M4AA13_XIPMA Loading...

BMP/retinoic acid-inducible neural-specific protein 1

AlphaFold DB , UniProt , Accession M4AA13, Species XIPMA (Xiphophorus maculatus, Southern platyfish), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43.1	Very low	45.3	Very low	245 Å²	245	141 Å²	141	100%	1.207	66%	0.664	S	S	*	*				0	112.1	0	-93.6	157.9	59.7	0	0	107.7
2	N	36.8	Very low	45	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	66%	0.663	S	S	*	*			trans	-87.9	122.8	-153.1	-108.3	-23.5	0	0	0	113.2	R4 F5	N2-R4 PolarHBondContact O-N 3.39Å; N2-F5 PolarHBondContact O-N 2.79Å
3	W	37.3	Very low	44.6	Very low	208 Å²	208	140.7 Å²	140.7	79%	0.788	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	-17.9	175.9	-124.6	55.6	0	0	0	114.6	F5 I6	W3-F5 VanDerWaalsContact C-N 3.28Å; W3-F5 PolarHBondContact O-N 3.2Å; W3-I6 PolarHBondContact O-N 3.22Å
4	R	42.1	Very low	44.4	Very low	200 Å²	200	137.8 Å²	137.8	76%	0.755	65%	0.653	S	S	*	*	H	α-helix	trans	-71	-15.2	178.5	-69.5	-166.1	172.3	-168	-1.8	114.9	N2	N2-R4 PolarHBondContact O-N 3.39Å
5	F	46	Very low	43.6	Very low	159 Å²	159	141.3 Å²	141.3	70%	0.697	66%	0.658	S	S	*	*	H	α-helix	trans	-79.8	-24.6	178.1	-146.4	-94.4	0	0	0	112.5	N2 W3 I9	N2-F5 PolarHBondContact O-N 2.79Å; W3-F5 VanDerWaalsContact C-N 3.28Å; W3-F5 PolarHBondContact O-N 3.2Å; F5-I9 HydrophobicContact CD1-CD1 4.06Å; F5-I9 HydrophobicContact CE1-CD1 4.2Å
6	I	52.3	Low	42.8	Very low	110 Å²	110	141.2 Å²	141.2	56%	0.564	66%	0.663	S	S	*	*	H	α-helix	trans	-79.4	-36.5	180	-64.1	172.4	0	0	0	110.7	W3 V8 I9 C10	W3-I6 PolarHBondContact O-N 3.22Å; I6-V8 VanDerWaalsContact C-N 3.33Å; I6-V8 PolarHBondContact O-N 2.98Å; I6-I9 PolarHBondContact O-N 3.39Å; I6-C10 PolarHBondContact O-N 3.26Å; I6-C10 PolarHBondContact O-SG 3.29Å
7	E	44.5	Very low	42.1	Very low	112 Å²	112	142.4 Å²	142.4	52%	0.523	67%	0.668	S	S	.	*	H	α-helix	trans	-63.6	-36	175.8	-81.5	-177.7	147	0	0	113	C10 F11	E7-C10 PolarHBondContact O-N 3.22Å; E7-F11 WeakPolarHBondContact O-CB 3.33Å; E7-F11 WeakPolarHBondContact O-CD2 3.49Å; E7-F11 PolarHBondContact O-N 2.8Å
8	V	50.4	Low	41.7	Very low	87 Å²	87	141.4 Å²	141.4	53%	0.527	67%	0.667	S	S	.	*	H	α-helix	trans	-69.4	-35.9	179.3	176.9	0	0	0	0	111.6	I6 L12	I6-V8 VanDerWaalsContact C-N 3.33Å; I6-V8 PolarHBondContact O-N 2.98Å; V8-L12 HydrophobicContact CG1-CD1 4.37Å; V8-L12 WeakPolarHBondContact O-CG 3.12Å; V8-L12 PolarHBondContact O-N 3.04Å; V8-L12 VanDerWaalsContact O-N 3.15Å
9	I	53	Low	41.2	Very low	89 Å²	89	139.6 Å²	139.6	46%	0.456	67%	0.666	S	S	.	*	H	α-helix	trans	-72	-38.4	176.9	-64	173	0	0	0	110.6	F5 I6 L12 F13	F5-I9 HydrophobicContact CD1-CD1 4.06Å; F5-I9 HydrophobicContact CE1-CD1 4.2Å; I6-I9 PolarHBondContact O-N 3.39Å; I9-L12 PolarHBondContact O-N 3.13Å; I9-F13 PolarHBondContact O-N 3.44Å; I9-F13 VanDerWaalsContact O-N 3.16Å
10	C	47.2	Very low	40.7	Very low	67 Å²	67	139.7 Å²	139.7	45%	0.453	68%	0.675	S	S	.	*	H	α-helix	trans	-66.7	-37.1	174.5	-70.7	0	0	0	0	112.5	I6 E7 F13 I14	I6-C10 PolarHBondContact O-N 3.26Å; I6-C10 PolarHBondContact O-SG 3.29Å; E7-C10 PolarHBondContact O-N 3.22Å; C10-F13 PolarHBondContact O-N 3.06Å; C10-I14 WeakPolarHBondContact O-CD1 3.34Å; C10-I14 VanDerWaalsContact O-CG1 3.3Å; C10-I14 WeakPolarHBondContact O-CG1 3.38Å; C10-I14 PolarHBondContact O-N 3.49Å; C10-I14 VanDerWaalsContact O-N 3.17Å
11	F	45.8	Very low	40	Very low	133 Å²	133	141.4 Å²	141.4	58%	0.583	68%	0.682	S	S	*	*	H	α-helix	trans	-68.7	-31.2	175.6	-100	-80.7	0	0	0	113.3	E7 W15	E7-F11 WeakPolarHBondContact O-CB 3.33Å; E7-F11 WeakPolarHBondContact O-CD2 3.49Å; E7-F11 PolarHBondContact O-N 2.8Å; F11-W15 PolarHBondContact O-N 3.3Å
12	L	41.3	Very low	39.1	Very low	123 Å²	123	135.1 Å²	135.1	64%	0.644	66%	0.663	S	S	*	*	H	α-helix	trans	-71.6	-32.1	173.7	-73.1	168.2	0	0	0	112.3	V8 I9	V8-L12 HydrophobicContact CG1-CD1 4.37Å; V8-L12 WeakPolarHBondContact O-CG 3.12Å; V8-L12 PolarHBondContact O-N 3.04Å; V8-L12 VanDerWaalsContact O-N 3.15Å; I9-L12 PolarHBondContact O-N 3.13Å
