrophobicContact CZ-CG 4.15Å; L844-P850 HydrophobicContact CB-CG 4.47Å; L844-P850 HydrophobicContact CD1-CB 3.96Å; L844-P850 HydrophobicContact CD1-CG 3.89Å; L844-P850 HydrophobicContact CD2-CB 4.05Å; L844-P850 HydrophobicContact CD2-CG 4.28Å; L844-P850 HydrophobicContact CG-CG 4.45Å; K848-P850 VanDerWaalsContact O-CD 3.3Å; K848-P850 WeakPolarHBondContact O-CD 3.33Å
851	D	92.6	Very high	91.7	Very high	114 Å²	114	52.6 Å²	52.6	61%	0.61	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-67.3	151.2	171.5	-58	-61.6	0	0	0	110.5	K848 L853	K848-D851 IonicContact NZ-OD2 3.99Å; D851-L853 PolarHBondContact O-N 2.83Å
852	P	92.3	Very high	91.8	Very high	68 Å²	68	50 Å²	50	44%	0.442	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-60.4	130.3	-177.6	-23.3	33.5	0	0	0	112.9	L810 T811	L810-P852 CarbonylContact O-C 3.56Å; L810-P852 WeakPolarHBondContact O-CA 3.28Å; T811-P852 HydrophobicContact CG2-CG 4.3Å
853	L	93.3	Very high	92	Very high	29 Å²	29	51.9 Å²	51.9	15%	0.152	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.9	179.1	-60.8	-179.6	0	0	0	110.1	K809 L810 V830 L841 L844 D851	K809-L853 CarbonylContact C-O 3.54Å; K809-L853 WeakPolarHBondContact CA-O 3.5Å; L810-L853 PolarHBondContact N-O 3.39Å; L810-L853 PolarHBondContact O-N 3.26Å; V830-L853 HydrophobicContact CB-CD1 3.82Å; V830-L853 HydrophobicContact CG1-CD1 4.01Å; V830-L853 HydrophobicContact CG2-CD1 3.83Å; L841-L853 HydrophobicContact CB-CD1 4.37Å; L844-L853 HydrophobicContact CD1-CD1 4.13Å; D851-L853 PolarHBondContact O-N 2.83Å
854	I	91.4	Very high	92	Very high	57 Å²	57	46.6 Å²	46.6	29%	0.292	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118	-178	-43.3	168	0	0	0	109.1	R807 V808 K809 E882	R807-I854 HydrophobicContact CB-CG2 4.36Å; V808-I854 CarbonylContact O-C 3.57Å; V808-I854 WeakPolarHBondContact O-CA 3.48Å; K809-I854 HydrophobicContact CB-CG1 4.24Å; K809-I854 HydrophobicContact CB-CG2 4.3Å; K809-I854 HydrophobicContact CD-CD1 4.37Å; K809-I854 HydrophobicContact CD-CG1 4.14Å; K809-I854 HydrophobicContact CG-CG1 4.05Å; I854-E882 WeakPolarHBondContact CD1-OE2 3.26Å
855	A	91.3	Very high	91.9	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.253	C	S	.	.			trans	-60.4	156.2	175.2	0	0	0	0	0	111.6	R807 V808 D832 L841 M860	R807-A855 VanDerWaalsContact CZ-O 3.3Å; R807-A855 PolarHBondContact NE-O 3.45Å; R807-A855 PolarHBondContact NH2-O 3.5Å; V808-A855 HydrophobicContact CB-CB 4.29Å; V808-A855 PolarHBondContact O-N 2.85Å; D832-A855 VanDerWaalsContact OD1-CA 3.29Å; D832-A855 WeakPolarHBondContact OD1-CA 3.33Å; D832-A855 WeakPolarHBondContact OD1-CB 3.32Å; L841-A855 HydrophobicContact CD1-CB 4.5Å; A855-M860 HydrophobicContact CB-CB 4.37Å; A855-M860 HydrophobicContact CB-CE 3.86Å
856	T	86.6	Confident	91.8	Very high	90 Å²	90	46.7 Å²	46.7	55%	0.552	25%	0.248	S	C	*	.	S	Bend	trans	-81.2	-25.5	172.5	58.9	0	0	0	0	112.3	D832	D832-T856 VanDerWaalsContact CG-OG1 3.3Å; D832-T856 PolarHBondContact OD1-N 3Å; D832-T856 PolarHBondContact OD1-OG1 2.92Å; D832-T856 WeakPolarHBondContact OD2-CB 3.38Å; D832-T856 WeakPolarHBondContact OD2-CG2 3.37Å; D832-T856 PolarHBondContact OD2-N 2.9Å; D832-T856 PolarHBondContact OD2-OG1 2.82Å
857	G	85.9	Confident	91.7	Very high	25 Å²	25	49.1 Å²	49.1	26%	0.258	26%	0.261	S	S	.	.	S	Bend	trans	-120.5	-168	177.2	0	0	0	0	0	114.2	R807 K859	R807-G857 WeakPolarHBondContact CA-O 3.31Å; G857-K859 VanDerWaalsContact C-N 3.28Å; G857-K859 PolarHBondContact O-N 2.82Å
858	N	88	Confident	91.6	Very high	51 Å²	51	46.6 Å²	46.6	27%	0.273	26%	0.255	S	S	.	.	S	Bend	trans	-86	13.3	-177	75.3	-59.8	0	0	0	114.1	A802 Q806	A802-N858 HydrophobicContact CB-CB 4.2Å; A802-N858 PolarHBondContact N-O 2.83Å; A802-N858 PolarHBondContact O-ND2 3.32Å; Q806-N858 WeakPolarHBondContact O-CA 3.45Å; Q806-N858 WeakPolarHBondContact O-CB 3.32Å; Q806-N858 PolarHBondContact O-N 2.66Å
859	K	91.2	Very high	91.3	Very high	53 Å²	53	42.1 Å²	42.1	23%	0.23	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140.7	177.8	-65	-168.4	178.1	-176.3	0	110.7	I800 G833 E834 G857	I800-K859 VanDerWaalsContact O-CA 3.29Å; I800-K859 WeakPolarHBondContact O-CA 3.4Å; G833-K859 WeakPolarHBondContact CA-O 3.34Å; G833-K859 PolarHBondContact N-O 3.39Å; G833-K859 CarbonylContact O-C 3.53Å; E834-K859 HydrophobicContact CB-CD 3.77Å; E834-K859 HydrophobicContact CG-CD 3.96Å; E834-K859 IonicContact OE1-NZ 3.89Å; E834-K859 PolarHBondContact OE1-NZ 2.95Å; E834-K859 IonicContact OE2-NZ 2.73Å; E834-K859 PolarHBondContact OE2-NZ 2.79Å; G857-K859 VanDerWaalsContact C-N 3.28Å; G857-K859 PolarHBondContact O-N 2.82Å
860	M	93.9	Very high	91	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	134.9	173.8	-174.4	-172.5	-75	0	0	108.9	I800 V808 L810 V830 F831 G833 L841 A855 L862	I800-M860 HydrophobicContact CB-CB 4.42Å; I800-M860 WeakPolarHBondContact CB-O 3.02Å; I800-M860 HydrophobicContact CD1-CB 4.48Å; I800-M860 HydrophobicContact CD1-SD 4.36Å; I800-M860 PolarHBondContact N-O 2.61Å; I800-M860 PolarHBondContact O-N 3.15Å; V808-M860 HydrophobicContact CB-CB 3.9Å; V808-M860 HydrophobicContact CB-CE 4.1Å; V808-M860 HydrophobicContact CG1-CB 3.84Å; V808-M860 HydrophobicContact CG1-CE 3.9Å; V808-M860 HydrophobicContact CG1-SD 3.96Å; V808-M860 HydrophobicContact CG2-CB 4.28Å; V808-M860 VanDerWaalsContact O-CE 3.23Å; V808-M860 WeakPolarHBondContact O-CE 3.5Å; L810-M860 HydrophobicContact CB-CE 4.3Å; L810-M860 HydrophobicContact CB-SD 3.95Å; L810-M860 HydrophobicContact CD2-SD 4.38Å; V830-M860 HydrophobicContact CG1-CE 4.48Å; V830-M860 HydrophobicContact CG1-CG 3.85Å; V830-M860 HydrophobicContact CG1-SD 3.61Å; F831-M860 WeakPolarHBondContact O-CA 3.44Å; G833-M860 CarbonylContact O-C 3.57Å; G833-M860 VanDerWaalsContact O-CA 3.24Å; G833-M860 WeakPolarHBondContact O-CA 3.21Å; G833-M860 PolarHBondContact O-N 2.87Å; L841-M860 HydrophobicContact CD1-CE 3.92Å; A855-M860 HydrophobicContact CB-CB 4.37Å; A855-M860 HydrophobicContact CB-CE 3.86Å; M860-L862 HydrophobicContact CG-CD1 3.89Å; M860-L862 HydrophobicContact SD-CD1 3.96Å
861	F	94.5	Very high	90.9	Very high	25 Å²	25	42.8 Å²	42.8	11%	0.11	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.5	179.5	179.1	-99.5	0	0	0	109.4	T797 W798 E799 F831 G833 E836 R863	T797-F861 HydrophobicContact CG2-CE2 4.37Å; T797-F861 HydrophobicContact CG2-CZ 3.77Å; W798-F861 CarbonylContact O-C 3.6Å; W798-F861 WeakPolarHBondContact O-CA 3.49Å; E799-F861 HydrophobicContact CB-CD2 4.37Å; F831-F861 HydrophobicContact CB-CB 4.26Å; F831-F861 AromaticContact CD2-CD1 3.66Å; F831-F861 HydrophobicContact CD2-CD1 3.66Å; F831-F861 HydrophobicContact CD2-CE1 4.36Å; F831-F861 WeakPolarHBondContact CD2-O 3.18Å; F831-F861 HydrophobicContact CE2-CD1 4.12Å; F831-F861 HydrophobicContact CE2-CE1 4.37Å; F831-F861 HydrophobicContact CG-CD1 4.28Å; F831-F861 PolarHBondContact N-O 2.77Å; F831-F861 PolarHBondContact O-N 3.04Å; F831-F861 VanDerWaalsContact O-N 3.11Å; G833-F861 WeakPolarHBondContact O-CB 3.31Å; G833-F861 PolarHBondContact O-N 2.88Å; E836-F861 HydrophobicContact CB-CE1 4.09Å; F861-R863 HydrophobicContact CE1-CB 4.28Å
862	L	94.5	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	143.7	179.8	-69.8	71.7	0	0	0	109.6	I781 T797 W798 I800 L810 L828 E829 V830 M860	I781-L862 HydrophobicContact CD1-CD2 4.08Å; I781-L862 HydrophobicContact CG2-CD2 4.43Å; T797-L862 VanDerWaalsContact CA-O 3.25Å; T797-L862 WeakPolarHBondContact CA-O 3.22Å; W798-L862 HydrophobicContact CB-CB 4.22Å; W798-L862 HydrophobicContact CE3-CB 3.85Å; W798-L862 PolarHBondContact N-O 2.96Å; W798-L862 PolarHBondContact O-N 2.87Å; I800-L862 HydrophobicContact CD1-CD1 3.53Å; I800-L862 HydrophobicContact CG1-CD1 4.09Å; L810-L862 HydrophobicContact CD1-CD2 4.19Å; L810-L862 HydrophobicContact CD2-CD2 3.75Å; L810-L862 HydrophobicContact CD2-CG 4.37Å; L828-L862 HydrophobicContact CD1-CB 4.32Å; E829-L862 CarbonylContact O-C 3.47Å; E829-L862 WeakPolarHBondContact O-CA 3.17Å; V830-L862 HydrophobicContact CG1-CD1 4.46Å; V830-L862 HydrophobicContact CG1-CG 4.31Å; V830-L862 HydrophobicContact CG2-CG 4.28Å; M860-L862 HydrophobicContact CG-CD1 3.89Å; M860-L862 HydrophobicContact SD-CD1 3.96Å
863	R	93.9	Very high	90.7	Very high	55 Å²	55	43.4 Å²	43.4	21%	0.208	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	115	176	-173.4	-170.8	-163.2	156.9	8.6	109.8	E795 C796 T797 E829 F831 E836 F861 I865	E795-R863 IonicContact OE1-CZ 3.12Å; E795-R863 IonicContact OE1-NE 2.96Å; E795-R863 PolarHBondContact OE1-NE 2.71Å; E795-R863 IonicContact OE1-NH2 2.67Å; E795-R863 PolarHBondContact OE1-NH2 3.39Å; C796-R863 WeakPolarHBondContact O-CA 3.42Å; T797-R863 HydrophobicContact CG2-CG 4.24Å; E829-R863 HydrophobicContact CB-CB 4.43Å; E829-R863 PolarHBondContact N-O 3.18Å; E829-R863 PolarHBondContact O-N 2.9Å; F831-R863 HydrophobicContact CE2-CB 4.16Å; E836-R863 IonicContact OE2-CZ 3.49Å; E836-R863 IonicContact OE2-NH1 2.77Å; E836-R863 PolarHBondContact OE2-NH1 3.29Å; E836-R863 IonicContact OE2-NH2 3.67Å; F861-R863 HydrophobicContact CE1-CB 4.28Å; R863-I865 HydrophobicContact CG-CD1 4.35Å; R863-I865 HydrophobicContact CG-CG1 4.12Å
864	F	94.3	Very high	90.6	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	131.8	171.2	174.3	-115	0	0	0	109.6	Y790 E795 C796 W798 I817 H827 L828 F875	Y790-F864 AromaticContact CD1-CZ 3.92Å; Y790-F864 HydrophobicContact CD1-CZ 3.92Å; Y790-F864 HydrophobicContact CD2-CE1 4.21Å; Y790-F864 AromaticContact CD2-CZ 3.77Å; Y790-F864 HydrophobicContact CD2-CZ 3.77Å; Y790-F864 HydrophobicContact CE1-CZ 4.14Å; Y790-F864 HydrophobicContact CE2-CZ 4.02Å; Y790-F864 HydrophobicContact CG-CE1 4.06Å; Y790-F864 AromaticContact CG-CZ 3.74Å; Y790-F864 HydrophobicContact CG-CZ 3.74Å; E795-F864 WeakPolarHBondContact CA-O 3.24Å; C796-F864 PolarHBondContact N-O 3.3Å; C796-F864 PolarHBondContact O-N 3.02Å; W798-F864 HydrophobicContact CH2-CB 3.9Å; W798-F864 HydrophobicContact CZ3-CB 3.67Å; I817-F864 HydrophobicContact CD1-CD2 4.19Å; I817-F864 HydrophobicContact CD1-CE2 3.93Å; I817-F864 HydrophobicContact CG1-CE2 4.41Å; I817-F864 HydrophobicContact CG2-CE2 4.35Å; H827-F864 VanDerWaalsContact O-CD2 3.31Å; H827-F864 WeakPolarHBondContact O-CD2 3.2Å; L828-F864 HydrophobicContact CB-CD2 4.5Å; L828-F864 HydrophobicContact CD1-CB 4.1Å; F864-F875 HydrophobicContact CB-CE1 4.11Å; F864-F875 HydrophobicContact CB-CZ 4.39Å; F864-F875 AromaticContact CD2-CE1 3.89Å; F864-F875 HydrophobicContact CD2-CE1 3.89Å; F864-F875 AromaticContact CG-CE1 3.94Å; F864-F875 HydrophobicContact CG-CE1 3.94Å
865	I	92.5	Very high	90.7	Very high	46 Å²	46	39.3 Å²	39.3	24%	0.236	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.6	177.9	-56.6	179.1	0	0	0	108.6	K794 D826 H827 R863	K794-I865 CarbonylContact O-C 3.59Å; K794-I865 WeakPolarHBondContact O-CA 2.87Å; D826-I865 WeakPolarHBondContact CA-O 3.44Å; H827-I865 PolarHBondContact N-O 3.4Å; H827-I865 PolarHBondContact O-N 2.84Å; R863-I865 HydrophobicContact CG-CD1 4.35Å; R863-I865 HydrophobicContact CG-CG1 4.12Å
866	S	92.9	Very high	90.8	Very high	8 Å²	8	41.4 Å²	41.4	6%	0.056	22%	0.222	C	C	.	.			trans	-122.1	150.5	169.1	70.3	0	0	0	0	113.9	P791 R793 K794 D826	P791-S866 PolarHBondContact O-OG 2.86Å; R793-S866 VanDerWaalsContact CA-O 3.23Å; R793-S866 WeakPolarHBondContact CA-O 3.49Å; R793-S866 PolarHBondContact N-O 2.63Å; R793-S866 PolarHBondContact N-OG 3.42Å; K794-S866 PolarHBondContact N-OG 3.41Å; K794-S866 PolarHBondContact O-N 3.33Å; D826-S866 WeakPolarHBondContact OD1-CA 3.13Å; D826-S866 WeakPolarHBondContact OD1-CB 3.05Å
867	D	90.3	Very high	91.1	Very high	52 Å²	52	37.1 Å²	37.1	28%	0.278	20%	0.196	S	C	.	.			trans	-92.2	-173.2	-174.8	134.3	-50.4	0	0	0	111.3	S792 R793 D826 S869	S792-D867 CarbonylContact C-O 3.59Å; S792-D867 VanDerWaalsContact CA-O 3.3Å; S792-D867 WeakPolarHBondContact CA-O 3.23Å; S792-D867 WeakPolarHBondContact CB-O 3.24Å; R793-D867 PolarHBondContact N-O 3.03Å; D826-D867 PolarHBondContact OD1-N 3.5Å; D867-S869 VanDerWaalsContact C-N 3.25Å; D867-S869 PolarHBondContact O-N 2.77Å; D867-S869 WeakPolarHBondContact OD1-CA 3.41Å; D867-S869 PolarHBondContact OD1-N 3.27Å; D867-S869 PolarHBondContact OD1-OG 2.76Å
868	A	88.4	Confident	91.5	Very high	55 Å²	55	37.6 Å²	37.6	46%	0.455	19%	0.194	S	C	.	.	S	Bend	trans	-73.1	-6	-179.8	0	0	0	0	0	115.3	R793	R793-A868 HydrophobicContact CG-CB 4.47Å
869	S	84.6	Confident	91.8	Very high	54 Å²	54	35.4 Å²	35.4	38%	0.378	18%	0.182	S	C	.	.	S	Bend	trans	-151.2	176.6	-164.2	57.1	0	0	0	0	113.8	D867 Q871	D867-S869 VanDerWaalsContact C-N 3.25Å; D867-S869 PolarHBondContact O-N 2.77Å; D867-S869 WeakPolarHBondContact OD1-CA 3.41Å; D867-S869 PolarHBondContact OD1-N 3.27Å; D867-S869 PolarHBondContact OD1-OG 2.76Å; S869-Q871 VanDerWaalsContact CA-NE2 3.28Å; S869-Q871 PolarHBondContact O-N 2.91Å; S869-Q871 PolarHBondContact O-NE2 2.95Å