13	F	40.3	Very low	38.5	Very low	155 Å²	155	134.3 Å²	134.3	68%	0.68	66%	0.663	S	S	*	*	H	α-helix	trans	-74.2	-25.4	175.2	-108.2	-86.7	0	0	0	113.9	I9 C10	I9-F13 PolarHBondContact O-N 3.44Å; I9-F13 VanDerWaalsContact O-N 3.16Å; C10-F13 PolarHBondContact O-N 3.06Å
14	I	41.3	Very low	38.1	Very low	100 Å²	100	135.8 Å²	135.8	51%	0.513	67%	0.668	S	S	.	*	H	α-helix	trans	-83.1	-25	179.2	-66.2	166.1	0	0	0	111.5	C10 H17 I18	C10-I14 WeakPolarHBondContact O-CD1 3.34Å; C10-I14 VanDerWaalsContact O-CG1 3.3Å; C10-I14 WeakPolarHBondContact O-CG1 3.38Å; C10-I14 PolarHBondContact O-N 3.49Å; C10-I14 VanDerWaalsContact O-N 3.17Å; I14-H17 PolarHBondContact O-N 2.7Å; I14-I18 HydrophobicContact CG2-CD1 4.33Å
15	W	32.5	Very low	37.4	Very low	191 Å²	191	134.5 Å²	134.5	72%	0.723	67%	0.671	S	S	*	*	H	α-helix	trans	-74.7	-28.9	178.5	-139.5	-58.3	0	0	0	113.2	F11 H17 I18	F11-W15 PolarHBondContact O-N 3.3Å; W15-H17 PolarHBondContact O-N 3.16Å; W15-I18 PolarHBondContact O-N 3.38Å
16	D	30.6	Very low	36.4	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-13.1	178.3	-132.9	19.6	0	0	0	112.9
17	H	32.2	Very low	35.2	Very low	162 Å²	162	137 Å²	137	75%	0.75	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	2.8	177.5	-82.9	-56.6	0	0	0	115	I14 W15	I14-H17 PolarHBondContact O-N 2.7Å; W15-H17 PolarHBondContact O-N 3.16Å
18	I	34.3	Very low	34.4	Very low	124 Å²	124	139 Å²	139	64%	0.636	71%	0.705	S	S	*	*	S	Bend	trans	-107.3	-5.7	-176.5	-66.1	175.3	0	0	0	113.9	I14 W15	I14-I18 HydrophobicContact CG2-CD1 4.33Å; W15-I18 PolarHBondContact O-N 3.38Å
19	T	32.3	Very low	33.2	Very low	107 Å²	107	139.9 Å²	139.9	66%	0.656	72%	0.722	S	S	*	*			trans	-118.6	58.5	177.5	59.6	0	0	0	0	114.3
20	V	30.3	Very low	32	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	74%	0.737	S	S	*	*			trans	-139.3	81.3	151.3	-173.1	0	0	0	0	109.2
21	Q	26.3	Very low	31	Very low	176 Å²	176	146.1 Å²	146.1	82%	0.822	76%	0.759	S	S	*	*			trans	-128.6	87	157.9	-140.6	176.9	9.8	0	0	107.4	T23	Q21-T23 PolarHBondContact O-N 3.31Å
22	S	24.3	Very low	30.3	Very low	113 Å²	113	148.7 Å²	148.7	79%	0.79	77%	0.772	S	S	*	*			trans	-86.8	86.5	164.1	-173.8	0	0	0	0	107.6	R24	S22-R24 PolarHBondContact O-N 2.76Å
23	T	24.1	Very low	29.6	Very low	124 Å²	124	151.7 Å²	151.7	76%	0.761	78%	0.783	S	S	*	*			trans	-62.6	101.4	159.6	22.3	0	0	0	0	107.8	Q21 Q25	Q21-T23 PolarHBondContact O-N 3.31Å; T23-Q25 PolarHBondContact O-N 3.13Å
24	R	28.9	Very low	29.1	Very low	239 Å²	239	150.6 Å²	150.6	90%	0.902	79%	0.788	S	S	*	*			trans	-83.9	97.8	173.4	-172.1	-176.5	-172.9	174.9	3.2	108.8	S22	S22-R24 PolarHBondContact O-N 2.76Å
25	Q	28	Very low	28.6	Very low	173 Å²	173	149.8 Å²	149.8	81%	0.808	79%	0.788	S	S	*	*			trans	-146	108.5	153.7	-102.3	172.1	-12.3	0	0	107.5	T23	T23-Q25 PolarHBondContact O-N 3.13Å
26	D	23.7	Very low	29.2	Very low	172 Å²	172	149.8 Å²	149.8	92%	0.92	79%	0.793	S	S	*	*				-157.6	140.1	124.6	-99.7	-23.3	0	0	0	111.8
27	L	27.5	Very low	29.8	Very low	149 Å²	149	149.2 Å²	149.2	78%	0.78	79%	0.786	S	S	*	*			trans	-98	158.2	-169.2	-103.1	138.7	0	0	0	109.8
28	L	28.6	Very low	30.4	Very low	155 Å²	155	147.6 Å²	147.6	81%	0.812	78%	0.775	S	S	*	*			trans	93	95	163.9	-53.6	170.4	0	0	0	118.3
29	A	24.4	Very low	31.2	Very low	106 Å²	106	146.1 Å²	146.1	88%	0.876	77%	0.768	S	S	*	*				-144.1	94.9	129.2	0	0	0	0	0	106.9	E31	A29-E31 PolarHBondContact O-N 3.16Å
30	A	28.7	Very low	32.4	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	76%	0.762	S	S	*	*			trans	-76.1	114.7	171.1	0	0	0	0	0	108.4
31	E	25	Very low	33.4	Very low	193 Å²	193	142.5 Å²	142.5	90%	0.902	73%	0.729	S	S	*	*			trans	-150.8	132.2	154.1	-110.7	176.5	-165.9	0	0	108.6	A29 H33	A29-E31 PolarHBondContact O-N 3.16Å; E31-H33 PolarHBondContact O-N 3.2Å
32	Q	31.3	Very low	35	Very low	186 Å²	186	137.6 Å²	137.6	87%	0.869	71%	0.708	S	S	*	*			trans	-62.7	111.5	-160.2	-67.1	161.4	-39.9	0	0	113.2
33	H	27.7	Very low	36.6	Very low	186 Å²	186	134.4 Å²	134.4	86%	0.861	69%	0.685	S	S	*	*	S	Bend	trans	-151.7	132.5	140.9	-88.4	-59	0	0	0	108.4	E31 T35	E31-H33 PolarHBondContact O-N 3.2Å; H33-T35 PolarHBondContact O-N 3.3Å
34	V	29.3	Very low	38.1	Very low	132 Å²	132	129.4 Å²	129.4	80%	0.8	65%	0.654	S	S	*	*			trans	-15.8	120.9	177.9	-176	0	0	0	0	114.2
35	T	31.3	Very low	39.4	Very low	83 Å²	83	119.7 Å²	119.7	51%	0.509	62%	0.617	S	S	.	*			trans	-23.8	123.1	173.6	37.1	0	0	0	0	116.4	H33 Q37	H33-T35 PolarHBondContact O-N 3.3Å; T35-Q37 PolarHBondContact O-N 2.95Å
36	K	44.3	Very low	41	Very low	191 Å²	191	111.5 Å²	111.5	83%	0.83	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	0.6	165.8	-75.1	178.3	175.3	174.2	0	115.7	Y38	K36-Y38 PolarHBondContact O-N 2.8Å
37	Q	43.1	Very low	42.6	Very low	128 Å²	128	106.8 Å²	106.8	60%	0.598	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-16.5	-174.1	-166.8	168.1	4	0	0	112.7	T35 W40	T35-Q37 PolarHBondContact O-N 2.95Å; Q37-W40 PolarHBondContact O-NE1 2.79Å
38	Y	45.6	Very low	44.4	Very low	128 Å²	128	104.7 Å²	104.7	50%	0.502	54%	0.544	S	S	.	.	S	Bend	trans	-123.5	3.2	-171.8	-62.3	-58.7	0	0	0	114.3	K36 W40 L41	K36-Y38 PolarHBondContact O-N 2.8Å; Y38-W40 PolarHBondContact O-N 2.04Å; Y38-W40 VanDerWaalsContact O-N 3.16Å; Y38-L41 HydrophobicContact CD1-CD1 3.68Å; Y38-L41 HydrophobicContact CG-CD1 4.18Å; Y38-L41 VanDerWaalsContact O-CB 3.25Å; Y38-L41 WeakPolarHBondContact O-CB 3.39Å; Y38-L41 PolarHBondContact O-N 3.15Å
39	D	51.4	Low	46.2	Very low	93 Å²	93	98.9 Å²	98.9	50%	0.497	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-57.9	-31.4	179.2	-85	-7.8	0	0	0	112.4	L41 I42 S43	D39-L41 PolarHBondContact O-N 2.7Å; D39-I42 VanDerWaalsContact O-CG1 3.29Å; D39-I42 WeakPolarHBondContact O-CG1 3.5Å; D39-I42 PolarHBondContact O-N 2.84Å; D39-S43 PolarHBondContact O-N 2.82Å; D39-S43 VanDerWaalsContact O-N 3.1Å
40	W	56	Low	48.1	Very low	138 Å²	138	99.8 Å²	99.8	52%	0.523	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-61.4	-28	176.4	73.5	-90	0	0	0	112.7	Q37 Y38 I42 S43 G46 P47	Q37-W40 PolarHBondContact O-NE1 2.79Å; Y38-W40 PolarHBondContact O-N 2.04Å; Y38-W40 VanDerWaalsContact O-N 3.16Å; W40-I42 VanDerWaalsContact C-N 3.26Å; W40-I42 PolarHBondContact O-N 2.9Å; W40-S43 PolarHBondContact O-OG 2.89Å; W40-G46 WeakPolarHBondContact O-CA 3.3Å; W40-P47 HydrophobicContact CZ3-CG 4.13Å
41	L	52.1	Low	50.1	Low	33 Å²	33	96.6 Å²	96.6	17%	0.173	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-67.9	-26.9	-178.4	-70.5	170.2	0	0	0	113	Y38 D39 G46 P47 F48	Y38-L41 HydrophobicContact CD1-CD1 3.68Å; Y38-L41 HydrophobicContact CG-CD1 4.18Å; Y38-L41 VanDerWaalsContact O-CB 3.25Å; Y38-L41 WeakPolarHBondContact O-CB 3.39Å; Y38-L41 PolarHBondContact O-N 3.15Å; D39-L41 PolarHBondContact O-N 2.7Å; L41-G46 CarbonylContact O-C 3.59Å; L41-G46 WeakPolarHBondContact O-CA 3.48Å; L41-P47 HydrophobicContact CD2-CG 3.66Å; L41-F48 HydrophobicContact CB-CD2 3.73Å; L41-F48 HydrophobicContact CB-CE2 3.98Å; L41-F48 HydrophobicContact CD1-CE2 4.06Å; L41-F48 HydrophobicContact CD2-CD2 4.28Å; L41-F48 HydrophobicContact CD2-CE2 3.82Å; L41-F48 HydrophobicContact CG-CD2 4.43Å; L41-F48 HydrophobicContact CG-CE2 4.19Å; L41-F48 WeakPolarHBondContact O-CB 3.38Å; L41-F48 PolarHBondContact O-N 2.84Å
42	I	59.1	Low	52.2	Low	74 Å²	74	98.2 Å²	98.2	38%	0.379	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.8	-3.7	-176.7	57.4	169.8	0	0	0	113.5	D39 W40 Y54	D39-I42 VanDerWaalsContact O-CG1 3.29Å; D39-I42 WeakPolarHBondContact O-CG1 3.5Å; D39-I42 PolarHBondContact O-N 2.84Å; W40-I42 VanDerWaalsContact C-N 3.26Å; W40-I42 PolarHBondContact O-N 2.9Å; I42-Y54 HydrophobicContact CB-CE2 4.15Å; I42-Y54 HydrophobicContact CG2-CD2 4.47Å; I42-Y54 HydrophobicContact CG2-CE2 4.26Å
43	S	59.3	Low	54	Low	45 Å²	45	92 Å²	92	32%	0.315	45%	0.445	S	S	.	.	S	Bend	trans	-57.9	159.6	169.6	70.8	0	0	0	0	111.1	D39 W40 R45 G46 H49	D39-S43 PolarHBondContact O-N 2.82Å; D39-S43 VanDerWaalsContact O-N 3.1Å; W40-S43 PolarHBondContact O-OG 2.89Å; S43-R45 PolarHBondContact O-N 3.35Å; S43-G46 WeakPolarHBondContact O-CA 3.41Å; S43-G46 PolarHBondContact O-N 3Å; S43-G46 PolarHBondContact OG-N 3.18Å; S43-H49 WeakPolarHBondContact O-CB 3.36Å