870	V	85.3	Confident	91.8	Very high	66 Å²	66	34.6 Å²	34.6	40%	0.4	18%	0.183	S	C	.	.			trans	53.8	43.7	168.7	-159.5	0	0	0	0	117.4	E818 R872	E818-V870 VanDerWaalsContact CD-CB 3.48Å; E818-V870 HydrophobicContact CG-CB 4.15Å; E818-V870 HydrophobicContact CG-CG1 3.86Å; E818-V870 VanDerWaalsContact OE1-CB 3.25Å; E818-V870 WeakPolarHBondContact OE1-CB 2.94Å; E818-V870 WeakPolarHBondContact OE1-CG1 3.3Å; E818-V870 WeakPolarHBondContact OE1-CG2 3Å; V870-R872 PolarHBondContact O-N 3.09Å
871	Q	90.5	Very high	91.6	Very high	49 Å²	49	36.2 Å²	36.2	23%	0.229	19%	0.193	C	C	.	.			trans	-66.1	136.4	178.8	-57.4	74.4	37.4	0	0	113.4	K789 Y790 S792 S869	K789-Q871 HydrophobicContact CB-CB 4.12Å; K789-Q871 HydrophobicContact CD-CB 4.45Å; K789-Q871 WeakPolarHBondContact CD-O 3.48Å; K789-Q871 WeakPolarHBondContact CE-O 3.24Å; K789-Q871 PolarHBondContact NZ-O 2.95Å; Y790-Q871 HydrophobicContact CD2-CB 4.13Å; Y790-Q871 HydrophobicContact CD2-CG 4.08Å; Y790-Q871 HydrophobicContact CE2-CB 4.01Å; Y790-Q871 HydrophobicContact CE2-CG 4.08Å; Y790-Q871 VanDerWaalsContact O-CB 3.24Å; Y790-Q871 WeakPolarHBondContact O-CB 2.99Å; Y790-Q871 WeakPolarHBondContact O-CG 3.42Å; S792-Q871 VanDerWaalsContact CB-NE2 3.31Å; S869-Q871 VanDerWaalsContact CA-NE2 3.28Å; S869-Q871 PolarHBondContact O-N 2.91Å; S869-Q871 PolarHBondContact O-NE2 2.95Å
872	R	91.8	Very high	91.2	Very high	104 Å²	104	37.8 Å²	37.8	39%	0.392	20%	0.201	S	C	.	.			trans	-115.7	179.9	176.2	-59.2	-51.8	-172.8	133.3	-8	111.1	K789 Y790 E816 V870 G874	K789-R872 WeakPolarHBondContact CA-O 3.25Å; Y790-R872 WeakPolarHBondContact CD1-O 3.38Å; Y790-R872 HydrophobicContact CE1-CB 3.86Å; Y790-R872 WeakPolarHBondContact CE1-O 3.19Å; Y790-R872 VanDerWaalsContact CZ-N 3.33Å; Y790-R872 PolarHBondContact N-O 3.26Å; Y790-R872 VanDerWaalsContact N-O 3.15Å; Y790-R872 PolarHBondContact OH-N 3.44Å; E816-R872 HydrophobicContact CB-CB 4.47Å; E816-R872 HydrophobicContact CG-CB 4.01Å; E816-R872 HydrophobicContact CG-CG 4.32Å; E816-R872 WeakPolarHBondContact O-CB 3.41Å; E816-R872 WeakPolarHBondContact OE1-CD 3.49Å; E816-R872 IonicContact OE1-CZ 3.85Å; E816-R872 IonicContact OE1-NH1 2.93Å; E816-R872 PolarHBondContact OE1-NH1 2.88Å; V870-R872 PolarHBondContact O-N 3.09Å; R872-G874 PolarHBondContact O-N 2.79Å
873	K	88.8	Confident	90.9	Very high	92 Å²	92	39.7 Å²	39.7	40%	0.4	21%	0.213	S	C	.	.			trans	-60.6	-25.9	178.6	-64.6	-176.8	176.5	-173.9	0	113.5	S783 E816	S783-K873 PolarHBondContact OG-O 3.38Å; E816-K873 HydrophobicContact CB-CB 4.44Å
874	G	92.1	Very high	90.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.8	-137.6	-175.9	0	0	0	0	0	111.8	S783 Y790 E816 R872	S783-G874 VanDerWaalsContact OG-CA 3.29Å; S783-G874 WeakPolarHBondContact OG-CA 3.31Å; Y790-G874 VanDerWaalsContact CD1-CA 3.4Å; E816-G874 CarbonylContact C-O 3.59Å; E816-G874 PolarHBondContact N-O 2.89Å; E816-G874 VanDerWaalsContact O-CA 3.26Å; E816-G874 WeakPolarHBondContact O-CA 3.39Å; E816-G874 PolarHBondContact O-N 3.24Å; R872-G874 PolarHBondContact O-N 2.79Å
875	F	93.3	Very high	89.9	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	151.6	-171.5	64.7	-89.8	0	0	0	113.1	I781 T782 S783 W798 F812 E814 F815 I817 L828 F864	I781-F875 HydrophobicContact CG2-CE2 4.09Å; T782-F875 WeakPolarHBondContact CA-O 3.26Å; S783-F875 PolarHBondContact N-O 3.42Å; S783-F875 PolarHBondContact OG-N 2.84Å; S783-F875 PolarHBondContact OG-O 2.82Å; W798-F875 AromaticContact CH2-CZ 3.8Å; W798-F875 HydrophobicContact CH2-CZ 3.8Å; W798-F875 HydrophobicContact CZ3-CZ 4.02Å; F812-F875 HydrophobicContact CE1-CD2 4.3Å; E814-F875 VanDerWaalsContact O-CA 3.27Å; E814-F875 WeakPolarHBondContact O-CA 3.25Å; E814-F875 WeakPolarHBondContact O-CB 3.36Å; F815-F875 HydrophobicContact CD2-CB 3.68Å; F815-F875 HydrophobicContact CD2-CG 4.47Å; F815-F875 HydrophobicContact CE2-CB 4.25Å; I817-F875 HydrophobicContact CD1-CD1 3.95Å; L828-F875 HydrophobicContact CD1-CE1 4.17Å; L828-F875 HydrophobicContact CD1-CZ 3.9Å; L828-F875 HydrophobicContact CD2-CD1 4.34Å; L828-F875 HydrophobicContact CD2-CD2 4.33Å; L828-F875 HydrophobicContact CD2-CE1 4.12Å; L828-F875 HydrophobicContact CD2-CE2 4.11Å; L828-F875 HydrophobicContact CD2-CG 4.45Å; L828-F875 HydrophobicContact CD2-CZ 4Å; F864-F875 HydrophobicContact CB-CE1 4.11Å; F864-F875 HydrophobicContact CB-CZ 4.39Å; F864-F875 AromaticContact CD2-CE1 3.89Å; F864-F875 HydrophobicContact CD2-CE1 3.89Å; F864-F875 AromaticContact CG-CE1 3.94Å; F864-F875 HydrophobicContact CG-CE1 3.94Å
876	Q	93.8	Very high	89.6	Confident	43 Å²	43	43.8 Å²	43.8	20%	0.201	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.5	159.8	179.1	-177	60.4	0	0	107.4	F780 I781 T782 W786 N813 E814	F780-Q876 HydrophobicContact CD1-CG 4.35Å; I781-Q876 WeakPolarHBondContact O-CA 3.4Å; T782-Q876 HydrophobicContact CG2-CB 4.11Å; T782-Q876 HydrophobicContact CG2-CG 3.95Å; W786-Q876 HydrophobicContact CD2-CB 4.05Å; W786-Q876 HydrophobicContact CE3-CB 4.41Å; W786-Q876 HydrophobicContact CH2-CB 4.13Å; W786-Q876 VanDerWaalsContact CH2-CD 3.45Å; W786-Q876 HydrophobicContact CH2-CG 4.32Å; W786-Q876 HydrophobicContact CZ2-CB 3.72Å; W786-Q876 HydrophobicContact CZ2-CG 4.39Å; W786-Q876 HydrophobicContact CZ3-CB 4.45Å; W786-Q876 HydrophobicContact CZ3-CG 4.5Å; N813-Q876 HydrophobicContact CB-CG 4.39Å; N813-Q876 PolarHBondContact N-O 3.39Å; E814-Q876 PolarHBondContact N-O 3.43Å; E814-Q876 VanDerWaalsContact N-O 3.12Å; E814-Q876 PolarHBondContact O-N 2.74Å
877	A	93	Very high	89.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	141.7	174.6	0	0	0	0	0	110.2	F780 I781 L810 T811 F812	F780-A877 CarbonylContact C-O 3.56Å; F780-A877 WeakPolarHBondContact CA-O 3.28Å; I781-A877 PolarHBondContact N-O 3.5Å; I781-A877 PolarHBondContact O-N 2.81Å; L810-A877 HydrophobicContact CD1-CB 3.7Å; L810-A877 HydrophobicContact CG-CB 4.16Å; T811-A877 CarbonylContact O-C 3.53Å; T811-A877 VanDerWaalsContact O-CA 3.29Å; T811-A877 WeakPolarHBondContact O-CA 3.42Å; F812-A877 HydrophobicContact CD1-CB 3.71Å; F812-A877 HydrophobicContact CE1-CB 3.86Å; F812-A877 HydrophobicContact CG-CB 4.3Å
878	T	94.3	Very high	89.3	Confident	36 Å²	36	46.6 Å²	46.6	22%	0.221	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.9	167.7	-52	0	0	0	0	108.4	G779 F780 T811 N813	G779-T878 CarbonylContact O-C 3.36Å; G779-T878 WeakPolarHBondContact O-CA 3.13Å; G779-T878 WeakPolarHBondContact O-CG2 3.45Å; F780-T878 HydrophobicContact CE1-CG2 4.32Å; F780-T878 VanDerWaalsContact CE1-OG1 3.26Å; F780-T878 WeakPolarHBondContact CE1-OG1 3.48Å; T811-T878 PolarHBondContact N-O 3.05Å; T811-T878 PolarHBondContact O-N 2.9Å; N813-T878 PolarHBondContact ND2-OG1 3.21Å; N813-T878 PolarHBondContact OD1-N 2.76Å; N813-T878 VanDerWaalsContact OD1-N 3.09Å; N813-T878 PolarHBondContact OD1-OG1 3Å
879	H	93.4	Very high	89.3	Confident	5 Å²	5	44 Å²	44	2%	0.023	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	143.7	165	80.8	-89.4	0	0	0	109.7	I774 S776 N778 G779 I781 I800 K809 L810	I774-H879 WeakPolarHBondContact CG2-CE1 3.25Å; I774-H879 VanDerWaalsContact CG2-NE2 3.33Å; I774-H879 WeakPolarHBondContact CG2-NE2 3.47Å; S776-H879 PolarHBondContact O-NE2 3.21Å; S776-H879 PolarHBondContact OG-CE1 2.8Å; S776-H879 PolarHBondContact OG-NE2 3.12Å; N778-H879 VanDerWaalsContact C-NE2 3.3Å; N778-H879 CarbonylContact C-O 3.55Å; N778-H879 WeakPolarHBondContact CA-O 3.21Å; N778-H879 PolarHBondContact O-CE1 2.68Å; N778-H879 PolarHBondContact O-NE2 2.83Å; G779-H879 VanDerWaalsContact CA-CE1 3.42Å; G779-H879 WeakPolarHBondContact CA-CE1 3.1Å; G779-H879 PolarHBondContact N-CE1 2.71Å; G779-H879 VanDerWaalsContact N-CE1 3.31Å; G779-H879 PolarHBondContact N-O 3.45Å; G779-H879 PolarHBondContact O-N 2.82Å; G779-H879 PolarHBondContact O-ND1 2.68Å; I781-H879 HydrophobicContact CD1-CB 4.12Å; I800-H879 HydrophobicContact CD1-CB 4.15Å; K809-H879 CarbonylContact O-C 3.59Å; K809-H879 VanDerWaalsContact O-CA 3.31Å; K809-H879 WeakPolarHBondContact O-CA 3.37Å; L810-H879 HydrophobicContact CD1-CB 4.34Å
880	S	91.4	Very high	89.5	Confident	35 Å²	35	45 Å²	45	25%	0.245	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	148.9	177.7	61	0	0	0	0	111.1	P777 K809	P777-S880 CarbonylContact O-C 3.48Å; P777-S880 WeakPolarHBondContact O-CA 3.41Å; K809-S880 PolarHBondContact N-O 3.35Å; K809-S880 PolarHBondContact O-N 2.02Å
881	T	89.3	Confident	89.5	Confident	36 Å²	36	47.2 Å²	47.2	22%	0.221	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	125.4	168	49.7	0	0	0	0	110.6	P777 A802 Q806 R807 A900	P777-T881 HydrophobicContact CB-CG2 4.17Å; P777-T881 WeakPolarHBondContact O-CG2 3.45Å; P777-T881 PolarHBondContact O-N 3.46Å; P777-T881 PolarHBondContact O-OG1 3.03Å; A802-T881 HydrophobicContact CB-CG2 3.53Å; Q806-T881 HydrophobicContact CB-CG2 4.49Å; R807-T881 CarbonylContact O-C 3.57Å; R807-T881 VanDerWaalsContact O-CA 3.3Å; R807-T881 WeakPolarHBondContact O-CA 3.33Å; T881-A900 HydrophobicContact CG2-CB 3.89Å; T881-A900 WeakPolarHBondContact OG1-CB 3.27Å
882	E	86.8	Confident	89.5	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.271	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	145.7	164	-72.4	-170.6	154.7	0	0	110.3	R807 K809 I854	R807-E882 PolarHBondContact N-O 2.97Å; R807-E882 PolarHBondContact O-N 2.87Å; K809-E882 HydrophobicContact CB-CG 4.14Å; K809-E882 HydrophobicContact CD-CG 3.9Å; K809-E882 WeakPolarHBondContact CD-OE1 3.02Å; K809-E882 WeakPolarHBondContact CD-OE2 3.48Å; K809-E882 WeakPolarHBondContact CE-OE1 3.33Å; K809-E882 IonicContact NZ-OE1 2.72Å; K809-E882 PolarHBondContact NZ-OE1 2.86Å; I854-E882 WeakPolarHBondContact CD1-OE2 3.26Å
883	C	87.4	Confident	89.3	Confident	39 Å²	39	50.8 Å²	50.8	26%	0.264	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-82.9	172.8	175.6	63.9	0	0	0	0	112.2	Q806 C913 W915	Q806-C883 VanDerWaalsContact OE1-CA 3.25Å; C883-C913 HydrophobicContact CB-CB 3.63Å; C883-C913 WeakPolarHBondContact CB-SG 3.35Å; C883-C913 VanDerWaalsContact SG-CA 3.58Å; C883-C913 WeakPolarHBondContact SG-CB 3.49Å; C883-C913 CovalentContact SG-SG 2.03Å; C883-C913 PolarHBondContact SG-SG 2.88Å; C883-W915 HydrophobicContact CB-CH2 4.2Å; C883-W915 HydrophobicContact CB-CZ2 3.76Å
884	G	84.3	Confident	89.4	Confident	4 Å²	4	49.2 Å²	49.2	4%	0.041	25%	0.251	C	S	.	.			trans	76.5	178.2	-176.4	0	0	0	0	0	114.2	R807 D914 W915	R807-G884 WeakPolarHBondContact CD-O 3.36Å; R807-G884 WeakPolarHBondContact CG-O 3.37Å; G884-D914 CarbonylContact C-O 3.28Å; G884-D914 WeakPolarHBondContact CA-O 3.47Å; G884-W915 VanDerWaalsContact CA-CD1 3.48Å; G884-W915 VanDerWaalsContact N-CE2 3.31Å; G884-W915 VanDerWaalsContact N-NE1 3.19Å
885	G	84.6	Confident	89.3	Confident	16 Å²	16	51.3 Å²	51.3	17%	0.165	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	135.8	177.6	179.5	0	0	0	0	0	114.6	D914 W915 L916	G885-D914 PolarHBondContact N-O 3.08Å; G885-W915 CarbonylContact O-C 3.57Å; G885-W915 WeakPolarHBondContact O-CA 3.43Å; G885-L916 PolarHBondContact O-N 2.73Å
886	R	86.2	Confident	89.2	Confident	168 Å²	168	51.3 Å²	51.3	63%	0.634	26%	0.262	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	110.3	177.6	-172.9	178.1	-173.9	143.3	4.3	110.3	L916 V918	R886-L916 CarbonylContact C-O 3.53Å; R886-L916 WeakPolarHBondContact CA-O 3.08Å; R886-L916 HydrophobicContact CG-CD2 4.44Å; R886-V918 HydrophobicContact CG-CG2 4.35Å
887	L	88.7	Confident	89.1	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.11	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.9	-175.8	-51.9	178.8	0	0	0	111	L896 L916 L917 V918	L887-L896 HydrophobicContact CD1-CD1 4.04Å; L887-L916 PolarHBondContact N-O 3.46Å; L887-L917 HydrophobicContact CB-CD2 3.77Å; L887-L917 HydrophobicContact CD1-CD2 3.81Å; L887-L917 HydrophobicContact CG-CD2 4.22Å; L887-L917 WeakPolarHBondContact O-CA 3.18Å; L887-V918 PolarHBondContact O-N 2.66Å
888	K	87.9	Confident	89	Confident	98 Å²	98	51.7 Å²	51.7	43%	0.426	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	119.2	175.5	-168.9	-177.7	179.1	-172.3	0	111.2	K894 E920	K888-K894 PolarHBondContact O-NZ 2.8Å; K888-E920 WeakPolarHBondContact CE-OE1 3.36Å; K888-E920 IonicContact NZ-OE1 2.9Å; K888-E920 PolarHBondContact NZ-OE1 2.86Å
889	A	87.5	Confident	88.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.			trans	-77.3	130.9	169	0	0	0	0	0	109.9	V918 A919 V925 Y996	A889-V918 PolarHBondContact N-O 3.45Å; A889-A919 HydrophobicContact CB-CB 4.4Å; A889-V925 HydrophobicContact CB-CG2 4.28Å; A889-Y996 HydrophobicContact CB-CD2 4.01Å; A889-Y996 HydrophobicContact CB-CE2 4.22Å
890	E	89.1	Confident	88.4	Confident	74 Å²	74	50.9 Å²	50.9	35%	0.346	26%	0.258	S	S	.	.			trans	-124	167.1	-178.9	-78.5	165.8	-149.4	0	0	110.2	K892 K894 R997 S998	E890-K892 PolarHBondContact O-N 2.82Å; E890-K892 VanDerWaalsContact O-O 3.14Å; E890-K894 VanDerWaalsContact CD-CE 3.42Å; E890-K894 IonicContact OE1-NZ 2.7Å; E890-K894 PolarHBondContact OE1-NZ 2.84Å; E890-K894 WeakPolarHBondContact OE2-CE 3.5Å; E890-K894 IonicContact OE2-NZ 2.73Å; E890-K894 PolarHBondContact OE2-NZ 2.95Å; E890-R997 CarbonylContact O-C 3.55Å; E890-R997 WeakPolarHBondContact O-CA 3.41Å; E890-R997 WeakPolarHBondContact O-CB 3.09Å; E890-S998 PolarHBondContact O-N 2.97Å