44	D	55.7	Low	56.2	Low	20 Å²	20	86.2 Å²	86.2	11%	0.107	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-25.1	177.8	-77.2	-6.8	0	0	0	114.8	H49 H50 P279 T281 D282	D44-H49 VanDerWaalsContact CA-CG 3.49Å; D44-H49 IonicContact OD1-CE1 2.79Å; D44-H49 PolarHBondContact OD1-CE1 3.1Å; D44-H49 IonicContact OD1-ND1 3.31Å; D44-H49 PolarHBondContact OD1-ND1 2.81Å; D44-H49 IonicContact OD1-NE2 3.69Å; D44-H49 PolarHBondContact OD1-NE2 2.83Å; D44-H50 PolarHBondContact O-CE1 3.01Å; D44-P279 HydrophobicContact CB-CB 4.45Å; D44-T281 PolarHBondContact OD2-OG1 3.5Å; D44-D282 VanDerWaalsContact CG-CG 3.46Å; D44-D282 VanDerWaalsContact OD2-CG 3.27Å
45	R	54.8	Low	58.4	Low	34 Å²	34	83.9 Å²	83.9	13%	0.128	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-1.9	-178.4	-58.2	171.1	-175	-137.3	-11	114.1	S43 M251 C276 N277	S43-R45 PolarHBondContact O-N 3.35Å; R45-M251 WeakPolarHBondContact CD-O 3.27Å; R45-M251 PolarHBondContact NH1-O 2.89Å; R45-C276 PolarHBondContact NH2-O 3.48Å; R45-N277 PolarHBondContact NH1-OD1 3.06Å; R45-N277 PolarHBondContact NH2-O 3.08Å
46	G	61.7	Low	60.6	Low	2 Å²	2	81.8 Å²	81.8	2%	0.021	39%	0.388	C	S	.	.	S	Bend	trans	-65.5	145.2	173.9	0	0	0	0	0	110.3	W40 L41 S43 F48 H49	W40-G46 WeakPolarHBondContact O-CA 3.3Å; L41-G46 CarbonylContact O-C 3.59Å; L41-G46 WeakPolarHBondContact O-CA 3.48Å; S43-G46 WeakPolarHBondContact O-CA 3.41Å; S43-G46 PolarHBondContact O-N 3Å; S43-G46 PolarHBondContact OG-N 3.18Å; G46-F48 PolarHBondContact O-N 2.65Å; G46-H49 PolarHBondContact O-N 3.23Å; G46-H49 VanDerWaalsContact O-N 3.07Å
47	P	58.8	Low	62.3	Low	73 Å²	73	75.3 Å²	75.3	47%	0.474	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-18.8	-180	23	-35.7	0	0	0	113.9	W40 L41	W40-P47 HydrophobicContact CZ3-CG 4.13Å; L41-P47 HydrophobicContact CD2-CG 3.66Å
48	F	64.1	Low	63.9	Low	105 Å²	105	70.7 Å²	70.7	46%	0.461	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-7.7	180	-55.2	-49.7	0	0	0	114.9	L41 G46 H50 S51 Y54	L41-F48 HydrophobicContact CB-CD2 3.73Å; L41-F48 HydrophobicContact CB-CE2 3.98Å; L41-F48 HydrophobicContact CD1-CE2 4.06Å; L41-F48 HydrophobicContact CD2-CD2 4.28Å; L41-F48 HydrophobicContact CD2-CE2 3.82Å; L41-F48 HydrophobicContact CG-CD2 4.43Å; L41-F48 HydrophobicContact CG-CE2 4.19Å; L41-F48 WeakPolarHBondContact O-CB 3.38Å; L41-F48 PolarHBondContact O-N 2.84Å; G46-F48 PolarHBondContact O-N 2.65Å; F48-H50 VanDerWaalsContact C-N 3.34Å; F48-H50 PolarHBondContact O-N 2.89Å; F48-S51 VanDerWaalsContact O-CB 3.22Å; F48-S51 WeakPolarHBondContact O-CB 3.42Å; F48-S51 PolarHBondContact O-N 2.8Å; F48-S51 PolarHBondContact O-OG 3.11Å; F48-Y54 WeakPolarHBondContact O-CB 3.1Å
49	H	66.6	Low	65.6	Low	32 Å²	32	69.1 Å²	69.1	15%	0.148	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-40.4	-178.8	-174.4	84.9	0	0	0	112.8	S43 D44 G46 S51 Y54 L55	S43-H49 WeakPolarHBondContact O-CB 3.36Å; D44-H49 VanDerWaalsContact CA-CG 3.49Å; D44-H49 IonicContact OD1-CE1 2.79Å; D44-H49 PolarHBondContact OD1-CE1 3.1Å; D44-H49 IonicContact OD1-ND1 3.31Å; D44-H49 PolarHBondContact OD1-ND1 2.81Å; D44-H49 IonicContact OD1-NE2 3.69Å; D44-H49 PolarHBondContact OD1-NE2 2.83Å; G46-H49 PolarHBondContact O-N 3.23Å; G46-H49 VanDerWaalsContact O-N 3.07Å; H49-S51 PolarHBondContact O-N 3.21Å; H49-Y54 AromaticContact ND1-CE1 3.59Å; H49-Y54 VanDerWaalsContact O-CD1 3.28Å; H49-Y54 WeakPolarHBondContact O-CD1 3.36Å; H49-L55 WeakPolarHBondContact O-CD2 3.48Å; H49-L55 WeakPolarHBondContact O-CG 3.08Å
50	H	64.8	Low	67	Low	125 Å²	125	67 Å²	67	58%	0.579	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	2.1	175.2	-62.7	91.2	0	0	0	113	D44 F48 R52	D44-H50 PolarHBondContact O-CE1 3.01Å; F48-H50 VanDerWaalsContact C-N 3.34Å; F48-H50 PolarHBondContact O-N 2.89Å; H50-R52 PolarHBondContact O-N 2.73Å