891	T	86.5	Confident	88.1	Confident	113 Å²	113	53 Å²	53	69%	0.693	26%	0.264	S	S	*	.	S	Bend	trans	-63.7	-24.2	176.8	52.2	0	0	0	0	113.1
892	K	88.5	Confident	87.9	Confident	155 Å²	155	53 Å²	53	67%	0.674	26%	0.262	S	S	*	.	S	Bend	trans	-81.3	133.2	167.3	-69.2	-176.5	177.9	-179.6	0	109.6	E890	E890-K892 PolarHBondContact O-N 2.82Å; E890-K892 VanDerWaalsContact O-O 3.14Å
893	P	89.1	Confident	87.5	Confident	73 Å²	73	52.8 Å²	52.8	47%	0.474	28%	0.275	S	S	.	.			trans	-62.3	140.4	175.3	26.9	-33.5	0	0	0	111.2	R995 Y996 R997	P893-R995 HydrophobicContact CB-CG 3.72Å; P893-Y996 WeakPolarHBondContact CA-O 3.35Å; P893-R997 HydrophobicContact CB-CB 4.49Å
894	K	89.6	Confident	87.2	Confident	59 Å²	59	57.9 Å²	57.9	26%	0.257	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.6	172.8	-68	-179.2	-178.7	177.1	0	109.3	K888 E890 R995 Y996	K888-K894 PolarHBondContact O-NZ 2.8Å; E890-K894 VanDerWaalsContact CD-CE 3.42Å; E890-K894 IonicContact OE1-NZ 2.7Å; E890-K894 PolarHBondContact OE1-NZ 2.84Å; E890-K894 WeakPolarHBondContact OE2-CE 3.5Å; E890-K894 IonicContact OE2-NZ 2.73Å; E890-K894 PolarHBondContact OE2-NZ 2.95Å; K894-R995 CarbonylContact O-C 3.57Å; K894-R995 WeakPolarHBondContact O-CA 3.22Å; K894-Y996 HydrophobicContact CB-CD1 4.13Å; K894-Y996 HydrophobicContact CB-CE1 3.55Å; K894-Y996 HydrophobicContact CB-CE2 4.1Å; K894-Y996 HydrophobicContact CD-CE2 4.31Å; K894-Y996 PolarHBondContact N-O 3.11Å; K894-Y996 VanDerWaalsContact O-CD1 3.24Å; K894-Y996 WeakPolarHBondContact O-CD1 3.49Å; K894-Y996 PolarHBondContact O-N 3.21Å
895	D	90.7	Very high	87.3	Confident	44 Å²	44	61.6 Å²	61.6	24%	0.235	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	140.3	-179.2	-62.4	-65.6	0	0	0	110.6	P804 Y897 H993 I994 R995	P804-D895 WeakPolarHBondContact CB-O 3.43Å; D895-Y897 HydrophobicContact CB-CE2 3.86Å; D895-H993 IonicContact OD1-CD2 2.8Å; D895-H993 IonicContact OD1-CE1 2.77Å; D895-H993 IonicContact OD1-NE2 3.66Å; D895-H993 PolarHBondContact OD1-NE2 3.49Å; D895-I994 CarbonylContact C-O 3.38Å; D895-I994 WeakPolarHBondContact CA-O 3.31Å; D895-R995 IonicContact OD1-CZ 2.72Å; D895-R995 VanDerWaalsContact OD1-CZ 3.25Å; D895-R995 IonicContact OD1-NE 3.25Å; D895-R995 PolarHBondContact OD1-NE 2.9Å; D895-R995 IonicContact OD1-NH2 2.68Å; D895-R995 PolarHBondContact OD1-NH2 2.57Å; D895-R995 IonicContact OD2-NH2 2.74Å; D895-R995 PolarHBondContact OD2-NH2 2.93Å
896	L	91.1	Very high	87.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.5	176.5	168.9	63	0	0	0	108.2	L887 W915 L917 L979 H993 I994 Y996	L887-L896 HydrophobicContact CD1-CD1 4.04Å; L896-W915 HydrophobicContact CD1-CD2 4.26Å; L896-W915 HydrophobicContact CD1-CG 4.18Å; L896-W915 HydrophobicContact CD1-CZ2 4.45Å; L896-W915 HydrophobicContact CD2-CG 4.41Å; L896-L917 HydrophobicContact CD2-CD2 4.48Å; L896-L979 HydrophobicContact CD2-CD1 4.19Å; L896-H993 WeakPolarHBondContact O-CA 3.08Å; L896-I994 HydrophobicContact CB-CB 4.41Å; L896-I994 PolarHBondContact N-O 2.64Å; L896-I994 PolarHBondContact O-N 3.12Å; L896-Y996 HydrophobicContact CB-CD1 4.08Å; L896-Y996 HydrophobicContact CB-CE1 4.01Å
897	Y	91.3	Very high	87.7	Confident	49 Å²	49	56.3 Å²	56.3	19%	0.192	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	142.4	-178.2	-58.9	-81.8	0	0	0	110.7	T803 P804 Q806 D895 H899 F902 H993	T803-Y897 HydrophobicContact CG2-CD2 3.7Å; T803-Y897 HydrophobicContact CG2-CE2 4.44Å; T803-Y897 HydrophobicContact CG2-CG 4.12Å; P804-Y897 HydrophobicContact CB-CD2 4.45Å; P804-Y897 HydrophobicContact CB-CE2 4.36Å; P804-Y897 HydrophobicContact CG-CE2 4.38Å; Q806-Y897 PolarHBondContact NE2-O 3.27Å; D895-Y897 HydrophobicContact CB-CE2 3.86Å; Y897-H899 PolarHBondContact O-N 3.03Å; Y897-F902 HydrophobicContact CD1-CB 4.22Å; Y897-F902 AromaticContact CD1-CD1 3.38Å; Y897-F902 HydrophobicContact CD1-CD1 3.38Å; Y897-F902 AromaticContact CD1-CE1 3.92Å; Y897-F902 HydrophobicContact CD1-CE1 3.92Å; Y897-F902 AromaticContact CD1-CG 3.88Å; Y897-F902 HydrophobicContact CD1-CG 3.88Å; Y897-F902 AromaticContact CE1-CD1 3.91Å; Y897-F902 HydrophobicContact CE1-CD1 3.91Å; Y897-F902 HydrophobicContact CE1-CE1 4.2Å; Y897-F902 HydrophobicContact CG-CB 4.45Å; Y897-F902 HydrophobicContact CG-CD1 4.38Å; Y897-H993 HydrophobicContact CD1-CB 3.87Å; Y897-H993 AromaticContact CD1-CD2 3.81Å; Y897-H993 AromaticContact CD1-CG 3.87Å; Y897-H993 HydrophobicContact CE1-CB 3.92Å; Y897-H993 AromaticContact CE1-CD2 3.35Å; Y897-H993 WeakPolarHBondContact CE1-CD2 3.29Å; Y897-H993 AromaticContact CE1-CG 3.44Å; Y897-H993 VanDerWaalsContact CE1-CG 3.44Å; Y897-H993 AromaticContact CE1-ND1 3.92Å; Y897-H993 AromaticContact CE1-NE2 3.81Å; Y897-H993 AromaticContact CZ-CD2 3.79Å; Y897-H993 AromaticContact CZ-NE2 3.87Å
898	S	90.6	Very high	87.7	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.014	32%	0.315	C	S	.	.	S	Bend	trans	-57.8	-35.2	-177.4	63.2	0	0	0	0	113.6	Q806 W915 F992	Q806-S898 PolarHBondContact NE2-O 3.26Å; S898-W915 WeakPolarHBondContact O-CH2 3.42Å; S898-F992 VanDerWaalsContact CB-CD1 3.49Å; S898-F992 PolarHBondContact N-O 3.44Å; S898-F992 PolarHBondContact OG-N 2.94Å
899	H	90.3	Very high	87.8	Confident	9 Å²	9	56.9 Å²	56.9	4%	0.042	31%	0.313	C	S	.	.	S	Bend	trans	-149.8	166.2	-179.5	66.2	-69.4	0	0	0	110.9	Y897 Q901 F902 N905 N906 P908 K990	Y897-H899 PolarHBondContact O-N 3.03Å; H899-Q901 PolarHBondContact O-N 3.14Å; H899-F902 VanDerWaalsContact CE1-CA 3.44Å; H899-F902 WeakPolarHBondContact CE1-CA 3.47Å; H899-F902 AromaticContact CE1-CD2 3.89Å; H899-F902 PolarHBondContact NE2-N 2.82Å; H899-F902 WeakPolarHBondContact O-CB 3.26Å; H899-F902 PolarHBondContact O-N 2.62Å; H899-N905 PolarHBondContact NE2-O 3.28Å; H899-N906 PolarHBondContact NE2-O 3.18Å; H899-P908 HydrophobicContact CB-CG 4.45Å; H899-K990 PolarHBondContact CE1-O 2.69Å
900	A	85.9	Confident	87.8	Confident	15 Å²	15	63.8 Å²	63.8	12%	0.124	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-27.8	-172.4	0	0	0	0	0	114.7	P777 T803 Q806 T881	P777-A900 HydrophobicContact CB-CB 3.77Å; T803-A900 PolarHBondContact OG1-O 3.13Å; Q806-A900 HydrophobicContact CG-CB 4.16Å; T881-A900 HydrophobicContact CG2-CB 3.89Å; T881-A900 WeakPolarHBondContact OG1-CB 3.27Å
901	Q	85.6	Confident	87.8	Confident	79 Å²	79	61 Å²	61	37%	0.369	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	21.6	-179.7	-64.6	-174.8	-54.4	0	0	113.6	P777 H899 G903 D904 N905	P777-Q901 HydrophobicContact CB-CG 4.36Å; P777-Q901 HydrophobicContact CG-CG 3.8Å; H899-Q901 PolarHBondContact O-N 3.14Å; Q901-G903 PolarHBondContact O-N 3.02Å; Q901-G903 VanDerWaalsContact O-N 3.12Å; Q901-D904 PolarHBondContact O-N 3.44Å; Q901-N905 HydrophobicContact CB-CB 4.06Å; Q901-N905 VanDerWaalsContact CD-ND2 3.33Å; Q901-N905 PolarHBondContact O-N 2.04Å; Q901-N905 VanDerWaalsContact O-N 3.1Å; Q901-N905 PolarHBondContact OE1-ND2 2.87Å
902	F	84.8	Confident	88	Confident	37 Å²	37	60.3 Å²	60.3	16%	0.162	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-57.8	117.2	-177.3	179.4	-87.3	0	0	0	111.8	Y897 H899 T931 K990 F992 H993	Y897-F902 HydrophobicContact CD1-CB 4.22Å; Y897-F902 AromaticContact CD1-CD1 3.38Å; Y897-F902 HydrophobicContact CD1-CD1 3.38Å; Y897-F902 AromaticContact CD1-CE1 3.92Å; Y897-F902 HydrophobicContact CD1-CE1 3.92Å; Y897-F902 AromaticContact CD1-CG 3.88Å; Y897-F902 HydrophobicContact CD1-CG 3.88Å; Y897-F902 AromaticContact CE1-CD1 3.91Å; Y897-F902 HydrophobicContact CE1-CD1 3.91Å; Y897-F902 HydrophobicContact CE1-CE1 4.2Å; Y897-F902 HydrophobicContact CG-CB 4.45Å; Y897-F902 HydrophobicContact CG-CD1 4.38Å; H899-F902 VanDerWaalsContact CE1-CA 3.44Å; H899-F902 WeakPolarHBondContact CE1-CA 3.47Å; H899-F902 AromaticContact CE1-CD2 3.89Å; H899-F902 PolarHBondContact NE2-N 2.82Å; H899-F902 WeakPolarHBondContact O-CB 3.26Å; H899-F902 PolarHBondContact O-N 2.62Å; F902-T931 HydrophobicContact CZ-CG2 4.02Å; F902-K990 WeakPolarHBondContact CD2-O 3.33Å; F902-K990 HydrophobicContact CE2-CG 4.34Å; F902-K990 WeakPolarHBondContact CE2-O 3.25Å; F902-F992 VanDerWaalsContact CE2-C 3.48Å; F902-F992 WeakPolarHBondContact CE2-O 3.44Å; F902-H993 HydrophobicContact CD1-CB 4.5Å; F902-H993 HydrophobicContact CE1-CB 3.7Å; F902-H993 HydrophobicContact CZ-CB 3.71Å
903	G	78.9	Confident	88.2	Confident	54 Å²	54	53.1 Å²	53.1	56%	0.557	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.7	-32.3	-177.9	0	0	0	0	0	113.5	Q901	Q901-G903 PolarHBondContact O-N 3.02Å; Q901-G903 VanDerWaalsContact O-N 3.12Å
904	D	80.7	Confident	88.3	Confident	145 Å²	145	52.6 Å²	52.6	78%	0.775	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-36.8	176	-63.6	-41.3	0	0	0	111.8	Q901	Q901-D904 PolarHBondContact O-N 3.44Å
905	N	86	Confident	88.5	Confident	82 Å²	82	49.8 Å²	49.8	44%	0.439	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-129.4	170.8	-178.7	-75.9	-30.7	0	0	0	112.2	H899 Q901	H899-N905 PolarHBondContact NE2-O 3.28Å; Q901-N905 HydrophobicContact CB-CB 4.06Å; Q901-N905 VanDerWaalsContact CD-ND2 3.33Å; Q901-N905 PolarHBondContact O-N 2.04Å; Q901-N905 VanDerWaalsContact O-N 3.1Å; Q901-N905 PolarHBondContact OE1-ND2 2.87Å
906	N	89.8	Confident	88.6	Confident	73 Å²	73	48.9 Å²	48.9	39%	0.39	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-76.6	161	163.2	-73.6	-6.5	0	0	0	111	H899 N988 K989 K990	H899-N906 PolarHBondContact NE2-O 3.18Å; N906-N988 HydrophobicContact CB-CB 4.15Å; N906-N988 WeakPolarHBondContact CB-OD1 3.47Å; N906-N988 PolarHBondContact ND2-O 2.92Å; N906-N988 PolarHBondContact ND2-OD1 2.9Å; N906-N988 VanDerWaalsContact ND2-OD1 3.1Å; N906-K989 CarbonylContact C-O 3.6Å; N906-K989 WeakPolarHBondContact CA-O 3.49Å; N906-K989 WeakPolarHBondContact CB-O 3.11Å; N906-K989 VanDerWaalsContact OD1-C 3.25Å; N906-K989 PolarHBondContact OD1-O 2.9Å; N906-K990 PolarHBondContact OD1-N 2.92Å
907	Y	90	Very high	88.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-63.9	150.4	176.2	52.1	-102.8	0	0	0	112.6	E935 D943 F981 T983 N988 K989	Y907-E935 PolarHBondContact OH-N 2.87Å; Y907-E935 VanDerWaalsContact OH-N 3.08Å; Y907-D943 WeakPolarHBondContact CE2-OD2 3.39Å; Y907-D943 PolarHBondContact OH-OD2 3Å; Y907-F981 AromaticContact CD1-CZ 3.97Å; Y907-F981 HydrophobicContact CD1-CZ 3.97Å; Y907-F981 AromaticContact CD2-CZ 3.95Å; Y907-F981 HydrophobicContact CD2-CZ 3.95Å; Y907-F981 HydrophobicContact CE1-CZ 4.3Å; Y907-F981 HydrophobicContact CE2-CZ 4.28Å; Y907-F981 HydrophobicContact CG-CE1 4.22Å; Y907-F981 AromaticContact CG-CZ 3.79Å; Y907-F981 HydrophobicContact CG-CZ 3.79Å; Y907-T983 HydrophobicContact CD2-CG2 3.55Å; Y907-T983 HydrophobicContact CE2-CG2 3.53Å; Y907-T983 HydrophobicContact CG-CG2 4.48Å; Y907-N988 HydrophobicContact CD2-CB 3.75Å; Y907-N988 HydrophobicContact CE2-CB 3.58Å; Y907-N988 HydrophobicContact CG-CB 4.48Å; Y907-N988 VanDerWaalsContact O-CB 3.25Å; Y907-N988 WeakPolarHBondContact O-CB 3.12Å; Y907-N988 PolarHBondContact O-ND2 2.97Å; Y907-K989 WeakPolarHBondContact CD1-O 3.45Å; Y907-K989 HydrophobicContact CE1-CB 3.94Å; Y907-K989 VanDerWaalsContact CE1-N 3.35Å; Y907-K989 WeakPolarHBondContact CE1-O 3.25Å; Y907-K989 PolarHBondContact N-O 3.17Å; Y907-K989 PolarHBondContact OH-N 3.26Å
908	P	88.6	Confident	88.7	Confident	68 Å²	68	47.5 Å²	47.5	44%	0.442	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64.6	143.6	174.2	26.9	-34	0	0	0	111.4	H899 A911 T983	H899-P908 HydrophobicContact CB-CG 4.45Å; P908-A911 HydrophobicContact CG-CB 4.08Å; P908-T983 PolarHBondContact O-OG1 2.86Å
909	V	89.5	Confident	88.7	Confident	64 Å²	64	47.8 Å²	47.8	39%	0.388	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	158.1	168.3	-63.9	0	0	0	0	111	A911 D984 T986 N988	V909-A911 PolarHBondContact O-N 2.84Å; V909-A911 VanDerWaalsContact O-N 3.15Å; V909-D984 CarbonylContact C-O 3.5Å; V909-D984 WeakPolarHBondContact CA-O 3.42Å; V909-D984 WeakPolarHBondContact CB-O 3.4Å; V909-T986 WeakPolarHBondContact CG1-O 3.38Å; V909-N988 HydrophobicContact CG1-CB 4.28Å
910	Q	88.3	Confident	88.6	Confident	145 Å²	145	52.8 Å²	52.8	68%	0.678	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	23.1	-179.6	-56.8	-176.1	-25.9	0	0	114.7	T983 D984 D985	Q910-T983 WeakPolarHBondContact CA-O 3.49Å; Q910-T983 PolarHBondContact N-OG1 2.91Å; Q910-D984 PolarHBondContact N-O 2.77Å; Q910-D985 HydrophobicContact CG-CB 3.86Å
911	A	88.3	Confident	88.4	Confident	15 Å²	15	62.8 Å²	62.8	12%	0.124	33%	0.329	C	S	.	.			trans	-82.4	128.1	174.5	0	0	0	0	0	111.3	P908 V909 H982 T983	P908-A911 HydrophobicContact CG-CB 4.08Å; V909-A911 PolarHBondContact O-N 2.84Å; V909-A911 VanDerWaalsContact O-N 3.15Å; A911-H982 CarbonylContact O-C 3.55Å; A911-H982 WeakPolarHBondContact O-CA 3.4Å; A911-T983 WeakPolarHBondContact CA-OG1 3.25Å; A911-T983 WeakPolarHBondContact CB-OG1 3.42Å; A911-T983 PolarHBondContact N-OG1 3.41Å; A911-T983 PolarHBondContact O-N 3.27Å; A911-T983 PolarHBondContact O-OG1 2.93Å; A911-T983 VanDerWaalsContact O-OG1 3.11Å
912	D	91.3	Very high	88.3	Confident	98 Å²	98	61.1 Å²	61.1	52%	0.524	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	113.1	167.8	-178.1	0.9	0	0	0	108.5	H980 F981	D912-H980 IonicContact OD1-CE1 2.63Å; D912-H980 PolarHBondContact OD1-CE1 3.35Å; D912-H980 IonicContact OD1-ND1 3.9Å; D912-H980 PolarHBondContact OD1-ND1 2.99Å; D912-H980 VanDerWaalsContact OD1-ND1 3.07Å; D912-F981 WeakPolarHBondContact CA-O 3.22Å
913	C	91.8	Very high	88.5	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.027	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	116.8	-167	-57.9	0	0	0	0	111.8	C883 W915 H980 F981	C883-C913 HydrophobicContact CB-CB 3.63Å; C883-C913 WeakPolarHBondContact CB-SG 3.35Å; C883-C913 VanDerWaalsContact SG-CA 3.58Å; C883-C913 WeakPolarHBondContact SG-CB 3.49Å; C883-C913 CovalentContact SG-SG 2.03Å; C883-C913 PolarHBondContact SG-SG 2.88Å; C913-W915 HydrophobicContact CB-CE3 4.02Å; C913-W915 HydrophobicContact CB-CH2 3.35Å; C913-W915 HydrophobicContact CB-CZ2 4.03Å; C913-W915 HydrophobicContact CB-CZ3 3.34Å; C913-H980 CarbonylContact O-C 3.56Å; C913-H980 WeakPolarHBondContact O-CA 3.2Å; C913-F981 HydrophobicContact CB-CB 4.29Å; C913-F981 PolarHBondContact N-O 3.18Å; C913-F981 PolarHBondContact O-N 2.9Å
914	D	92.3	Very high	89	Confident	62 Å²	62	60.5 Å²	60.5	33%	0.332	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	111.4	179.5	-79.5	-13.6	0	0	0	112.1	G884 G885 K953 L978 L979 H980	G884-D914 CarbonylContact C-O 3.28Å; G884-D914 WeakPolarHBondContact CA-O 3.47Å; G885-D914 PolarHBondContact N-O 3.08Å; D914-K953 VanDerWaalsContact CG-NZ 3.25Å; D914-K953 WeakPolarHBondContact OD1-CE 3.39Å; D914-K953 IonicContact OD1-NZ 3.07Å; D914-K953 PolarHBondContact OD1-NZ 3.05Å; D914-K953 WeakPolarHBondContact OD2-CE 3.4Å; D914-K953 IonicContact OD2-NZ 2.98Å; D914-K953 PolarHBondContact OD2-NZ 2.98Å; D914-L978 HydrophobicContact CB-CD1 4.18Å; D914-L979 CarbonylContact C-O 3.42Å; D914-L979 WeakPolarHBondContact CA-O 3.46Å; D914-H980 WeakPolarHBondContact OD1-CB 3.33Å; D914-H980 IonicContact OD1-CG 3.39Å; D914-H980 IonicContact OD1-ND1 3.52Å; D914-H980 PolarHBondContact OD1-ND1 3.43Å; D914-H980 VanDerWaalsContact OD1-ND1 3.09Å
915	W	93.2	Very high	89.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118.5	173.5	-62.8	-91.1	0	0	0	111.9	G805 C883 G884 G885 L896 S898 C913 L979 F981 F992	G805-W915 VanDerWaalsContact O-CD1 3.31Å; G805-W915 PolarHBondContact O-NE1 2.8Å; C883-W915 HydrophobicContact CB-CH2 4.2Å; C883-W915 HydrophobicContact CB-CZ2 3.76Å; G884-W915 VanDerWaalsContact CA-CD1 3.48Å; G884-W915 VanDerWaalsContact N-CE2 3.31Å; G884-W915 VanDerWaalsContact N-NE1 3.19Å; G885-W915 CarbonylContact O-C 3.57Å; G885-W915 WeakPolarHBondContact O-CA 3.43Å; L896-W915 HydrophobicContact CD1-CD2 4.26Å; L896-W915 HydrophobicContact CD1-CG 4.18Å; L896-W915 HydrophobicContact CD1-CZ2 4.45Å; L896-W915 HydrophobicContact CD2-CG 4.41Å; S898-W915 WeakPolarHBondContact O-CH2 3.42Å; C913-W915 HydrophobicContact CB-CE3 4.02Å; C913-W915 HydrophobicContact CB-CH2 3.35Å; C913-W915 HydrophobicContact CB-CZ2 4.03Å; C913-W915 HydrophobicContact CB-CZ3 3.34Å; W915-L979 HydrophobicContact CB-CB 4.44Å; W915-L979 HydrophobicContact CE3-CD2 3.46Å; W915-L979 VanDerWaalsContact CE3-CD2 3.46Å; W915-L979 HydrophobicContact CZ3-CD2 3.63Å; W915-L979 PolarHBondContact N-O 2.78Å; W915-L979 PolarHBondContact O-N 3.2Å; W915-F981 HydrophobicContact CH2-CB 4.37Å; W915-F981 HydrophobicContact CH2-CD1 4.5Å; W915-F981 HydrophobicContact CZ3-CB 3.74Å; W915-F992 HydrophobicContact CH2-CZ 4.21Å; W915-F992 HydrophobicContact CZ3-CZ 4.05Å
916	L	92.3	Very high	89.8	Confident	26 Å²	26	50.2 Å²	50.2	14%	0.136	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	105.3	174.2	178.3	60.1	0	0	0	110.3	G885 R886 L887 V918 A976 L978	G885-L916 PolarHBondContact O-N 2.73Å; R886-L916 CarbonylContact C-O 3.53Å; R886-L916 WeakPolarHBondContact CA-O 3.08Å; R886-L916 HydrophobicContact CG-CD2 4.44Å; L887-L916 PolarHBondContact N-O 3.46Å; L916-V918 HydrophobicContact CD1-CG2 4.24Å; L916-V918 HydrophobicContact CD2-CG2 4.15Å; L916-V918 HydrophobicContact CG-CG2 3.75Å; L916-A976 HydrophobicContact CD1-CB 4.21Å; L916-L978 HydrophobicContact CB-CD1 4.35Å
917	L	92.2	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.1	174.9	-52.3	-178.1	0	0	0	109.2	L887 L896 V925 L927 A976 V977 Y996	L887-L917 HydrophobicContact CB-CD2 3.77Å; L887-L917 HydrophobicContact CD1-CD2 3.81Å; L887-L917 HydrophobicContact CG-CD2 4.22Å; L887-L917 WeakPolarHBondContact O-CA 3.18Å; L896-L917 HydrophobicContact CD2-CD2 4.48Å; L917-V925 HydrophobicContact CB-CG1 4.45Å; L917-V925 HydrophobicContact CD1-CG1 4.39Å; L917-L927 HydrophobicContact CD1-CD1 4.45Å; L917-L927 HydrophobicContact CD1-CD2 3.4Å; L917-A976 CarbonylContact O-C 3.55Å; L917-A976 WeakPolarHBondContact O-CA 3.42Å; L917-V977 PolarHBondContact N-O 3.46Å; L917-V977 PolarHBondContact O-N 2.82Å; L917-Y996 HydrophobicContact CD1-CD2 4.4Å; L917-Y996 HydrophobicContact CD1-CG 4.33Å; L917-Y996 HydrophobicContact CD2-CD2 4.29Å; L917-Y996 HydrophobicContact CD2-CE2 4.15Å
918	V	91.6	Very high	90	Very high	19 Å²	19	47.5 Å²	47.5	12%	0.115	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	123.9	-178.2	-170.2	0	0	0	0	111	R886 L887 A889 L916 A976	R886-V918 HydrophobicContact CG-CG2 4.35Å; L887-V918 PolarHBondContact O-N 2.66Å; A889-V918 PolarHBondContact N-O 3.45Å; L916-V918 HydrophobicContact CD1-CG2 4.24Å; L916-V918 HydrophobicContact CD2-CG2 4.15Å; L916-V918 HydrophobicContact CG-CG2 3.75Å; V918-A976 HydrophobicContact CG2-CB 4.42Å
919	A	90.6	Very high	90.2	Very high	9 Å²	9	44.9 Å²	44.9	7%	0.074	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-86.5	172.8	173.2	0	0	0	0	0	111.8	A889 C923 V925 E975	A889-A919 HydrophobicContact CB-CB 4.4Å; A919-C923 HydrophobicContact CB-CB 4.12Å; A919-V925 HydrophobicContact CB-CG2 4.02Å; A919-E975 PolarHBondContact N-O 3Å
920	E	88.4	Confident	90.3	Very high	114 Å²	114	45.9 Å²	45.9	53%	0.533	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-80.1	147.6	169.7	-64.4	-172.5	163.6	0	0	111	K888 G922 C923	K888-E920 WeakPolarHBondContact CE-OE1 3.36Å; K888-E920 IonicContact NZ-OE1 2.9Å; K888-E920 PolarHBondContact NZ-OE1 2.86Å; E920-G922 PolarHBondContact O-N 3.05Å; E920-C923 VanDerWaalsContact O-CB 3.29Å; E920-C923 WeakPolarHBondContact O-CB 3.46Å; E920-C923 PolarHBondContact O-N 3.34Å
921	R	83.1	Confident	90.4	Very high	224 Å²	224	40.7 Å²	40.7	85%	0.845	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.9	128.4	-179.4	-78.9	-179.9	174.1	-177.7	0.4	112.1	E975	R921-E975 WeakPolarHBondContact CA-OE2 3.45Å; R921-E975 VanDerWaalsContact CG-OE2 3.26Å; R921-E975 WeakPolarHBondContact CG-OE2 3.43Å
922	G	82.7	Confident	90.6	Very high	44 Å²	44	40.3 Å²	40.3	45%	0.454	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	11.2	-175.3	0	0	0	0	0	114.4	E920 Y1001	E920-G922 PolarHBondContact O-N 3.05Å; G922-Y1001 VanDerWaalsContact C-CD2 3.46Å; G922-Y1001 WeakPolarHBondContact O-CD2 3.47Å; G922-Y1001 PolarHBondContact O-N 3.46Å
923	C	88.2	Confident	90.7	Very high	10 Å²	10	38.9 Å²	38.9	7%	0.068	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	152.2	168.1	-54.9	0	0	0	0	110.9	A919 E920 S998 I999	A919-C923 HydrophobicContact CB-CB 4.12Å; E920-C923 VanDerWaalsContact O-CB 3.29Å; E920-C923 WeakPolarHBondContact O-CB 3.46Å; E920-C923 PolarHBondContact O-N 3.34Å; C923-S998 WeakPolarHBondContact CB-OG 3.01Å; C923-I999 CarbonylContact C-O 3.53Å; C923-I999 WeakPolarHBondContact CA-O 3.41Å; C923-I999 WeakPolarHBondContact CB-O 3.46Å
924	R	90	Very high	90.7	Very high	69 Å²	69	38.7 Å²	38.7	26%	0.26	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	161.3	169	65.9	174.2	-174.8	172.2	8.1	111.1	Y971 S972 S998 I999 Y1001	R924-Y971 VanDerWaalsContact CZ-CD1 3.49Å; R924-S972 WeakPolarHBondContact CB-O 3.47Å; R924-S972 WeakPolarHBondContact CB-OG 3.19Å; R924-S972 VanDerWaalsContact CD-O 3.25Å; R924-S972 WeakPolarHBondContact CD-O 3.28Å; R924-S998 WeakPolarHBondContact O-CA 3.46Å; R924-I999 HydrophobicContact CG-CB 4.42Å; R924-I999 PolarHBondContact N-O 3.35Å; R924-I999 PolarHBondContact O-N 3.16Å; R924-Y1001 HydrophobicContact CB-CE1 4.3Å
925	V	92.3	Very high	90.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.7	173	-174.2	0	0	0	0	109.3	A889 L917 A919 L927 S972 V977 R997	A889-V925 HydrophobicContact CB-CG2 4.28Å; L917-V925 HydrophobicContact CB-CG1 4.45Å; L917-V925 HydrophobicContact CD1-CG1 4.39Å; A919-V925 HydrophobicContact CB-CG2 4.02Å; V925-L927 HydrophobicContact CG1-CD2 3.67Å; V925-L927 HydrophobicContact CG1-CG 4.18Å; V925-S972 PolarHBondContact N-OG 2.64Å; V925-S972 PolarHBondContact O-N 3.14Å; V925-S972 PolarHBondContact O-OG 2.81Å; V925-V977 HydrophobicContact CB-CG2 3.98Å; V925-V977 HydrophobicContact CG1-CG2 4.39Å; V925-V977 HydrophobicContact CG2-CG2 4.39Å; V925-R997 WeakPolarHBondContact CA-O 3.32Å
926	E	92.3	Very high	90.5	Very high	10 Å²	10	43 Å²	43	5%	0.047	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.9	165.2	178.3	-159.5	-91.9	0	0	108.6	I970 Y971 Y996 R997 I999	E926-I970 WeakPolarHBondContact CA-O 3.24Å; E926-Y971 HydrophobicContact CB-CD1 4.05Å; E926-Y971 HydrophobicContact CB-CE1 4.08Å; E926-Y971 HydrophobicContact CG-CD1 3.95Å; E926-Y971 HydrophobicContact CG-CE1 3.59Å; E926-Y971 WeakPolarHBondContact OE1-CE1 3.39Å; E926-Y996 VanDerWaalsContact O-CA 3.26Å; E926-Y996 WeakPolarHBondContact O-CA 3.03Å; E926-R997 HydrophobicContact CB-CG 4.24Å; E926-R997 VanDerWaalsContact CD-NH2 3.31Å; E926-R997 PolarHBondContact N-O 3.43Å; E926-R997 PolarHBondContact O-N 2.92Å; E926-R997 IonicContact OE1-CZ 2.71Å; E926-R997 IonicContact OE1-NE 2.8Å; E926-R997 PolarHBondContact OE1-NE 2.8Å; E926-R997 IonicContact OE1-NH2 3.7Å; E926-R997 PolarHBondContact OE1-NH2 3.1Å; E926-R997 WeakPolarHBondContact OE2-CG 3.39Å; E926-R997 IonicContact OE2-CZ 3.76Å; E926-R997 IonicContact OE2-NE 2.78Å; E926-R997 PolarHBondContact OE2-NE 3.29Å; E926-R997 IonicContact OE2-NH2 3.06Å; E926-R997 PolarHBondContact OE2-NH2 2.98Å; E926-I999 HydrophobicContact CB-CD1 3.58Å; E926-I999 HydrophobicContact CB-CG1 4.17Å; E926-I999 HydrophobicContact CG-CD1 4.09Å; E926-I999 WeakPolarHBondContact OE1-CD1 3.35Å
927	L	92.3	Very high	90.3	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.9	177.4	-54.6	179.6	0	0	0	110	L917 V925 L947 I970 V977 I994 Y996	L917-L927 HydrophobicContact CD1-CD1 4.45Å; L917-L927 HydrophobicContact CD1-CD2 3.4Å; V925-L927 HydrophobicContact CG1-CD2 3.67Å; V925-L927 HydrophobicContact CG1-CG 4.18Å; L927-L947 HydrophobicContact CD1-CD1 4.09Å; L927-L947 HydrophobicContact CD1-CD2 3.93Å; L927-I970 HydrophobicContact CB-CB 4.34Å; L927-I970 PolarHBondContact N-O 3.13Å; L927-I970 PolarHBondContact O-N 2.64Å; L927-V977 HydrophobicContact CD1-CG1 3.96Å; L927-I994 HydrophobicContact CB-CG2 4.31Å; L927-I994 HydrophobicContact CD2-CG2 4.19Å; L927-Y996 VanDerWaalsContact CD2-CB 3.47Å
928	S	91.5	Very high	89.9	Confident	16 Å²	16	48.7 Å²	48.7	11%	0.112	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121.4	174.7	59.7	0	0	0	0	110	Q930 I994 R995	S928-Q930 PolarHBondContact O-N 3.18Å; S928-Q930 PolarHBondContact OG-NE2 3.34Å; S928-I994 WeakPolarHBondContact O-CA 3.18Å; S928-R995 PolarHBondContact N-O 2.84Å; S928-R995 PolarHBondContact O-N 3.32Å; S928-R995 PolarHBondContact OG-O 3.22Å
929	F	92.1	Very high	89.7	Confident	13 Å²	13	54.4 Å²	54.4	6%	0.057	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	119.2	174.9	-73.4	-94.7	0	0	0	109.4	F932 V945 L947 P966 P967 I970 F992 I994	F929-F932 HydrophobicContact CD1-CB 4.23Å; F929-F932 AromaticContact CD1-CD2 3.49Å; F929-F932 HydrophobicContact CD1-CD2 3.49Å; F929-F932 VanDerWaalsContact CD1-CD2 3.49Å; F929-F932 HydrophobicContact CD1-CE2 4.27Å; F929-F932 HydrophobicContact CD1-CG 4.23Å; F929-F932 AromaticContact CE1-CD2 3.47Å; F929-F932 HydrophobicContact CE1-CD2 3.47Å; F929-F932 VanDerWaalsContact CE1-CD2 3.47Å; F929-F932 AromaticContact CE1-CE2 3.79Å; F929-F932 HydrophobicContact CE1-CE2 3.79Å; F929-F932 HydrophobicContact CG-CD2 4.43Å; F929-F932 HydrophobicContact CZ-CD2 4.42Å; F929-F932 HydrophobicContact CZ-CE2 4.45Å; F929-V945 HydrophobicContact CZ-CG1 4.44Å; F929-L947 HydrophobicContact CE2-CD1 4.38Å; F929-P966 HydrophobicContact CB-CB 3.72Å; F929-P966 VanDerWaalsContact O-CB 3.29Å; F929-P966 WeakPolarHBondContact O-CB 3.17Å; F929-P967 HydrophobicContact CD2-CB 4.01Å; F929-P967 HydrophobicContact CD2-CG 3.89Å; F929-P967 HydrophobicContact CE2-CB 4.3Å; F929-P967 HydrophobicContact CE2-CG 4.05Å; F929-P967 HydrophobicContact CG-CG 4.27Å; F929-I970 HydrophobicContact CE2-CD1 4.21Å; F929-F992 HydrophobicContact CD1-CB 4.2Å; F929-F992 HydrophobicContact CE1-CB 4.21Å; F929-F992 HydrophobicContact CE1-CG 4.38Å; F929-I994 HydrophobicContact CD1-CD1 4.05Å; F929-I994 HydrophobicContact CD1-CG1 3.47Å; F929-I994 VanDerWaalsContact CD1-CG1 3.47Å; F929-I994 HydrophobicContact CE1-CD1 3.42Å; F929-I994 VanDerWaalsContact CE1-CD1 3.42Å; F929-I994 HydrophobicContact CE1-CG1 3.41Å; F929-I994 VanDerWaalsContact CE1-CG1 3.41Å; F929-I994 HydrophobicContact CE2-CD1 4.48Å; F929-I994 HydrophobicContact CE2-CG1 4.47Å; F929-I994 HydrophobicContact CG-CG1 4.07Å; F929-I994 HydrophobicContact CZ-CD1 3.67Å; F929-I994 HydrophobicContact CZ-CG1 3.94Å