51	S	70.1	Confident	68.1	Low	27 Å²	27	65.7 Å²	65.7	19%	0.189	32%	0.32	C	S	.	.			trans	-67.2	132.1	178.3	74.5	0	0	0	0	109.6	F48 H49 S53 Y54 L55	F48-S51 VanDerWaalsContact O-CB 3.22Å; F48-S51 WeakPolarHBondContact O-CB 3.42Å; F48-S51 PolarHBondContact O-N 2.8Å; F48-S51 PolarHBondContact O-OG 3.11Å; H49-S51 PolarHBondContact O-N 3.21Å; S51-S53 PolarHBondContact O-N 2.67Å; S51-S53 VanDerWaalsContact O-N 3.12Å; S51-S53 PolarHBondContact OG-OG 3.28Å; S51-Y54 PolarHBondContact O-N 3.23Å; S51-Y54 WeakPolarHBondContact OG-CB 2.93Å; S51-Y54 PolarHBondContact OG-N 2.82Å; S51-L55 PolarHBondContact O-N 2.87Å
52	R	70.1	Confident	69.4	Low	227 Å²	227	72.9 Å²	72.9	86%	0.857	35%	0.345	S	S	*	.	H	α-helix	trans	-55	-34.1	179.3	-172.4	177.4	179	-176.6	0.2	112	H50 S56	H50-R52 PolarHBondContact O-N 2.73Å; R52-S56 VanDerWaalsContact O-CB 3.22Å; R52-S56 WeakPolarHBondContact O-CB 3.4Å; R52-S56 PolarHBondContact O-N 3.43Å; R52-S56 PolarHBondContact O-OG 3.43Å
53	S	68.9	Low	70.3	Confident	57 Å²	57	73.5 Å²	73.5	40%	0.399	35%	0.346	S	S	.	.	H	α-helix	trans	-67	-45.3	176.6	53.7	0	0	0	0	112.3	S51 S56 F57	S51-S53 PolarHBondContact O-N 2.67Å; S51-S53 VanDerWaalsContact O-N 3.12Å; S51-S53 PolarHBondContact OG-OG 3.28Å; S53-S56 PolarHBondContact O-OG 2.88Å; S53-F57 PolarHBondContact O-N 3.23Å; S53-F57 VanDerWaalsContact O-N 3.12Å
54	Y	73.9	Confident	71.1	Confident	63 Å²	63	72.5 Å²	72.5	25%	0.247	34%	0.344	C	S	.	.	H	α-helix	trans	-65.7	-49.6	176	178.5	-99.2	0	0	0	111.7	I42 F48 H49 S51 S56 F57 V58	I42-Y54 HydrophobicContact CB-CE2 4.15Å; I42-Y54 HydrophobicContact CG2-CD2 4.47Å; I42-Y54 HydrophobicContact CG2-CE2 4.26Å; F48-Y54 WeakPolarHBondContact O-CB 3.1Å; H49-Y54 AromaticContact ND1-CE1 3.59Å; H49-Y54 VanDerWaalsContact O-CD1 3.28Å; H49-Y54 WeakPolarHBondContact O-CD1 3.36Å; S51-Y54 PolarHBondContact O-N 3.23Å; S51-Y54 WeakPolarHBondContact OG-CB 2.93Å; S51-Y54 PolarHBondContact OG-N 2.82Å; Y54-S56 VanDerWaalsContact C-N 3.29Å; Y54-S56 PolarHBondContact O-N 3.03Å; Y54-F57 CarbonylContact O-C 3.59Å; Y54-F57 WeakPolarHBondContact O-CA 3.12Å; Y54-F57 WeakPolarHBondContact O-CB 3.34Å; Y54-F57 PolarHBondContact O-N 3.49Å; Y54-V58 HydrophobicContact CD1-CG2 3.95Å; Y54-V58 HydrophobicContact CD2-CG2 4.42Å; Y54-V58 HydrophobicContact CE1-CG2 3.55Å; Y54-V58 HydrophobicContact CE2-CG2 4.07Å; Y54-V58 HydrophobicContact CG-CG2 4.38Å; Y54-V58 WeakPolarHBondContact O-CG2 3.18Å; Y54-V58 PolarHBondContact O-N 3.19Å
55	L	75.5	Confident	72.4	Confident	83 Å²	83	72.1 Å²	72.1	44%	0.435	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-42.6	178.7	-68.4	174.9	0	0	0	111.8	H49 S51 F57 V58 E59	H49-L55 WeakPolarHBondContact O-CD2 3.48Å; H49-L55 WeakPolarHBondContact O-CG 3.08Å; S51-L55 PolarHBondContact O-N 2.87Å; L55-F57 VanDerWaalsContact C-N 3.3Å; L55-F57 PolarHBondContact O-N 3.32Å; L55-V58 PolarHBondContact O-N 3.03Å; L55-E59 PolarHBondContact O-N 2.86Å
56	S	77.3	Confident	73.6	Confident	40 Å²	40	73.3 Å²	73.3	28%	0.28	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-36.5	175	74.3	0	0	0	0	112.6	R52 S53 Y54 R60	R52-S56 VanDerWaalsContact O-CB 3.22Å; R52-S56 WeakPolarHBondContact O-CB 3.4Å; R52-S56 PolarHBondContact O-N 3.43Å; R52-S56 PolarHBondContact O-OG 3.43Å; S53-S56 PolarHBondContact O-OG 2.88Å; Y54-S56 VanDerWaalsContact C-N 3.29Å; Y54-S56 PolarHBondContact O-N 3.03Å; S56-R60 WeakPolarHBondContact O-CG 3.31Å; S56-R60 PolarHBondContact O-N 2.87Å
57	F	79.3	Confident	74.5	Confident	55 Å²	55	75.4 Å²	75.4	24%	0.241	37%	0.365	C	S	.	.	H	α-helix	trans	-70.4	-43.3	175.1	174.3	-95.5	0	0	0	111.3	S53 Y54 L55 E59 R60 F61 R68 Y144	S53-F57 PolarHBondContact O-N 3.23Å; S53-F57 VanDerWaalsContact O-N 3.12Å; Y54-F57 CarbonylContact O-C 3.59Å; Y54-F57 WeakPolarHBondContact O-CA 3.12Å; Y54-F57 WeakPolarHBondContact O-CB 3.34Å; Y54-F57 PolarHBondContact O-N 3.49Å; L55-F57 VanDerWaalsContact C-N 3.3Å; L55-F57 PolarHBondContact O-N 3.32Å; F57-E59 VanDerWaalsContact C-N 3.33Å; F57-E59 PolarHBondContact O-N 3.44Å; F57-R60 CarbonylContact O-C 3.54Å; F57-R60 PolarHBondContact O-N 2.85Å; F57-F61 HydrophobicContact CE1-CB 4.36Å; F57-F61 HydrophobicContact CE1-CD2 4.37Å; F57-F61 HydrophobicContact CZ-CD2 4.21Å; F57-F61 WeakPolarHBondContact O-CB 3.4Å; F57-F61 PolarHBondContact O-N 2.83Å; F57-R68 HydrophobicContact CD2-CB 3.75Å; F57-R68 HydrophobicContact CD2-CG 4.45Å; F57-R68 HydrophobicContact CE2-CB 3.71Å; F57-Y144 HydrophobicContact CB-CE1 4.46Å; F57-Y144 HydrophobicContact CD2-CD1 4.18Å; F57-Y144 AromaticContact CD2-CE1 3.86Å; F57-Y144 HydrophobicContact CD2-CE1 3.86Å
58	V	77.8	Confident	75.8	Confident	30 Å²	30	76.4 Å²	76.4	18%	0.182	36%	0.359	C	S	.	.	H	α-helix	trans	-60.9	-42.3	178.3	171.9	0	0	0	0	111.3	Y54 L55 R60 F61 R62	Y54-V58 HydrophobicContact CD1-CG2 3.95Å; Y54-V58 HydrophobicContact CD2-CG2 4.42Å; Y54-V58 HydrophobicContact CE1-CG2 3.55Å; Y54-V58 HydrophobicContact CE2-CG2 4.07Å; Y54-V58 HydrophobicContact CG-CG2 4.38Å; Y54-V58 WeakPolarHBondContact O-CG2 3.18Å; Y54-V58 PolarHBondContact O-N 3.19Å; L55-V58 PolarHBondContact O-N 3.03Å; V58-R60 PolarHBondContact O-N 3.29Å; V58-F61 WeakPolarHBondContact O-CB 3.34Å; V58-F61 PolarHBondContact O-N 3.16Å; V58-R62 WeakPolarHBondContact O-CG 3.39Å; V58-R62 PolarHBondContact O-N 3.07Å
59	E	80.3	Confident	76.8	Confident	96 Å²	96	75.1 Å²	75.1	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-44.3	175	-165	-154.2	130.3	0	0	111.7	L55 F57 F61 R62 Q63	L55-E59 PolarHBondContact O-N 2.86Å; F57-E59 VanDerWaalsContact C-N 3.33Å; F57-E59 PolarHBondContact O-N 3.44Å; E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 2.85Å; E59-R62 PolarHBondContact O-N 3.08Å; E59-Q63 WeakPolarHBondContact O-CG 3.27Å; E59-Q63 PolarHBondContact O-N 2.92Å; E59-Q63 VanDerWaalsContact O-N 3.12Å; E59-Q63 PolarHBondContact OE1-NE2 3.43Å
60	R	81.7	Confident	77.7	Confident	49 Å²	49	76 Å²	76	19%	0.185	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-34.4	175.8	-64.4	-76.2	179.3	-111.2	-8.5	111.8	S56 F57 V58 Q63 G64 F65 Y144	S56-R60 WeakPolarHBondContact O-CG 3.31Å; S56-R60 PolarHBondContact O-N 2.87Å; F57-R60 CarbonylContact O-C 3.54Å; F57-R60 PolarHBondContact O-N 2.85Å; V58-R60 PolarHBondContact O-N 3.29Å; R60-Q63 CarbonylContact O-C 3.54Å; R60-Q63 WeakPolarHBondContact O-CA 3.44Å; R60-Q63 WeakPolarHBondContact O-CB 3.06Å; R60-Q63 PolarHBondContact O-N 2.88Å; R60-Q63 VanDerWaalsContact O-N 3.17Å; R60-G64 PolarHBondContact O-N 2.8Å; R60-F65 HydrophobicContact CB-CD2 4.41Å; R60-F65 WeakPolarHBondContact O-CB 3.49Å; R60-F65 WeakPolarHBondContact O-CD2 3.25Å; R60-F65 PolarHBondContact O-N 3.46Å; R60-F65 VanDerWaalsContact O-N 3.15Å; R60-Y144 HydrophobicContact CB-CD1 3.81Å; R60-Y144 HydrophobicContact CB-CE1 4.02Å; R60-Y144 HydrophobicContact CB-CG 4.27Å; R60-Y144 HydrophobicContact CG-CD1 4.08Å; R60-Y144 HydrophobicContact CG-CD2 4.38Å; R60-Y144 HydrophobicContact CG-CE1 3.99Å; R60-Y144 HydrophobicContact CG-CE2 4.31Å; R60-Y144 HydrophobicContact CG-CG 4.28Å
61	F	79.3	Confident	78.6	Confident	109 Å²	109	71.1 Å²	71.1	48%	0.478	33%	0.333	S	S	.	.	H	α-helix	trans	-65.9	-42.6	175.5	-173.3	-94.4	0	0	0	111.7	F57 V58 E59 Q63 G64 F65 T66	F57-F61 HydrophobicContact CE1-CB 4.36Å; F57-F61 HydrophobicContact CE1-CD2 4.37Å; F57-F61 HydrophobicContact CZ-CD2 4.21Å; F57-F61 WeakPolarHBondContact O-CB 3.4Å; F57-F61 PolarHBondContact O-N 2.83Å; V58-F61 WeakPolarHBondContact O-CB 3.34Å; V58-F61 PolarHBondContact O-N 3.16Å; E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 2.85Å; F61-Q63 PolarHBondContact O-N 2.91Å; F61-G64 WeakPolarHBondContact O-CA 3.44Å; F61-G64 PolarHBondContact O-N 3.37Å; F61-F65 VanDerWaalsContact CA-O 3.31Å; F61-F65 WeakPolarHBondContact CA-O 3.48Å; F61-F65 WeakPolarHBondContact CD2-O 3.12Å; F61-T66 HydrophobicContact CE2-CG2 4.37Å
62	R	78.1	Confident	79	Confident	185 Å²	185	74.8 Å²	74.8	70%	0.698	34%	0.343	S	S	*	.	H	α-helix	trans	-60.1	-32.2	170.9	-71.2	176	-178.4	159.6	1.7	112.5	V58 E59 G64	V58-R62 WeakPolarHBondContact O-CG 3.39Å; V58-R62 PolarHBondContact O-N 3.07Å; E59-R62 PolarHBondContact O-N 3.08Å; R62-G64 PolarHBondContact O-N 2.98Å