930	Q	91.1	Very high	89.6	Confident	84 Å²	84	54.9 Å²	54.9	39%	0.393	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	-28.7	176.2	-54.8	-64.1	-67.5	0	0	111.1	S928 H993 R995	S928-Q930 PolarHBondContact O-N 3.18Å; S928-Q930 PolarHBondContact OG-NE2 3.34Å; Q930-H993 PolarHBondContact N-O 3.12Å; Q930-R995 HydrophobicContact CG-CB 3.95Å
931	T	90.2	Very high	89.5	Confident	37 Å²	37	51.6 Å²	51.6	23%	0.227	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	140.8	172.6	-62.5	0	0	0	0	107.7	F902 K990 F992 H993	F902-T931 HydrophobicContact CZ-CG2 4.02Å; T931-K990 HydrophobicContact CG2-CD 4.41Å; T931-F992 VanDerWaalsContact O-CA 3.24Å; T931-F992 WeakPolarHBondContact O-CA 3.03Å; T931-H993 PolarHBondContact N-O 3.03Å; T931-H993 PolarHBondContact O-N 2.81Å
932	F	93.4	Very high	89.8	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	107.7	178.3	-170.9	-94.3	0	0	0	109.2	F929 V934 V945 F961 G965 F992	F929-F932 HydrophobicContact CD1-CB 4.23Å; F929-F932 AromaticContact CD1-CD2 3.49Å; F929-F932 HydrophobicContact CD1-CD2 3.49Å; F929-F932 VanDerWaalsContact CD1-CD2 3.49Å; F929-F932 HydrophobicContact CD1-CE2 4.27Å; F929-F932 HydrophobicContact CD1-CG 4.23Å; F929-F932 AromaticContact CE1-CD2 3.47Å; F929-F932 HydrophobicContact CE1-CD2 3.47Å; F929-F932 VanDerWaalsContact CE1-CD2 3.47Å; F929-F932 AromaticContact CE1-CE2 3.79Å; F929-F932 HydrophobicContact CE1-CE2 3.79Å; F929-F932 HydrophobicContact CG-CD2 4.43Å; F929-F932 HydrophobicContact CZ-CD2 4.42Å; F929-F932 HydrophobicContact CZ-CE2 4.45Å; F932-V934 HydrophobicContact CD2-CG2 4.33Å; F932-V934 HydrophobicContact CE1-CB 4.24Å; F932-V934 HydrophobicContact CE1-CG2 4.09Å; F932-V934 HydrophobicContact CE2-CG2 3.8Å; F932-V934 HydrophobicContact CZ-CB 4.12Å; F932-V934 HydrophobicContact CZ-CG2 3.64Å; F932-V945 HydrophobicContact CE2-CB 4.19Å; F932-V945 HydrophobicContact CE2-CG2 3.87Å; F932-V945 HydrophobicContact CZ-CG2 4.44Å; F932-F961 HydrophobicContact CE1-CB 4.21Å; F932-F961 HydrophobicContact CE2-CB 4.22Å; F932-F961 HydrophobicContact CZ-CB 3.59Å; F932-G965 WeakPolarHBondContact CD1-O 3.26Å; F932-G965 PolarHBondContact O-N 3.26Å; F932-F992 HydrophobicContact CD2-CB 3.77Å; F932-F992 HydrophobicContact CE2-CB 4.4Å
933	E	92.3	Very high	90.3	Very high	68 Å²	68	44.4 Å²	44.4	32%	0.318	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	83.2	-179.6	-67.9	174.8	-132	0	0	107.5	K989 K990 G991	E933-K989 WeakPolarHBondContact O-CB 3.37Å; E933-K990 HydrophobicContact CB-CB 4.13Å; E933-K990 VanDerWaalsContact OE1-CD 3.22Å; E933-K990 WeakPolarHBondContact OE1-CD 3.33Å; E933-K990 IonicContact OE1-NZ 2.81Å; E933-K990 PolarHBondContact OE1-NZ 2.84Å; E933-K990 VanDerWaalsContact OE1-NZ 3.07Å; E933-G991 PolarHBondContact N-O 2.96Å; E933-G991 VanDerWaalsContact O-CA 3.29Å; E933-G991 WeakPolarHBondContact O-CA 3.44Å; E933-G991 PolarHBondContact O-N 3.5Å
934	V	92	Very high	90.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.			trans	-106.2	163.4	176.3	-178.9	0	0	0	0	108.2	F932 D943 C962 G963 F981 K989	F932-V934 HydrophobicContact CD2-CG2 4.33Å; F932-V934 HydrophobicContact CE1-CB 4.24Å; F932-V934 HydrophobicContact CE1-CG2 4.09Å; F932-V934 HydrophobicContact CE2-CG2 3.8Å; F932-V934 HydrophobicContact CZ-CB 4.12Å; F932-V934 HydrophobicContact CZ-CG2 3.64Å; V934-D943 HydrophobicContact CG1-CB 3.5Å; V934-D943 VanDerWaalsContact CG1-CB 3.5Å; V934-D943 WeakPolarHBondContact CG1-O 3.43Å; V934-C962 HydrophobicContact CG1-CB 4.36Å; V934-G963 PolarHBondContact N-O 2.99Å; V934-G963 CarbonylContact O-C 3.56Å; V934-G963 WeakPolarHBondContact O-CA 3.4Å; V934-G963 PolarHBondContact O-N 2.87Å; V934-F981 HydrophobicContact CG1-CE2 4.45Å; V934-F981 HydrophobicContact CG2-CE2 4.44Å; V934-K989 WeakPolarHBondContact O-CD 3.33Å; V934-K989 PolarHBondContact O-NZ 2.89Å
935	E	93.1	Very high	90.8	Very high	15 Å²	15	42 Å²	42	7%	0.07	23%	0.23	C	C	.	.			trans	-52.2	146.8	174.1	-152.1	-160.1	168	0	0	111.3	Y907 Y942 D943 C962 G963 I987	Y907-E935 PolarHBondContact OH-N 2.87Å; Y907-E935 VanDerWaalsContact OH-N 3.08Å; E935-Y942 WeakPolarHBondContact OE2-CB 3.18Å; E935-Y942 VanDerWaalsContact OE2-CD2 3.3Å; E935-Y942 WeakPolarHBondContact OE2-CD2 3.39Å; E935-D943 HydrophobicContact CB-CB 3.81Å; E935-C962 WeakPolarHBondContact O-CB 3.4Å; E935-G963 WeakPolarHBondContact O-CA 3.29Å; E935-G963 PolarHBondContact O-N 2.82Å; E935-I987 HydrophobicContact CG-CB 3.97Å; E935-I987 HydrophobicContact CG-CG2 4.02Å
936	E	88.8	Confident	90.9	Very high	137 Å²	137	42.1 Å²	42.1	64%	0.64	23%	0.231	S	C	*	.			trans	-109.4	112.9	-174.6	-165.9	170.3	152.3	0	0	109.7	S964	E936-S964 PolarHBondContact OE2-OG 2.82Å
937	E	89.1	Confident	91	Very high	51 Å²	51	41.7 Å²	41.7	24%	0.238	23%	0.228	C	C	.	.			trans	-138	149.7	-177.7	-161.8	-70.5	114.4	0	0	107.8	D939 C940 G941 Y942 C962	E937-D939 PolarHBondContact O-N 3.2Å; E937-D939 PolarHBondContact OE1-N 2.89Å; E937-D939 VanDerWaalsContact OE2-C 3.31Å; E937-D939 WeakPolarHBondContact OE2-CA 3.39Å; E937-D939 PolarHBondContact OE2-N 2.8Å; E937-C940 PolarHBondContact O-N 3.4Å; E937-C940 PolarHBondContact OE2-N 2.95Å; E937-G941 PolarHBondContact OE2-N 3.32Å; E937-Y942 HydrophobicContact CB-CD2 3.93Å; E937-Y942 HydrophobicContact CB-CE2 4.28Å; E937-Y942 HydrophobicContact CG-CD2 3.49Å; E937-Y942 VanDerWaalsContact CG-CD2 3.49Å; E937-Y942 HydrophobicContact CG-CE2 3.44Å; E937-Y942 VanDerWaalsContact CG-CE2 3.44Å; E937-Y942 HydrophobicContact CG-CG 4.15Å; E937-C962 PolarHBondContact O-SG 2.81Å
938	A	83.1	Confident	91.2	Very high	95 Å²	95	42.1 Å²	42.1	79%	0.785	23%	0.23	S	C	*	.	S	Bend	trans	-66.3	-34	-171.3	0	0	0	0	0	113.9
939	D	86.7	Confident	91.2	Very high	139 Å²	139	42.5 Å²	42.5	74%	0.743	23%	0.231	S	C	*	.	S	Bend	trans	-108.2	5	179	-70.4	-41.4	0	0	0	112.6	E937 G941	E937-D939 PolarHBondContact O-N 3.2Å; E937-D939 PolarHBondContact OE1-N 2.89Å; E937-D939 VanDerWaalsContact OE2-C 3.31Å; E937-D939 WeakPolarHBondContact OE2-CA 3.39Å; E937-D939 PolarHBondContact OE2-N 2.8Å; D939-G941 VanDerWaalsContact C-N 3.3Å; D939-G941 PolarHBondContact O-N 3.12Å
940	C	88.9	Confident	91.2	Very high	20 Å²	20	42.5 Å²	42.5	14%	0.135	24%	0.235	C	C	.	.			trans	49.9	48.2	-168.6	-60.6	0	0	0	0	112.4	E937 Y944 R960 C962	E937-C940 PolarHBondContact O-N 3.4Å; E937-C940 PolarHBondContact OE2-N 2.95Å; C940-Y944 WeakPolarHBondContact O-CD1 3.43Å; C940-R960 HydrophobicContact CB-CG 3.99Å; C940-R960 WeakPolarHBondContact O-CD 3.12Å; C940-R960 PolarHBondContact O-NH1 2.9Å; C940-C962 WeakPolarHBondContact CA-SG 3.41Å; C940-C962 HydrophobicContact CB-CB 3.6Å; C940-C962 WeakPolarHBondContact CB-SG 3.39Å; C940-C962 WeakPolarHBondContact SG-CB 3.37Å; C940-C962 PolarHBondContact SG-N 3.32Å; C940-C962 VanDerWaalsContact SG-N 3.41Å; C940-C962 CovalentContact SG-SG 2.03Å; C940-C962 PolarHBondContact SG-SG 2.92Å
941	G	85.9	Confident	91.1	Very high	44 Å²	44	42.9 Å²	42.9	45%	0.454	24%	0.237	S	C	.	.			trans	-81	-28.6	-175.9	0	0	0	0	0	115.8	E937 D939	E937-G941 PolarHBondContact OE2-N 3.32Å; D939-G941 VanDerWaalsContact C-N 3.3Å; D939-G941 PolarHBondContact O-N 3.12Å
942	Y	89.9	Confident	91.1	Very high	115 Å²	115	44.9 Å²	44.9	45%	0.451	25%	0.246	S	C	.	.	S	Bend	trans	-87.9	-98.5	-178.5	-52.4	-38.2	0	0	0	110.6	E935 E937 Y944 H982	E935-Y942 WeakPolarHBondContact OE2-CB 3.18Å; E935-Y942 VanDerWaalsContact OE2-CD2 3.3Å; E935-Y942 WeakPolarHBondContact OE2-CD2 3.39Å; E937-Y942 HydrophobicContact CB-CD2 3.93Å; E937-Y942 HydrophobicContact CB-CE2 4.28Å; E937-Y942 HydrophobicContact CG-CD2 3.49Å; E937-Y942 VanDerWaalsContact CG-CD2 3.49Å; E937-Y942 HydrophobicContact CG-CE2 3.44Å; E937-Y942 VanDerWaalsContact CG-CE2 3.44Å; E937-Y942 HydrophobicContact CG-CG 4.15Å; Y942-Y944 WeakPolarHBondContact O-CD1 3.32Å; Y942-H982 PolarHBondContact O-ND1 2.99Å
943	D	94	Very high	91	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.262	C	S	.	.	S	Bend	trans	-85	131.8	173.9	-61.6	-16.5	0	0	0	112.1	Y907 V934 E935 C962 H982 T983 D984	Y907-D943 WeakPolarHBondContact CE2-OD2 3.39Å; Y907-D943 PolarHBondContact OH-OD2 3Å; V934-D943 HydrophobicContact CG1-CB 3.5Å; V934-D943 VanDerWaalsContact CG1-CB 3.5Å; V934-D943 WeakPolarHBondContact CG1-O 3.43Å; E935-D943 HydrophobicContact CB-CB 3.81Å; D943-C962 VanDerWaalsContact O-CB 3.3Å; D943-C962 WeakPolarHBondContact O-CB 3.16Å; D943-H982 WeakPolarHBondContact CA-O 3.26Å; D943-T983 HydrophobicContact CB-CG2 4.31Å; D943-T983 WeakPolarHBondContact OD1-CA 3.44Å; D943-T983 VanDerWaalsContact OD1-CB 3.29Å; D943-T983 WeakPolarHBondContact OD1-CB 3.33Å; D943-D984 PolarHBondContact OD1-N 2.88Å
944	Y	94.1	Very high	90.8	Very high	27 Å²	27	50.6 Å²	50.6	11%	0.106	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	153	178.6	63.1	-98.6	0	0	0	114.3	C940 Y942 E946 R960 F961 H980 F981 H982	C940-Y944 WeakPolarHBondContact O-CD1 3.43Å; Y942-Y944 WeakPolarHBondContact O-CD1 3.32Å; Y944-E946 HydrophobicContact CD2-CB 4.43Å; Y944-E946 HydrophobicContact CD2-CG 3.83Å; Y944-E946 HydrophobicContact CE2-CB 4.48Å; Y944-E946 HydrophobicContact CE2-CG 3.95Å; Y944-R960 HydrophobicContact CD2-CG 4.09Å; Y944-R960 HydrophobicContact CG-CG 4.04Å; Y944-R960 VanDerWaalsContact CZ-NH2 3.27Å; Y944-F961 WeakPolarHBondContact CA-O 3.49Å; Y944-H980 AromaticContact CE2-CD2 3.88Å; Y944-H980 AromaticContact CE2-NE2 3.84Å; Y944-F981 WeakPolarHBondContact O-CD2 3.4Å; Y944-H982 HydrophobicContact CD1-CB 4.3Å; Y944-H982 HydrophobicContact CD2-CB 4.25Å; Y944-H982 HydrophobicContact CE1-CB 3.8Å; Y944-H982 AromaticContact CE1-CG 3.88Å; Y944-H982 AromaticContact CE1-ND1 3.74Å; Y944-H982 HydrophobicContact CE2-CB 3.73Å; Y944-H982 VanDerWaalsContact CZ-CB 3.48Å; Y944-H982 AromaticContact CZ-CG 3.84Å; Y944-H982 PolarHBondContact N-O 3.04Å; Y944-H982 PolarHBondContact O-N 2.77Å
945	V	94.4	Very high	90.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	121.6	165.3	178.5	0	0	0	0	109.2	F929 F932 R960 F961 L979 H980 F981 F992	F929-V945 HydrophobicContact CZ-CG1 4.44Å; F932-V945 HydrophobicContact CE2-CB 4.19Å; F932-V945 HydrophobicContact CE2-CG2 3.87Å; F932-V945 HydrophobicContact CZ-CG2 4.44Å; V945-R960 CarbonylContact O-C 3.55Å; V945-R960 WeakPolarHBondContact O-CA 3.39Å; V945-F961 PolarHBondContact N-O 3.44Å; V945-F961 PolarHBondContact O-N 2.89Å; V945-L979 HydrophobicContact CG1-CD1 4.28Å; V945-L979 HydrophobicContact CG1-CD2 3.96Å; V945-L979 HydrophobicContact CG1-CG 3.96Å; V945-H980 CarbonylContact C-O 3.6Å; V945-H980 WeakPolarHBondContact CA-O 3.22Å; V945-F981 HydrophobicContact CG2-CB 4.49Å; V945-F981 HydrophobicContact CG2-CD2 3.63Å; V945-F981 HydrophobicContact CG2-CE2 4.24Å; V945-F981 HydrophobicContact CG2-CG 4.37Å; V945-F992 HydrophobicContact CG2-CD1 3.48Å; V945-F992 VanDerWaalsContact CG2-CD1 3.48Å; V945-F992 HydrophobicContact CG2-CE1 3.35Å; V945-F992 HydrophobicContact CG2-CG 4.47Å; V945-F992 HydrophobicContact CG2-CZ 4.25Å
946	E	94.1	Very high	90.6	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.019	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.7	168.8	-84.8	-171.2	-149.7	0	0	112	Y944 F948 R957 G959 R960 L979 H980	Y944-E946 HydrophobicContact CD2-CB 4.43Å; Y944-E946 HydrophobicContact CD2-CG 3.83Å; Y944-E946 HydrophobicContact CE2-CB 4.48Å; Y944-E946 HydrophobicContact CE2-CG 3.95Å; E946-F948 HydrophobicContact CB-CE2 3.92Å; E946-F948 HydrophobicContact CB-CZ 4.31Å; E946-F948 WeakPolarHBondContact OE2-CZ 3.32Å; E946-R957 VanDerWaalsContact CD-NE 3.32Å; E946-R957 IonicContact OE1-CZ 3.93Å; E946-R957 IonicContact OE1-NE 3.13Å; E946-R957 IonicContact OE1-NH2 2.81Å; E946-R957 PolarHBondContact OE1-NH2 2.99Å; E946-R957 IonicContact OE2-CZ 3.7Å; E946-R957 IonicContact OE2-NE 3.44Å; E946-R957 PolarHBondContact OE2-NE 3.5Å; E946-R957 IonicContact OE2-NH2 3.75Å; E946-R957 PolarHBondContact OE2-NH2 2.85Å; E946-G959 WeakPolarHBondContact CA-O 3.27Å; E946-R960 HydrophobicContact CG-CB 3.78Å; E946-R960 HydrophobicContact CG-CG 3.88Å; E946-R960 IonicContact OE1-CZ 3.87Å; E946-R960 IonicContact OE1-NE 3.23Å; E946-R960 PolarHBondContact OE1-NE 2.95Å; E946-R960 IonicContact OE1-NH2 3.86Å; E946-R960 PolarHBondContact OE1-NH2 2.79Å; E946-L979 WeakPolarHBondContact O-CA 3.2Å; E946-H980 HydrophobicContact CB-CB 4.36Å; E946-H980 PolarHBondContact N-O 2.68Å; E946-H980 PolarHBondContact O-N 2.88Å
947	L	94.6	Very high	90.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.5	176.1	-66.9	174	0	0	0	110.4	L927 F929 R957 L958 G959 F961 I970 V977 L978 L979	L927-L947 HydrophobicContact CD1-CD1 4.09Å; L927-L947 HydrophobicContact CD1-CD2 3.93Å; F929-L947 HydrophobicContact CE2-CD1 4.38Å; L947-R957 CarbonylContact O-C 3.46Å; L947-R957 WeakPolarHBondContact O-CA 3.24Å; L947-L958 HydrophobicContact CB-CB 4Å; L947-L958 HydrophobicContact CB-CD1 4.39Å; L947-L958 PolarHBondContact O-N 2.81Å; L947-G959 PolarHBondContact N-O 2.58Å; L947-F961 HydrophobicContact CD1-CE2 3.92Å; L947-F961 HydrophobicContact CG-CE2 4.38Å; L947-I970 HydrophobicContact CD1-CD1 3.38Å; L947-I970 HydrophobicContact CD1-CG2 4.35Å; L947-V977 HydrophobicContact CD2-CG1 4.07Å; L947-L978 WeakPolarHBondContact CA-O 3.34Å; L947-L979 HydrophobicContact CD2-CB 3.69Å; L947-L979 HydrophobicContact CD2-CD1 3.71Å; L947-L979 HydrophobicContact CD2-CG 3.55Å
948	F	95	Very high	90.9	Very high	10 Å²	10	57.9 Å²	57.9	4%	0.044	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133	177.3	-53.5	-97.8	0	0	0	111.1	E946 G950 K953 A955 M956 R957 V977 L978 H980	E946-F948 HydrophobicContact CB-CE2 3.92Å; E946-F948 HydrophobicContact CB-CZ 4.31Å; E946-F948 WeakPolarHBondContact OE2-CZ 3.32Å; F948-G950 VanDerWaalsContact C-N 3.28Å; F948-G950 PolarHBondContact O-N 3.03Å; F948-K953 HydrophobicContact CE1-CB 4.25Å; F948-K953 WeakPolarHBondContact CE1-O 3.49Å; F948-K953 HydrophobicContact CE2-CB 4.26Å; F948-K953 HydrophobicContact CE2-CG 3.98Å; F948-K953 HydrophobicContact CZ-CB 3.98Å; F948-K953 HydrophobicContact CZ-CG 4.15Å; F948-A955 HydrophobicContact CB-CB 4.26Å; F948-M956 WeakPolarHBondContact CA-O 3.41Å; F948-R957 HydrophobicContact CD1-CB 4.14Å; F948-R957 HydrophobicContact CE1-CB 4.24Å; F948-V977 VanDerWaalsContact O-CA 3.31Å; F948-V977 WeakPolarHBondContact O-CA 3.31Å; F948-V977 WeakPolarHBondContact O-CG1 3.24Å; F948-L978 HydrophobicContact CB-CB 4.32Å; F948-L978 HydrophobicContact CD2-CB 4.43Å; F948-L978 HydrophobicContact CD2-CD2 4.18Å; F948-L978 HydrophobicContact CD2-CG 4.42Å; F948-L978 PolarHBondContact N-O 3.03Å; F948-L978 PolarHBondContact O-N 3.21Å; F948-H980 HydrophobicContact CE2-CB 4.21Å
949	D	92.9	Very high	91.2	Very high	24 Å²	24	54.1 Å²	54.1	13%	0.128	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	68.1	-179.7	-163.6	-3.4	0	0	0	111.4	M956 L958 S972 A973 G974	D949-M956 PolarHBondContact N-O 2.87Å; D949-L958 HydrophobicContact CB-CD1 4.04Å; D949-L958 HydrophobicContact CB-CD2 3.94Å; D949-L958 HydrophobicContact CB-CG 3.93Å; D949-S972 WeakPolarHBondContact OD1-CB 3.38Å; D949-A973 VanDerWaalsContact CG-N 3.34Å; D949-A973 PolarHBondContact OD1-N 2.97Å; D949-A973 VanDerWaalsContact OD1-N 3.12Å; D949-A973 WeakPolarHBondContact OD2-CA 3.47Å; D949-A973 WeakPolarHBondContact OD2-CB 3.18Å; D949-A973 PolarHBondContact OD2-N 3.29Å; D949-G974 PolarHBondContact OD1-N 2.91Å
950	G	91.1	Very high	91.5	Very high	14 Å²	14	51.6 Å²	51.6	14%	0.144	27%	0.27	C	S	.	.	S	Bend	trans	172.6	-157.4	-178.7	0	0	0	0	0	114	F948 A976 V977 L978	F948-G950 VanDerWaalsContact C-N 3.28Å; F948-G950 PolarHBondContact O-N 3.03Å; G950-A976 PolarHBondContact N-O 2.81Å; G950-V977 CarbonylContact O-C 3.33Å; G950-L978 PolarHBondContact O-N 3.39Å
951	H	89.9	Confident	91.7	Very high	92 Å²	92	52.9 Å²	52.9	43%	0.426	27%	0.273	S	S	.	.	S	Bend	trans	-94.6	-16	-174.6	-70.7	-59.4	0	0	0	115	A976	H951-A976 VanDerWaalsContact CE1-CB 3.42Å; H951-A976 WeakPolarHBondContact CE1-CB 3.21Å
952	D	90.4	Very high	92	Very high	79 Å²	79	52 Å²	52	42%	0.422	26%	0.26	S	S	.	.	S	Bend	trans	-149.6	173.7	-172.8	61	55.8	0	0	0	111.3	S954 A955	D952-S954 PolarHBondContact O-N 2.61Å; D952-S954 VanDerWaalsContact O-N 3.16Å; D952-S954 WeakPolarHBondContact OD1-CA 3.2Å; D952-S954 WeakPolarHBondContact OD1-CB 3.46Å; D952-S954 PolarHBondContact OD1-N 3.33Å; D952-S954 PolarHBondContact OD1-OG 3.44Å; D952-A955 WeakPolarHBondContact O-CB 3.35Å; D952-A955 PolarHBondContact O-N 2.82Å
953	K	89.8	Confident	92	Very high	85 Å²	85	46.8 Å²	46.8	37%	0.37	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	0.4	-178.3	-56.3	-175.7	-175.8	-176.9	0	114	D914 F948 L978 H980	D914-K953 VanDerWaalsContact CG-NZ 3.25Å; D914-K953 WeakPolarHBondContact OD1-CE 3.39Å; D914-K953 IonicContact OD1-NZ 3.07Å; D914-K953 PolarHBondContact OD1-NZ 3.05Å; D914-K953 WeakPolarHBondContact OD2-CE 3.4Å; D914-K953 IonicContact OD2-NZ 2.98Å; D914-K953 PolarHBondContact OD2-NZ 2.98Å; F948-K953 HydrophobicContact CE1-CB 4.25Å; F948-K953 WeakPolarHBondContact CE1-O 3.49Å; F948-K953 HydrophobicContact CE2-CB 4.26Å; F948-K953 HydrophobicContact CE2-CG 3.98Å; F948-K953 HydrophobicContact CZ-CB 3.98Å; F948-K953 HydrophobicContact CZ-CG 4.15Å; K953-L978 HydrophobicContact CB-CD2 4.5Å; K953-L978 HydrophobicContact CG-CD2 3.53Å; K953-H980 PolarHBondContact NZ-CE1 3.19Å; K953-H980 VanDerWaalsContact NZ-CE1 3.29Å; K953-H980 PolarHBondContact NZ-ND1 2.65Å
954	S	89.8	Confident	91.7	Very high	108 Å²	108	50.2 Å²	50.2	76%	0.755	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-11.4	172.8	81.1	0	0	0	0	113.5	D952	D952-S954 PolarHBondContact O-N 2.61Å; D952-S954 VanDerWaalsContact O-N 3.16Å; D952-S954 WeakPolarHBondContact OD1-CA 3.2Å; D952-S954 WeakPolarHBondContact OD1-CB 3.46Å; D952-S954 PolarHBondContact OD1-N 3.33Å; D952-S954 PolarHBondContact OD1-OG 3.44Å
955	A	89.5	Confident	91.1	Very high	26 Å²	26	50.8 Å²	50.8	22%	0.215	28%	0.279	C	S	.	.	S	Bend	trans	-69.1	171.3	174.5	0	0	0	0	0	112.5	F948 D952 R957	F948-A955 HydrophobicContact CB-CB 4.26Å; D952-A955 WeakPolarHBondContact O-CB 3.35Å; D952-A955 PolarHBondContact O-N 2.82Å; A955-R957 PolarHBondContact O-N 3.15Å
956	M	90.4	Very high	90.4	Very high	136 Å²	136	54.6 Å²	54.6	67%	0.67	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	119.6	-177.4	-173.1	161.8	69.6	0	0	111	F948 D949 L958	F948-M956 WeakPolarHBondContact CA-O 3.41Å; D949-M956 PolarHBondContact N-O 2.87Å; M956-L958 PolarHBondContact O-N 2.84Å
957	R	92.9	Very high	89.8	Confident	139 Å²	139	55.8 Å²	55.8	53%	0.525	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	119.7	174.7	-175.9	-174.9	-75.1	160.1	-7.1	109.7	E946 L947 F948 A955	E946-R957 VanDerWaalsContact CD-NE 3.32Å; E946-R957 IonicContact OE1-CZ 3.93Å; E946-R957 IonicContact OE1-NE 3.13Å; E946-R957 IonicContact OE1-NH2 2.81Å; E946-R957 PolarHBondContact OE1-NH2 2.99Å; E946-R957 IonicContact OE2-CZ 3.7Å; E946-R957 IonicContact OE2-NE 3.44Å; E946-R957 PolarHBondContact OE2-NE 3.5Å; E946-R957 IonicContact OE2-NH2 3.75Å; E946-R957 PolarHBondContact OE2-NH2 2.85Å; L947-R957 CarbonylContact O-C 3.46Å; L947-R957 WeakPolarHBondContact O-CA 3.24Å; F948-R957 HydrophobicContact CD1-CB 4.14Å; F948-R957 HydrophobicContact CE1-CB 4.24Å; A955-R957 PolarHBondContact O-N 3.15Å
958	L	90.6	Very high	89.3	Confident	56 Å²	56	64.3 Å²	64.3	29%	0.293	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-31.2	174.5	-66.4	171.6	0	0	0	111.7	L947 D949 M956 I970 V977	L947-L958 HydrophobicContact CB-CB 4Å; L947-L958 HydrophobicContact CB-CD1 4.39Å; L947-L958 PolarHBondContact O-N 2.81Å; D949-L958 HydrophobicContact CB-CD1 4.04Å; D949-L958 HydrophobicContact CB-CD2 3.94Å; D949-L958 HydrophobicContact CB-CG 3.93Å; M956-L958 PolarHBondContact O-N 2.84Å; L958-I970 HydrophobicContact CB-CG2 4.37Å; L958-I970 HydrophobicContact CD1-CG2 3.9Å; L958-V977 HydrophobicContact CD1-CG1 4.44Å
959	G	89.9	Confident	88.8	Confident	16 Å²	16	69.1 Å²	69.1	17%	0.165	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.2	167.3	172.4	0	0	0	0	0	112.9	E946 L947	E946-G959 WeakPolarHBondContact CA-O 3.27Å; L947-G959 PolarHBondContact N-O 2.58Å
960	R	92.9	Very high	88.6	Confident	86 Å²	86	69 Å²	69	33%	0.325	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132.9	162.5	179.1	-175.6	-82.2	-147.3	-6.2	106.4	C940 Y944 V945 E946	C940-R960 HydrophobicContact CB-CG 3.99Å; C940-R960 WeakPolarHBondContact O-CD 3.12Å; C940-R960 PolarHBondContact O-NH1 2.9Å; Y944-R960 HydrophobicContact CD2-CG 4.09Å; Y944-R960 HydrophobicContact CG-CG 4.04Å; Y944-R960 VanDerWaalsContact CZ-NH2 3.27Å; V945-R960 CarbonylContact O-C 3.55Å; V945-R960 WeakPolarHBondContact O-CA 3.39Å; E946-R960 HydrophobicContact CG-CB 3.78Å; E946-R960 HydrophobicContact CG-CG 3.88Å; E946-R960 IonicContact OE1-CZ 3.87Å; E946-R960 IonicContact OE1-NE 3.23Å; E946-R960 PolarHBondContact OE1-NE 2.95Å; E946-R960 IonicContact OE1-NH2 3.86Å; E946-R960 PolarHBondContact OE1-NH2 2.79Å
961	F	93.1	Very high	88.5	Confident	46 Å²	46	72.3 Å²	72.3	20%	0.202	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.3	-172.8	-52.5	-85.9	0	0	0	110.3	F932 Y944 V945 L947 P967 I970	F932-F961 HydrophobicContact CE1-CB 4.21Å; F932-F961 HydrophobicContact CE2-CB 4.22Å; F932-F961 HydrophobicContact CZ-CB 3.59Å; Y944-F961 WeakPolarHBondContact CA-O 3.49Å; V945-F961 PolarHBondContact N-O 3.44Å; V945-F961 PolarHBondContact O-N 2.89Å; L947-F961 HydrophobicContact CD1-CE2 3.92Å; L947-F961 HydrophobicContact CG-CE2 4.38Å; F961-P967 HydrophobicContact CB-CG 4.32Å; F961-P967 HydrophobicContact CD1-CB 3.99Å; F961-P967 HydrophobicContact CD1-CG 3.65Å; F961-P967 HydrophobicContact CE1-CB 3.99Å; F961-P967 HydrophobicContact CE1-CG 4.16Å; F961-P967 HydrophobicContact CG-CG 4.03Å; F961-I970 HydrophobicContact CE1-CD1 4.39Å; F961-I970 HydrophobicContact CE2-CD1 3.85Å; F961-I970 HydrophobicContact CZ-CD1 3.56Å
962	C	92.5	Very high	88.5	Confident	27 Å²	27	68 Å²	68	18%	0.182	36%	0.362	C	S	.	.			trans	-149.9	177.2	172.7	71.2	0	0	0	0	109.2	V934 E935 E937 C940 D943	V934-C962 HydrophobicContact CG1-CB 4.36Å; E935-C962 WeakPolarHBondContact O-CB 3.4Å; E937-C962 PolarHBondContact O-SG 2.81Å; C940-C962 WeakPolarHBondContact CA-SG 3.41Å; C940-C962 HydrophobicContact CB-CB 3.6Å; C940-C962 WeakPolarHBondContact CB-SG 3.39Å; C940-C962 WeakPolarHBondContact SG-CB 3.37Å; C940-C962 PolarHBondContact SG-N 3.32Å; C940-C962 VanDerWaalsContact SG-N 3.41Å; C940-C962 CovalentContact SG-SG 2.03Å; C940-C962 PolarHBondContact SG-SG 2.92Å; D943-C962 VanDerWaalsContact O-CB 3.3Å; D943-C962 WeakPolarHBondContact O-CB 3.16Å
963	G	90.1	Very high	88.3	Confident	4 Å²	4	67.4 Å²	67.4	4%	0.041	37%	0.368	C	S	.	.	S	Bend	trans	82.2	-158.2	-178.6	0	0	0	0	0	115	V934 E935	V934-G963 PolarHBondContact N-O 2.99Å; V934-G963 CarbonylContact O-C 3.56Å; V934-G963 WeakPolarHBondContact O-CA 3.4Å; V934-G963 PolarHBondContact O-N 2.87Å; E935-G963 WeakPolarHBondContact O-CA 3.29Å; E935-G963 PolarHBondContact O-N 2.82Å
964	S	86.7	Confident	88	Confident	76 Å²	76	64.7 Å²	64.7	53%	0.531	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-118.8	116.8	-165	-40.3	0	0	0	0	112.1	E936 K989	E936-S964 PolarHBondContact OE2-OG 2.82Å; S964-K989 PolarHBondContact OG-NZ 3.14Å
965	G	82.3	Confident	88.1	Confident	39 Å²	39	62.7 Å²	62.7	40%	0.402	34%	0.343	S	S	.	.	S	Bend	trans	125.9	139	179.5	0	0	0	0	0	112.6	F932	F932-G965 WeakPolarHBondContact CD1-O 3.26Å; F932-G965 PolarHBondContact O-N 3.26Å
966	P	80.5	Confident	88.2	Confident	80 Å²	80	61.6 Å²	61.6	52%	0.519	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.3	132	-176.3	27.8	-34	0	0	0	112	F929	F929-P966 HydrophobicContact CB-CB 3.72Å; F929-P966 VanDerWaalsContact O-CB 3.29Å; F929-P966 WeakPolarHBondContact O-CB 3.17Å
967	P	81.8	Confident	88.4	Confident	28 Å²	28	55.2 Å²	55.2	18%	0.182	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-56.6	159.7	165.9	-26.1	34.3	0	0	0	113.2	F929 F961	F929-P967 HydrophobicContact CD2-CB 4.01Å; F929-P967 HydrophobicContact CD2-CG 3.89Å; F929-P967 HydrophobicContact CE2-CB 4.3Å; F929-P967 HydrophobicContact CE2-CG 4.05Å; F929-P967 HydrophobicContact CG-CG 4.27Å; F961-P967 HydrophobicContact CB-CG 4.32Å; F961-P967 HydrophobicContact CD1-CB 3.99Å; F961-P967 HydrophobicContact CD1-CG 3.65Å; F961-P967 HydrophobicContact CE1-CB 3.99Å; F961-P967 HydrophobicContact CE1-CG 4.16Å; F961-P967 HydrophobicContact CG-CG 4.03Å
968	E	82.3	Confident	88.4	Confident	179 Å²	179	49 Å²	49	84%	0.836	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-58.9	162	169.3	-64.6	-167.6	157.4	0	0	111.9	I970	E968-I970 WeakPolarHBondContact O-CG1 3.19Å; E968-I970 PolarHBondContact O-N 2.86Å
969	E	84.9	Confident	88.6	Confident	112 Å²	112	46.4 Å²	46.4	52%	0.523	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-62	128.7	179.7	-65.6	-178.1	166.2	0	0	112.1	Y971	E969-Y971 HydrophobicContact CB-CE2 3.77Å; E969-Y971 PolarHBondContact OE2-OH 2.77Å