63	Q	78.8	Confident	79.3	Confident	86 Å²	86	70.1 Å²	70.1	40%	0.402	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	0.6	173.7	-67.8	162.9	9.2	0	0	113.6	E59 R60 F61 F65	E59-Q63 WeakPolarHBondContact O-CG 3.27Å; E59-Q63 PolarHBondContact O-N 2.92Å; E59-Q63 VanDerWaalsContact O-N 3.12Å; E59-Q63 PolarHBondContact OE1-NE2 3.43Å; R60-Q63 CarbonylContact O-C 3.54Å; R60-Q63 WeakPolarHBondContact O-CA 3.44Å; R60-Q63 WeakPolarHBondContact O-CB 3.06Å; R60-Q63 PolarHBondContact O-N 2.88Å; R60-Q63 VanDerWaalsContact O-N 3.17Å; F61-Q63 PolarHBondContact O-N 2.91Å; Q63-F65 HydrophobicContact CB-CD2 4.13Å; Q63-F65 HydrophobicContact CB-CE2 4.22Å
64	G	76.6	Confident	79.4	Confident	25 Å²	25	69.9 Å²	69.9	26%	0.258	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	7	174	0	0	0	0	0	115.5	R60 F61 R62 A146	R60-G64 PolarHBondContact O-N 2.8Å; F61-G64 WeakPolarHBondContact O-CA 3.44Å; F61-G64 PolarHBondContact O-N 3.37Å; R62-G64 PolarHBondContact O-N 2.98Å; G64-A146 WeakPolarHBondContact O-CB 3.36Å
65	F	82.7	Confident	79	Confident	11 Å²	11	69.2 Å²	69.2	5%	0.048	32%	0.317	C	S	.	.			trans	-86.8	118.8	174.9	-61	-80.6	0	0	0	110.8	R60 F61 Q63 Y144 L145 A146 K193	R60-F65 HydrophobicContact CB-CD2 4.41Å; R60-F65 WeakPolarHBondContact O-CB 3.49Å; R60-F65 WeakPolarHBondContact O-CD2 3.25Å; R60-F65 PolarHBondContact O-N 3.46Å; R60-F65 VanDerWaalsContact O-N 3.15Å; F61-F65 VanDerWaalsContact CA-O 3.31Å; F61-F65 WeakPolarHBondContact CA-O 3.48Å; F61-F65 WeakPolarHBondContact CD2-O 3.12Å; Q63-F65 HydrophobicContact CB-CD2 4.13Å; Q63-F65 HydrophobicContact CB-CE2 4.22Å; F65-Y144 WeakPolarHBondContact CD1-O 3.43Å; F65-L145 CarbonylContact C-O 3.45Å; F65-A146 HydrophobicContact CD1-CB 3.93Å; F65-A146 HydrophobicContact CE1-CB 4.32Å; F65-K193 HydrophobicContact CE1-CB 3.92Å; F65-K193 HydrophobicContact CE2-CB 4.15Å; F65-K193 HydrophobicContact CE2-CD 4.29Å; F65-K193 HydrophobicContact CZ-CB 3.69Å; F65-K193 HydrophobicContact CZ-CD 4.46Å
66	T	78.3	Confident	78	Confident	59 Å²	59	68.1 Å²	68.1	36%	0.362	32%	0.32	S	S	.	.			trans	-98.1	-18.5	-171.6	57.1	0	0	0	0	114.2	F61 L145	F61-T66 HydrophobicContact CE2-CG2 4.37Å; T66-L145 PolarHBondContact N-O 3.34Å
67	T	82.5	Confident	77.3	Confident	47 Å²	47	75 Å²	75	29%	0.288	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136	-175.2	-49.8	0	0	0	0	110.4	Y144 L145 K147	T67-Y144 CarbonylContact O-C 3.51Å; T67-Y144 WeakPolarHBondContact O-CA 3.41Å; T67-L145 PolarHBondContact N-O 2.98Å; T67-L145 VanDerWaalsContact N-O 3.09Å; T67-L145 PolarHBondContact O-N 2.87Å; T67-K147 WeakPolarHBondContact OG1-CE 3.41Å
68	R	84.9	Confident	76.7	Confident	94 Å²	94	81 Å²	81	36%	0.355	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.8	172.8	178.8	-174.6	176.9	-162.9	-1	109.3	F57 T142 M143 Y144	F57-R68 HydrophobicContact CD2-CB 3.75Å; F57-R68 HydrophobicContact CD2-CG 4.45Å; F57-R68 HydrophobicContact CE2-CB 3.71Å; R68-T142 HydrophobicContact CG-CG2 3.95Å; R68-M143 CarbonylContact C-O 3.59Å; R68-M143 WeakPolarHBondContact CA-O 3.39Å; R68-Y144 HydrophobicContact CB-CD1 4.1Å; R68-Y144 HydrophobicContact CB-CE1 4.14Å; R68-Y144 HydrophobicContact CG-CD1 4.16Å; R68-Y144 HydrophobicContact CG-CE1 3.84Å
69	Y	84.9	Confident	76.3	Confident	77 Å²	77	85.5 Å²	85.5	30%	0.302	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	132	172.4	-172	-110.3	0	0	0	108.4	I71 T142 M143 H165 A168	Y69-I71 HydrophobicContact CD1-CG2 4.19Å; Y69-I71 HydrophobicContact CE1-CB 4.49Å; Y69-I71 HydrophobicContact CE1-CG2 3.3Å; Y69-I71 HydrophobicContact CE2-CG2 4.45Å; Y69-I71 VanDerWaalsContact CZ-CG2 3.44Å; Y69-I71 WeakPolarHBondContact OH-CG2 3.39Å; Y69-T142 CarbonylContact O-C 3.4Å; Y69-T142 WeakPolarHBondContact O-CA 3.43Å; Y69-M143 HydrophobicContact CD1-SD 4.48Å; Y69-M143 PolarHBondContact N-O 3.09Å; Y69-M143 PolarHBondContact O-N 2.87Å; Y69-H165 AromaticContact CD2-CE1 3.6Å; Y69-H165 AromaticContact CD2-ND1 3.75Å; Y69-H165 AromaticContact CE1-ND1 3.89Å; Y69-H165 AromaticContact CE2-CE1 3.74Å; Y69-H165 AromaticContact CE2-ND1 3.51Å; Y69-H165 AromaticContact CZ-ND1 3.59Å; Y69-A168 HydrophobicContact CD1-CB 4.28Å; Y69-A168 HydrophobicContact CE1-CB 3.8Å