970	I	88.9	Confident	88.9	Confident	22 Å²	22	46.2 Å²	46.2	11%	0.113	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.2	-175	-56	-179.8	0	0	0	109.6	E926 L927 F929 L947 L958 F961 E968	E926-I970 WeakPolarHBondContact CA-O 3.24Å; L927-I970 HydrophobicContact CB-CB 4.34Å; L927-I970 PolarHBondContact N-O 3.13Å; L927-I970 PolarHBondContact O-N 2.64Å; F929-I970 HydrophobicContact CE2-CD1 4.21Å; L947-I970 HydrophobicContact CD1-CD1 3.38Å; L947-I970 HydrophobicContact CD1-CG2 4.35Å; L958-I970 HydrophobicContact CB-CG2 4.37Å; L958-I970 HydrophobicContact CD1-CG2 3.9Å; F961-I970 HydrophobicContact CE1-CD1 4.39Å; F961-I970 HydrophobicContact CE2-CD1 3.85Å; F961-I970 HydrophobicContact CZ-CD1 3.56Å; E968-I970 WeakPolarHBondContact O-CG1 3.19Å; E968-I970 PolarHBondContact O-N 2.86Å
971	Y	89.3	Confident	89	Confident	83 Å²	83	42.2 Å²	42.2	33%	0.325	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	127.9	-179.2	-62.3	-93	0	0	0	109.8	R924 E926 E969 I999	R924-Y971 VanDerWaalsContact CZ-CD1 3.49Å; E926-Y971 HydrophobicContact CB-CD1 4.05Å; E926-Y971 HydrophobicContact CB-CE1 4.08Å; E926-Y971 HydrophobicContact CG-CD1 3.95Å; E926-Y971 HydrophobicContact CG-CE1 3.59Å; E926-Y971 WeakPolarHBondContact OE1-CE1 3.39Å; E969-Y971 HydrophobicContact CB-CE2 3.77Å; E969-Y971 PolarHBondContact OE2-OH 2.77Å; Y971-I999 HydrophobicContact CE1-CD1 4.4Å
972	S	90.1	Very high	89	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.014	25%	0.249	C	C	.	.			trans	-72.5	151.4	173.1	72	0	0	0	0	111.6	R924 V925 D949 G974 V977	R924-S972 WeakPolarHBondContact CB-O 3.47Å; R924-S972 WeakPolarHBondContact CB-OG 3.19Å; R924-S972 VanDerWaalsContact CD-O 3.25Å; R924-S972 WeakPolarHBondContact CD-O 3.28Å; V925-S972 PolarHBondContact N-OG 2.64Å; V925-S972 PolarHBondContact O-N 3.14Å; V925-S972 PolarHBondContact O-OG 2.81Å; D949-S972 WeakPolarHBondContact OD1-CB 3.38Å; S972-G974 PolarHBondContact OG-O 2.83Å; S972-V977 VanDerWaalsContact CB-CG2 3.45Å
973	A	85.3	Confident	89.1	Confident	66 Å²	66	41.7 Å²	41.7	55%	0.545	24%	0.241	S	C	.	.	S	Bend	trans	-82.7	-34.7	163.7	0	0	0	0	0	110.7	D949 Y1001	D949-A973 VanDerWaalsContact CG-N 3.34Å; D949-A973 PolarHBondContact OD1-N 2.97Å; D949-A973 VanDerWaalsContact OD1-N 3.12Å; D949-A973 WeakPolarHBondContact OD2-CA 3.47Å; D949-A973 WeakPolarHBondContact OD2-CB 3.18Å; D949-A973 PolarHBondContact OD2-N 3.29Å; A973-Y1001 WeakPolarHBondContact O-CE1 3.01Å; A973-Y1001 PolarHBondContact O-OH 3.08Å
974	G	85.3	Confident	89.2	Confident	27 Å²	27	42.9 Å²	42.9	28%	0.278	25%	0.247	S	C	.	.	S	Bend	trans	-91.8	-175.6	179.2	0	0	0	0	0	115.1	D949 S972 A976	D949-G974 PolarHBondContact OD1-N 2.91Å; S972-G974 PolarHBondContact OG-O 2.83Å; G974-A976 VanDerWaalsContact C-N 3.3Å
975	E	91.1	Very high	89.2	Confident	67 Å²	67	44.5 Å²	44.5	31%	0.313	25%	0.249	S	C	.	.	S	Bend	trans	-84	1.9	176.4	66.2	-178.3	-160.6	0	0	114.1	A919 R921	A919-E975 PolarHBondContact N-O 3Å; R921-E975 WeakPolarHBondContact CA-OE2 3.45Å; R921-E975 VanDerWaalsContact CG-OE2 3.26Å; R921-E975 WeakPolarHBondContact CG-OE2 3.43Å
976	A	92	Very high	89.3	Confident	3 Å²	3	45.9 Å²	45.9	3%	0.025	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	150.7	-177.5	0	0	0	0	0	112.9	L916 L917 V918 G950 H951 G974	L916-A976 HydrophobicContact CD1-CB 4.21Å; L917-A976 CarbonylContact O-C 3.55Å; L917-A976 WeakPolarHBondContact O-CA 3.42Å; V918-A976 HydrophobicContact CG2-CB 4.42Å; G950-A976 PolarHBondContact N-O 2.81Å; H951-A976 VanDerWaalsContact CE1-CB 3.42Å; H951-A976 WeakPolarHBondContact CE1-CB 3.21Å; G974-A976 VanDerWaalsContact C-N 3.3Å
977	V	94.2	Very high	89.5	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.1	168.6	179.8	0	0	0	0	108.8	L917 V925 L927 L947 F948 G950 L958 S972	L917-V977 PolarHBondContact N-O 3.46Å; L917-V977 PolarHBondContact O-N 2.82Å; V925-V977 HydrophobicContact CB-CG2 3.98Å; V925-V977 HydrophobicContact CG1-CG2 4.39Å; V925-V977 HydrophobicContact CG2-CG2 4.39Å; L927-V977 HydrophobicContact CD1-CG1 3.96Å; L947-V977 HydrophobicContact CD2-CG1 4.07Å; F948-V977 VanDerWaalsContact O-CA 3.31Å; F948-V977 WeakPolarHBondContact O-CA 3.31Å; F948-V977 WeakPolarHBondContact O-CG1 3.24Å; G950-V977 CarbonylContact O-C 3.33Å; L958-V977 HydrophobicContact CD1-CG1 4.44Å; S972-V977 VanDerWaalsContact CB-CG2 3.45Å
978	L	93.8	Very high	89.8	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.052	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.8	165.5	179.4	69.5	0	0	0	109	D914 L916 L947 F948 G950 K953	D914-L978 HydrophobicContact CB-CD1 4.18Å; L916-L978 HydrophobicContact CB-CD1 4.35Å; L947-L978 WeakPolarHBondContact CA-O 3.34Å; F948-L978 HydrophobicContact CB-CB 4.32Å; F948-L978 HydrophobicContact CD2-CB 4.43Å; F948-L978 HydrophobicContact CD2-CD2 4.18Å; F948-L978 HydrophobicContact CD2-CG 4.42Å; F948-L978 PolarHBondContact N-O 3.03Å; F948-L978 PolarHBondContact O-N 3.21Å; G950-L978 PolarHBondContact O-N 3.39Å; K953-L978 HydrophobicContact CB-CD2 4.5Å; K953-L978 HydrophobicContact CG-CD2 3.53Å
979	L	94.4	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.1	168.8	-170.2	158.9	0	0	0	108.9	L896 D914 W915 V945 E946 L947 F981 F992 I994	L896-L979 HydrophobicContact CD2-CD1 4.19Å; D914-L979 CarbonylContact C-O 3.42Å; D914-L979 WeakPolarHBondContact CA-O 3.46Å; W915-L979 HydrophobicContact CB-CB 4.44Å; W915-L979 HydrophobicContact CE3-CD2 3.46Å; W915-L979 VanDerWaalsContact CE3-CD2 3.46Å; W915-L979 HydrophobicContact CZ3-CD2 3.63Å; W915-L979 PolarHBondContact N-O 2.78Å; W915-L979 PolarHBondContact O-N 3.2Å; V945-L979 HydrophobicContact CG1-CD1 4.28Å; V945-L979 HydrophobicContact CG1-CD2 3.96Å; V945-L979 HydrophobicContact CG1-CG 3.96Å; E946-L979 WeakPolarHBondContact O-CA 3.2Å; L947-L979 HydrophobicContact CD2-CB 3.69Å; L947-L979 HydrophobicContact CD2-CD1 3.71Å; L947-L979 HydrophobicContact CD2-CG 3.55Å; L979-F981 HydrophobicContact CD2-CB 4.31Å; L979-F992 HydrophobicContact CD1-CE2 4.46Å; L979-F992 HydrophobicContact CD2-CE2 4.43Å; L979-F992 HydrophobicContact CD2-CZ 3.91Å; L979-I994 HydrophobicContact CD1-CD1 3.24Å
980	H	95	Very high	90.5	Very high	13 Å²	13	40.5 Å²	40.5	6%	0.06	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	118.1	176.2	168.1	49.4	0	0	0	108.2	D912 C913 D914 Y944 V945 E946 F948 K953	D912-H980 IonicContact OD1-CE1 2.63Å; D912-H980 PolarHBondContact OD1-CE1 3.35Å; D912-H980 IonicContact OD1-ND1 3.9Å; D912-H980 PolarHBondContact OD1-ND1 2.99Å; D912-H980 VanDerWaalsContact OD1-ND1 3.07Å; C913-H980 CarbonylContact O-C 3.56Å; C913-H980 WeakPolarHBondContact O-CA 3.2Å; D914-H980 WeakPolarHBondContact OD1-CB 3.33Å; D914-H980 IonicContact OD1-CG 3.39Å; D914-H980 IonicContact OD1-ND1 3.52Å; D914-H980 PolarHBondContact OD1-ND1 3.43Å; D914-H980 VanDerWaalsContact OD1-ND1 3.09Å; Y944-H980 AromaticContact CE2-CD2 3.88Å; Y944-H980 AromaticContact CE2-NE2 3.84Å; V945-H980 CarbonylContact C-O 3.6Å; V945-H980 WeakPolarHBondContact CA-O 3.22Å; E946-H980 HydrophobicContact CB-CB 4.36Å; E946-H980 PolarHBondContact N-O 2.68Å; E946-H980 PolarHBondContact O-N 2.88Å; F948-H980 HydrophobicContact CE2-CB 4.21Å; K953-H980 PolarHBondContact NZ-CE1 3.19Å; K953-H980 VanDerWaalsContact NZ-CE1 3.29Å; K953-H980 PolarHBondContact NZ-ND1 2.65Å
981	F	95.1	Very high	90.6	Very high	1 Å²	1	39.5 Å²	39.5	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	125.5	172.7	177.3	-135.3	0	0	0	108.7	Y907 D912 C913 W915 V934 Y944 V945 L979 T983 F992	Y907-F981 AromaticContact CD1-CZ 3.97Å; Y907-F981 HydrophobicContact CD1-CZ 3.97Å; Y907-F981 AromaticContact CD2-CZ 3.95Å; Y907-F981 HydrophobicContact CD2-CZ 3.95Å; Y907-F981 HydrophobicContact CE1-CZ 4.3Å; Y907-F981 HydrophobicContact CE2-CZ 4.28Å; Y907-F981 HydrophobicContact CG-CE1 4.22Å; Y907-F981 AromaticContact CG-CZ 3.79Å; Y907-F981 HydrophobicContact CG-CZ 3.79Å; D912-F981 WeakPolarHBondContact CA-O 3.22Å; C913-F981 HydrophobicContact CB-CB 4.29Å; C913-F981 PolarHBondContact N-O 3.18Å; C913-F981 PolarHBondContact O-N 2.9Å; W915-F981 HydrophobicContact CH2-CB 4.37Å; W915-F981 HydrophobicContact CH2-CD1 4.5Å; W915-F981 HydrophobicContact CZ3-CB 3.74Å; V934-F981 HydrophobicContact CG1-CE2 4.45Å; V934-F981 HydrophobicContact CG2-CE2 4.44Å; Y944-F981 WeakPolarHBondContact O-CD2 3.4Å; V945-F981 HydrophobicContact CG2-CB 4.49Å; V945-F981 HydrophobicContact CG2-CD2 3.63Å; V945-F981 HydrophobicContact CG2-CE2 4.24Å; V945-F981 HydrophobicContact CG2-CG 4.37Å; L979-F981 HydrophobicContact CD2-CB 4.31Å; F981-T983 HydrophobicContact CD2-CG2 4.41Å; F981-T983 HydrophobicContact CE1-CG2 3.78Å; F981-T983 HydrophobicContact CE2-CG2 3.65Å; F981-T983 HydrophobicContact CZ-CG2 3.28Å; F981-F992 HydrophobicContact CB-CE1 3.99Å; F981-F992 HydrophobicContact CB-CZ 4.17Å; F981-F992 AromaticContact CD1-CE1 3.89Å; F981-F992 HydrophobicContact CD1-CE1 3.89Å; F981-F992 HydrophobicContact CD1-CZ 4.38Å; F981-F992 HydrophobicContact CD2-CD1 4.47Å; F981-F992 AromaticContact CD2-CE1 3.71Å; F981-F992 HydrophobicContact CD2-CE1 3.71Å; F981-F992 HydrophobicContact CE1-CE1 4.26Å; F981-F992 HydrophobicContact CE2-CE1 4.1Å; F981-F992 AromaticContact CG-CE1 3.6Å; F981-F992 HydrophobicContact CG-CE1 3.6Å; F981-F992 HydrophobicContact CG-CZ 4.19Å; F981-F992 HydrophobicContact CZ-CE1 4.35Å
982	H	94.2	Very high	90.8	Very high	59 Å²	59	35.5 Å²	35.5	27%	0.273	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	142.8	177.4	-179.9	-85.4	0	0	0	109.2	A911 Y942 D943 Y944	A911-H982 CarbonylContact O-C 3.55Å; A911-H982 WeakPolarHBondContact O-CA 3.4Å; Y942-H982 PolarHBondContact O-ND1 2.99Å; D943-H982 WeakPolarHBondContact CA-O 3.26Å; Y944-H982 HydrophobicContact CD1-CB 4.3Å; Y944-H982 HydrophobicContact CD2-CB 4.25Å; Y944-H982 HydrophobicContact CE1-CB 3.8Å; Y944-H982 AromaticContact CE1-CG 3.88Å; Y944-H982 AromaticContact CE1-ND1 3.74Å; Y944-H982 HydrophobicContact CE2-CB 3.73Å; Y944-H982 VanDerWaalsContact CZ-CB 3.48Å; Y944-H982 AromaticContact CZ-CG 3.84Å; Y944-H982 PolarHBondContact N-O 3.04Å; Y944-H982 PolarHBondContact O-N 2.77Å
983	T	93.9	Very high	90.9	Very high	3 Å²	3	36.5 Å²	36.5	2%	0.018	20%	0.201	C	C	.	.			trans	-136.8	146.3	173.9	52.2	0	0	0	0	111.3	Y907 P908 Q910 A911 D943 F981	Y907-T983 HydrophobicContact CD2-CG2 3.55Å; Y907-T983 HydrophobicContact CE2-CG2 3.53Å; Y907-T983 HydrophobicContact CG-CG2 4.48Å; P908-T983 PolarHBondContact O-OG1 2.86Å; Q910-T983 WeakPolarHBondContact CA-O 3.49Å; Q910-T983 PolarHBondContact N-OG1 2.91Å; A911-T983 WeakPolarHBondContact CA-OG1 3.25Å; A911-T983 WeakPolarHBondContact CB-OG1 3.42Å; A911-T983 PolarHBondContact N-OG1 3.41Å; A911-T983 PolarHBondContact O-N 3.27Å; A911-T983 PolarHBondContact O-OG1 2.93Å; A911-T983 VanDerWaalsContact O-OG1 3.11Å; D943-T983 HydrophobicContact CB-CG2 4.31Å; D943-T983 WeakPolarHBondContact OD1-CA 3.44Å; D943-T983 VanDerWaalsContact OD1-CB 3.29Å; D943-T983 WeakPolarHBondContact OD1-CB 3.33Å; F981-T983 HydrophobicContact CD2-CG2 4.41Å; F981-T983 HydrophobicContact CE1-CG2 3.78Å; F981-T983 HydrophobicContact CE2-CG2 3.65Å; F981-T983 HydrophobicContact CZ-CG2 3.28Å
984	D	91.6	Very high	91.3	Very high	29 Å²	29	33.3 Å²	33.3	16%	0.155	18%	0.175	C	C	.	.			trans	-86.6	-168.1	178.2	88.9	-3.5	0	0	0	112.4	V909 Q910 D943 T986	V909-D984 CarbonylContact C-O 3.5Å; V909-D984 WeakPolarHBondContact CA-O 3.42Å; V909-D984 WeakPolarHBondContact CB-O 3.4Å; Q910-D984 PolarHBondContact N-O 2.77Å; D943-D984 PolarHBondContact OD1-N 2.88Å; D984-T986 VanDerWaalsContact C-N 3.31Å; D984-T986 WeakPolarHBondContact OD1-CA 3.48Å; D984-T986 PolarHBondContact OD1-N 3.36Å; D984-T986 PolarHBondContact OD1-OG1 3.35Å; D984-T986 PolarHBondContact OD2-OG1 3.47Å
985	D	88.4	Confident	91.6	Very high	110 Å²	110	36.1 Å²	36.1	59%	0.588	18%	0.177	S	C	*	.	S	Bend	trans	-87.7	8.2	-179.8	67.2	-31.4	0	0	0	114.8	Q910	Q910-D985 HydrophobicContact CG-CB 3.86Å
986	T	83.9	Confident	91.7	Very high	68 Å²	68	33.5 Å²	33.5	42%	0.417	17%	0.165	S	C	.	.	S	Bend	trans	-126.8	-129.5	-173.4	75	0	0	0	0	113.6	V909 D984 N988	V909-T986 WeakPolarHBondContact CG1-O 3.38Å; D984-T986 VanDerWaalsContact C-N 3.31Å; D984-T986 WeakPolarHBondContact OD1-CA 3.48Å; D984-T986 PolarHBondContact OD1-N 3.36Å; D984-T986 PolarHBondContact OD1-OG1 3.35Å; D984-T986 PolarHBondContact OD2-OG1 3.47Å; T986-N988 PolarHBondContact O-N 3.09Å
987	I	83.8	Confident	91.8	Very high	102 Å²	102	38 Å²	38	52%	0.523	18%	0.181	S	C	.	.			trans	-64	94.6	-151.6	-58.5	172.8	0	0	0	113.7	E935	E935-I987 HydrophobicContact CG-CB 3.97Å; E935-I987 HydrophobicContact CG-CG2 4.02Å
988	N	88	Confident	91.7	Very high	59 Å²	59	38.3 Å²	38.3	32%	0.316	18%	0.183	S	C	.	.			trans	-81.8	151.3	174.2	69.6	9.8	0	0	0	114.5	N906 Y907 V909 T986	N906-N988 HydrophobicContact CB-CB 4.15Å; N906-N988 WeakPolarHBondContact CB-OD1 3.47Å; N906-N988 PolarHBondContact ND2-O 2.92Å; N906-N988 PolarHBondContact ND2-OD1 2.9Å; N906-N988 VanDerWaalsContact ND2-OD1 3.1Å; Y907-N988 HydrophobicContact CD2-CB 3.75Å; Y907-N988 HydrophobicContact CE2-CB 3.58Å; Y907-N988 HydrophobicContact CG-CB 4.48Å; Y907-N988 VanDerWaalsContact O-CB 3.25Å; Y907-N988 WeakPolarHBondContact O-CB 3.12Å; Y907-N988 PolarHBondContact O-ND2 2.97Å; V909-N988 HydrophobicContact CG1-CB 4.28Å; T986-N988 PolarHBondContact O-N 3.09Å
989	K	91.3	Very high	91.5	Very high	51 Å²	51	40 Å²	40	22%	0.222	19%	0.192	C	C	.	.			trans	-129.8	-172.5	174.4	-67.6	-166.6	-165.4	159.7	0	110.9	N906 Y907 E933 V934 S964 G991	N906-K989 CarbonylContact C-O 3.6Å; N906-K989 WeakPolarHBondContact CA-O 3.49Å; N906-K989 WeakPolarHBondContact CB-O 3.11Å; N906-K989 VanDerWaalsContact OD1-C 3.25Å; N906-K989 PolarHBondContact OD1-O 2.9Å; Y907-K989 WeakPolarHBondContact CD1-O 3.45Å; Y907-K989 HydrophobicContact CE1-CB 3.94Å; Y907-K989 VanDerWaalsContact CE1-N 3.35Å; Y907-K989 WeakPolarHBondContact CE1-O 3.25Å; Y907-K989 PolarHBondContact N-O 3.17Å; Y907-K989 PolarHBondContact OH-N 3.26Å; E933-K989 WeakPolarHBondContact O-CB 3.37Å; V934-K989 WeakPolarHBondContact O-CD 3.33Å; V934-K989 PolarHBondContact O-NZ 2.89Å; S964-K989 PolarHBondContact OG-NZ 3.14Å; K989-G991 VanDerWaalsContact C-N 3.28Å; K989-G991 PolarHBondContact O-N 2.73Å
990	K	90.6	Very high	91	Very high	75 Å²	75	47.6 Å²	47.6	33%	0.326	23%	0.225	S	C	.	.			trans	-65.1	-25.7	-176.2	-171.6	-171.8	178.2	-174.3	0	114	H899 F902 N906 T931 E933	H899-K990 PolarHBondContact CE1-O 2.69Å; F902-K990 WeakPolarHBondContact CD2-O 3.33Å; F902-K990 HydrophobicContact CE2-CG 4.34Å; F902-K990 WeakPolarHBondContact CE2-O 3.25Å; N906-K990 PolarHBondContact OD1-N 2.92Å; T931-K990 HydrophobicContact CG2-CD 4.41Å; E933-K990 HydrophobicContact CB-CB 4.13Å; E933-K990 VanDerWaalsContact OE1-CD 3.22Å; E933-K990 WeakPolarHBondContact OE1-CD 3.33Å; E933-K990 IonicContact OE1-NZ 2.81Å; E933-K990 PolarHBondContact OE1-NZ 2.84Å; E933-K990 VanDerWaalsContact OE1-NZ 3.07Å
991	G	92.3	Very high	90.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.6	-148.6	175.9	0	0	0	0	0	114.1	E933 K989	E933-G991 PolarHBondContact N-O 2.96Å; E933-G991 VanDerWaalsContact O-CA 3.29Å; E933-G991 WeakPolarHBondContact O-CA 3.44Å; E933-G991 PolarHBondContact O-N 3.5Å; K989-G991 VanDerWaalsContact C-N 3.28Å; K989-G991 PolarHBondContact O-N 2.73Å
992	F	92.4	Very high	88.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.4	-174.5	63.8	-98.9	0	0	0	114.4	S898 F902 W915 F929 T931 F932 V945 L979 F981 I994	S898-F992 VanDerWaalsContact CB-CD1 3.49Å; S898-F992 PolarHBondContact N-O 3.44Å; S898-F992 PolarHBondContact OG-N 2.94Å; F902-F992 VanDerWaalsContact CE2-C 3.48Å; F902-F992 WeakPolarHBondContact CE2-O 3.44Å; W915-F992 HydrophobicContact CH2-CZ 4.21Å; W915-F992 HydrophobicContact CZ3-CZ 4.05Å; F929-F992 HydrophobicContact CD1-CB 4.2Å; F929-F992 HydrophobicContact CE1-CB 4.21Å; F929-F992 HydrophobicContact CE1-CG 4.38Å; T931-F992 VanDerWaalsContact O-CA 3.24Å; T931-F992 WeakPolarHBondContact O-CA 3.03Å; F932-F992 HydrophobicContact CD2-CB 3.77Å; F932-F992 HydrophobicContact CE2-CB 4.4Å; V945-F992 HydrophobicContact CG2-CD1 3.48Å; V945-F992 VanDerWaalsContact CG2-CD1 3.48Å; V945-F992 HydrophobicContact CG2-CE1 3.35Å; V945-F992 HydrophobicContact CG2-CG 4.47Å; V945-F992 HydrophobicContact CG2-CZ 4.25Å; L979-F992 HydrophobicContact CD1-CE2 4.46Å; L979-F992 HydrophobicContact CD2-CE2 4.43Å; L979-F992 HydrophobicContact CD2-CZ 3.91Å; F981-F992 HydrophobicContact CB-CE1 3.99Å; F981-F992 HydrophobicContact CB-CZ 4.17Å; F981-F992 AromaticContact CD1-CE1 3.89Å; F981-F992 HydrophobicContact CD1-CE1 3.89Å; F981-F992 HydrophobicContact CD1-CZ 4.38Å; F981-F992 HydrophobicContact CD2-CD1 4.47Å; F981-F992 AromaticContact CD2-CE1 3.71Å; F981-F992 HydrophobicContact CD2-CE1 3.71Å; F981-F992 HydrophobicContact CE1-CE1 4.26Å; F981-F992 HydrophobicContact CE2-CE1 4.1Å; F981-F992 AromaticContact CG-CE1 3.6Å; F981-F992 HydrophobicContact CG-CE1 3.6Å; F981-F992 HydrophobicContact CG-CZ 4.19Å; F981-F992 HydrophobicContact CZ-CE1 4.35Å; F992-I994 HydrophobicContact CD2-CD1 3.55Å; F992-I994 HydrophobicContact CD2-CG1 3.8Å; F992-I994 HydrophobicContact CE2-CD1 3.68Å; F992-I994 HydrophobicContact CE2-CG1 4.37Å; F992-I994 HydrophobicContact CG-CD1 4.44Å
993	H	93.1	Very high	86.4	Confident	22 Å²	22	61.7 Å²	61.7	10%	0.102	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	117.9	165.8	167.5	-150.1	0	0	0	108	D895 L896 Y897 F902 Q930 T931	D895-H993 IonicContact OD1-CD2 2.8Å; D895-H993 IonicContact OD1-CE1 2.77Å; D895-H993 IonicContact OD1-NE2 3.66Å; D895-H993 PolarHBondContact OD1-NE2 3.49Å; L896-H993 WeakPolarHBondContact O-CA 3.08Å; Y897-H993 HydrophobicContact CD1-CB 3.87Å; Y897-H993 AromaticContact CD1-CD2 3.81Å; Y897-H993 AromaticContact CD1-CG 3.87Å; Y897-H993 HydrophobicContact CE1-CB 3.92Å; Y897-H993 AromaticContact CE1-CD2 3.35Å; Y897-H993 WeakPolarHBondContact CE1-CD2 3.29Å; Y897-H993 AromaticContact CE1-CG 3.44Å; Y897-H993 VanDerWaalsContact CE1-CG 3.44Å; Y897-H993 AromaticContact CE1-ND1 3.92Å; Y897-H993 AromaticContact CE1-NE2 3.81Å; Y897-H993 AromaticContact CZ-CD2 3.79Å; Y897-H993 AromaticContact CZ-NE2 3.87Å; F902-H993 HydrophobicContact CD1-CB 4.5Å; F902-H993 HydrophobicContact CE1-CB 3.7Å; F902-H993 HydrophobicContact CZ-CB 3.71Å; Q930-H993 PolarHBondContact N-O 3.12Å; T931-H993 PolarHBondContact N-O 3.03Å; T931-H993 PolarHBondContact O-N 2.81Å
994	I	92.3	Very high	84	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.8	179.2	-65.5	163.5	0	0	0	108.9	D895 L896 L927 S928 F929 L979 F992	D895-I994 CarbonylContact C-O 3.38Å; D895-I994 WeakPolarHBondContact CA-O 3.31Å; L896-I994 HydrophobicContact CB-CB 4.41Å; L896-I994 PolarHBondContact N-O 2.64Å; L896-I994 PolarHBondContact O-N 3.12Å; L927-I994 HydrophobicContact CB-CG2 4.31Å; L927-I994 HydrophobicContact CD2-CG2 4.19Å; S928-I994 WeakPolarHBondContact O-CA 3.18Å; F929-I994 HydrophobicContact CD1-CD1 4.05Å; F929-I994 HydrophobicContact CD1-CG1 3.47Å; F929-I994 VanDerWaalsContact CD1-CG1 3.47Å; F929-I994 HydrophobicContact CE1-CD1 3.42Å; F929-I994 VanDerWaalsContact CE1-CD1 3.42Å; F929-I994 HydrophobicContact CE1-CG1 3.41Å; F929-I994 VanDerWaalsContact CE1-CG1 3.41Å; F929-I994 HydrophobicContact CE2-CD1 4.48Å; F929-I994 HydrophobicContact CE2-CG1 4.47Å; F929-I994 HydrophobicContact CG-CG1 4.07Å; F929-I994 HydrophobicContact CZ-CD1 3.67Å; F929-I994 HydrophobicContact CZ-CG1 3.94Å; L979-I994 HydrophobicContact CD1-CD1 3.24Å; F992-I994 HydrophobicContact CD2-CD1 3.55Å; F992-I994 HydrophobicContact CD2-CG1 3.8Å; F992-I994 HydrophobicContact CE2-CD1 3.68Å; F992-I994 HydrophobicContact CE2-CG1 4.37Å; F992-I994 HydrophobicContact CG-CD1 4.44Å
995	R	92.9	Very high	81.4	Confident	86 Å²	86	73.5 Å²	73.5	33%	0.325	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.1	167.9	178.6	165.3	-69.7	151.3	-1	109.4	P893 K894 D895 S928 Q930	P893-R995 HydrophobicContact CB-CG 3.72Å; K894-R995 CarbonylContact O-C 3.57Å; K894-R995 WeakPolarHBondContact O-CA 3.22Å; D895-R995 IonicContact OD1-CZ 2.72Å; D895-R995 VanDerWaalsContact OD1-CZ 3.25Å; D895-R995 IonicContact OD1-NE 3.25Å; D895-R995 PolarHBondContact OD1-NE 2.9Å; D895-R995 IonicContact OD1-NH2 2.68Å; D895-R995 PolarHBondContact OD1-NH2 2.57Å; D895-R995 IonicContact OD2-NH2 2.74Å; D895-R995 PolarHBondContact OD2-NH2 2.93Å; S928-R995 PolarHBondContact N-O 2.84Å; S928-R995 PolarHBondContact O-N 3.32Å; S928-R995 PolarHBondContact OG-O 3.22Å; Q930-R995 HydrophobicContact CG-CB 3.95Å
996	Y	93.2	Very high	79.2	Confident	12 Å²	12	75.7 Å²	75.7	5%	0.047	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.3	-173.6	71.1	-82.2	0	0	0	112.7	A889 P893 K894 L896 L917 E926 L927	A889-Y996 HydrophobicContact CB-CD2 4.01Å; A889-Y996 HydrophobicContact CB-CE2 4.22Å; P893-Y996 WeakPolarHBondContact CA-O 3.35Å; K894-Y996 HydrophobicContact CB-CD1 4.13Å; K894-Y996 HydrophobicContact CB-CE1 3.55Å; K894-Y996 HydrophobicContact CB-CE2 4.1Å; K894-Y996 HydrophobicContact CD-CE2 4.31Å; K894-Y996 PolarHBondContact N-O 3.11Å; K894-Y996 VanDerWaalsContact O-CD1 3.24Å; K894-Y996 WeakPolarHBondContact O-CD1 3.49Å; K894-Y996 PolarHBondContact O-N 3.21Å; L896-Y996 HydrophobicContact CB-CD1 4.08Å; L896-Y996 HydrophobicContact CB-CE1 4.01Å; L917-Y996 HydrophobicContact CD1-CD2 4.4Å; L917-Y996 HydrophobicContact CD1-CG 4.33Å; L917-Y996 HydrophobicContact CD2-CD2 4.29Å; L917-Y996 HydrophobicContact CD2-CE2 4.15Å; E926-Y996 VanDerWaalsContact O-CA 3.26Å; E926-Y996 WeakPolarHBondContact O-CA 3.03Å; L927-Y996 VanDerWaalsContact CD2-CB 3.47Å
997	R	93	Very high	77	Confident	97 Å²	97	78.2 Å²	78.2	37%	0.366	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	163.9	174.1	64.8	176.3	174.9	-170.6	-6.9	112.8	E890 P893 V925 E926 I999	E890-R997 CarbonylContact O-C 3.55Å; E890-R997 WeakPolarHBondContact O-CA 3.41Å; E890-R997 WeakPolarHBondContact O-CB 3.09Å; P893-R997 HydrophobicContact CB-CB 4.49Å; V925-R997 WeakPolarHBondContact CA-O 3.32Å; E926-R997 HydrophobicContact CB-CG 4.24Å; E926-R997 VanDerWaalsContact CD-NH2 3.31Å; E926-R997 PolarHBondContact N-O 3.43Å; E926-R997 PolarHBondContact O-N 2.92Å; E926-R997 IonicContact OE1-CZ 2.71Å; E926-R997 IonicContact OE1-NE 2.8Å; E926-R997 PolarHBondContact OE1-NE 2.8Å; E926-R997 IonicContact OE1-NH2 3.7Å; E926-R997 PolarHBondContact OE1-NH2 3.1Å; E926-R997 WeakPolarHBondContact OE2-CG 3.39Å; E926-R997 IonicContact OE2-CZ 3.76Å; E926-R997 IonicContact OE2-NE 2.78Å; E926-R997 PolarHBondContact OE2-NE 3.29Å; E926-R997 IonicContact OE2-NH2 3.06Å; E926-R997 PolarHBondContact OE2-NH2 2.98Å; R997-I999 HydrophobicContact CG-CD1 4.31Å; R997-I999 HydrophobicContact CG-CG1 4.08Å
998	S	91.9	Very high	74.8	Confident	7 Å²	7	83.3 Å²	83.3	5%	0.049	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.2	174.2	175.8	0	0	0	0	110.4	E890 C923 R924	E890-S998 PolarHBondContact O-N 2.97Å; C923-S998 WeakPolarHBondContact CB-OG 3.01Å; R924-S998 WeakPolarHBondContact O-CA 3.46Å
999	I	89.6	Confident	72.4	Confident	46 Å²	46	94.2 Å²	94.2	24%	0.236	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.6	-178.6	-54.6	-173.3	0	0	0	109.2	C923 R924 E926 Y971 R997	C923-I999 CarbonylContact C-O 3.53Å; C923-I999 WeakPolarHBondContact CA-O 3.41Å; C923-I999 WeakPolarHBondContact CB-O 3.46Å; R924-I999 HydrophobicContact CG-CB 4.42Å; R924-I999 PolarHBondContact N-O 3.35Å; R924-I999 PolarHBondContact O-N 3.16Å; E926-I999 HydrophobicContact CB-CD1 3.58Å; E926-I999 HydrophobicContact CB-CG1 4.17Å; E926-I999 HydrophobicContact CG-CD1 4.09Å; E926-I999 WeakPolarHBondContact OE1-CD1 3.35Å; Y971-I999 HydrophobicContact CE1-CD1 4.4Å; R997-I999 HydrophobicContact CG-CD1 4.31Å; R997-I999 HydrophobicContact CG-CG1 4.08Å
1000	K	84.3	Confident	71.5	Confident	160 Å²	160	96.4 Å²	96.4	70%	0.696	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	145.4	174.5	-70.1	-173.5	174.9	-170.5	0	110.9
1001	Y	76.5	Confident	70.4	Confident	103 Å²	103	97.5 Å²	97.5	40%	0.404	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-55.2	139.9	168.3	-68.1	-73.7	0	0	0	110.1	G922 R924 A973 D1003	G922-Y1001 VanDerWaalsContact C-CD2 3.46Å; G922-Y1001 WeakPolarHBondContact O-CD2 3.47Å; G922-Y1001 PolarHBondContact O-N 3.46Å; R924-Y1001 HydrophobicContact CB-CE1 4.3Å; A973-Y1001 WeakPolarHBondContact O-CE1 3.01Å; A973-Y1001 PolarHBondContact O-OH 3.08Å; Y1001-D1003 PolarHBondContact O-N 2.04Å
1002	P	62.1	Low	69.2	Low	105 Å²	105	102.9 Å²	102.9	68%	0.682	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-60.5	121.9	168.9	-19.5	31.7	0	0	0	109.3	S1004	P1002-S1004 PolarHBondContact O-N 3.1Å
1003	D	49.2	Very low	67.9	Low	161 Å²	161	108.9 Å²	108.9	86%	0.861	53%	0.528	S	S	*	.			trans	-62.1	104.1	172.7	-90.5	-40.3	0	0	0	109.2	Y1001 M1005	Y1001-D1003 PolarHBondContact O-N 2.04Å; D1003-M1005 PolarHBondContact O-N 3.5Å
1004	S	43.5	Very low	66.3	Low	105 Å²	105	114.4 Å²	114.4	73%	0.734	56%	0.555	S	S	*	*			trans	-72.1	82.6	170.7	61.1	0	0	0	0	109.5	P1002 H1006	P1002-S1004 PolarHBondContact O-N 3.1Å; S1004-H1006 PolarHBondContact O-N 3.32Å
1005	M	37.3	Very low	64.6	Low	174 Å²	174	122 Å²	122	86%	0.857	59%	0.592	S	S	*	*			trans	-59.5	107.4	166.7	-88.3	-117.8	70.6	0	0	109.4	D1003 T1007	D1003-M1005 PolarHBondContact O-N 3.5Å; M1005-T1007 PolarHBondContact O-N 3.3Å
1006	H	41.2	Very low	62.5	Low	157 Å²	157	124.6 Å²	124.6	73%	0.727	61%	0.611	S	S	*	*			trans	-52.1	127.3	169.2	-90.5	-80.5	0	0	0	112	S1004	S1004-H1006 PolarHBondContact O-N 3.32Å
1007	T	38.3	Very low	60.2	Low	120 Å²	120	133.2 Å²	133.2	74%	0.736	66%	0.655	S	S	*	*			trans	23	115.6	139.7	54.4	0	0	0	0	118.3	M1005	M1005-T1007 PolarHBondContact O-N 3.3Å
1008	K	38.8	Very low	57.4	Low	209 Å²	209	136.3 Å²	136.3	91%	0.909	68%	0.679	S	S	*	*			trans	-145.8	99.5	148	-110.9	178.8	-174.4	174.3	0	112
1009	K	36.6	Very low	54.3	Low	288 Å²	288	148 Å²	148	100%	1.252	74%	0.736	S	S	*	*			trans	50.6	0	164.7	-72.8	-169	173	-173.8	0	118.2

Retrieved 1,009 of 1,009 residues in 187.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).