70	K	85.6	Confident	75.8	Confident	51 Å²	51	84.4 Å²	84.4	22%	0.222	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	120	176.1	-177.5	-167.8	175.6	-152.6	0	107.3	E138 A140 L141 E222	K70-E138 WeakPolarHBondContact CE-OE1 3.49Å; K70-E138 IonicContact NZ-OE1 2.64Å; K70-E138 PolarHBondContact NZ-OE1 3.4Å; K70-E138 IonicContact NZ-OE2 2.73Å; K70-A140 HydrophobicContact CG-CB 4.43Å; K70-L141 WeakPolarHBondContact CA-O 3.38Å; K70-E222 IonicContact NZ-OE1 2.66Å; K70-E222 PolarHBondContact NZ-OE1 3.3Å
71	I	84.4	Confident	75.2	Confident	22 Å²	22	88 Å²	88	11%	0.113	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.9	165.4	57.7	174.7	0	0	0	107.7	Y69 A140 L141 A168 Y171 F172	Y69-I71 HydrophobicContact CD1-CG2 4.19Å; Y69-I71 HydrophobicContact CE1-CB 4.49Å; Y69-I71 HydrophobicContact CE1-CG2 3.3Å; Y69-I71 HydrophobicContact CE2-CG2 4.45Å; Y69-I71 VanDerWaalsContact CZ-CG2 3.44Å; Y69-I71 WeakPolarHBondContact OH-CG2 3.39Å; I71-A140 CarbonylContact O-C 3.49Å; I71-A140 WeakPolarHBondContact O-CA 3.39Å; I71-A140 WeakPolarHBondContact O-CB 3.4Å; I71-L141 HydrophobicContact CD1-CB 4.11Å; I71-L141 HydrophobicContact CD1-CD2 3.98Å; I71-L141 HydrophobicContact CG1-CB 3.7Å; I71-L141 HydrophobicContact CG1-CD2 4.34Å; I71-L141 HydrophobicContact CG1-CG 4.47Å; I71-L141 PolarHBondContact N-O 2.76Å; I71-L141 PolarHBondContact O-N 3.23Å; I71-A168 HydrophobicContact CD1-CB 4.29Å; I71-A168 WeakPolarHBondContact CD1-O 3.43Å; I71-Y171 HydrophobicContact CD1-CD1 4.48Å; I71-F172 HydrophobicContact CB-CE2 4.1Å; I71-F172 HydrophobicContact CD1-CE2 4.01Å; I71-F172 HydrophobicContact CG1-CE2 4.11Å; I71-F172 HydrophobicContact CG1-CZ 4.36Å
72	Y	78.9	Confident	74.7	Confident	105 Å²	105	85.7 Å²	85.7	41%	0.412	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	155.3	-178	67	-89.3	0	0	0	110.3	E74 E138 E139 A140 E222	Y72-E74 HydrophobicContact CD2-CG 4.16Å; Y72-E74 HydrophobicContact CE2-CG 4.23Å; Y72-E138 WeakPolarHBondContact CB-OE1 3.33Å; Y72-E139 CarbonylContact C-O 3.44Å; Y72-E139 VanDerWaalsContact CA-O 3.25Å; Y72-E139 WeakPolarHBondContact CA-O 3.23Å; Y72-A140 VanDerWaalsContact CB-CB 3.48Å; Y72-E222 WeakPolarHBondContact CD2-OE2 3.32Å; Y72-E222 WeakPolarHBondContact CE1-OE1 3.38Å; Y72-E222 VanDerWaalsContact CE1-OE2 3.24Å; Y72-E222 WeakPolarHBondContact CE1-OE2 3.5Å; Y72-E222 WeakPolarHBondContact CE2-OE2 3.35Å; Y72-E222 PolarHBondContact OH-OE2 3.27Å; Y72-E222 VanDerWaalsContact OH-OE2 3.08Å
73	R	76	Confident	73.9	Confident	129 Å²	129	82.7 Å²	82.7	49%	0.487	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	131	170.6	179.8	-179.6	179.2	-172.1	1.5	107.4	F75 E139 F172	R73-F75 HydrophobicContact CG-CE1 4.27Å; R73-F75 HydrophobicContact CG-CZ 4.16Å; R73-E139 PolarHBondContact N-O 2.89Å; R73-E139 PolarHBondContact O-N 3.44Å; R73-F172 HydrophobicContact CB-CD1 3.79Å; R73-F172 HydrophobicContact CB-CE1 3.4Å; R73-F172 HydrophobicContact CB-CE2 4.4Å; R73-F172 HydrophobicContact CB-CG 4.46Å; R73-F172 HydrophobicContact CB-CZ 3.77Å
74	E	71	Confident	73	Confident	52 Å²	52	80.3 Å²	80.3	24%	0.243	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	141.4	173.8	-64.5	-180	168.8	0	0	110.6	Y72 R77 G137	Y72-E74 HydrophobicContact CD2-CG 4.16Å; Y72-E74 HydrophobicContact CE2-CG 4.23Å; E74-R77 IonicContact OE2-CZ 2.67Å; E74-R77 IonicContact OE2-NE 2.8Å; E74-R77 PolarHBondContact OE2-NE 3.46Å; E74-R77 IonicContact OE2-NH2 3.99Å; E74-R77 PolarHBondContact OE2-NH2 3.13Å; E74-G137 CarbonylContact C-O 3.53Å; E74-G137 VanDerWaalsContact CA-O 3.29Å; E74-G137 WeakPolarHBondContact CA-O 3.49Å
75	F	64.2	Low	72.5	Confident	48 Å²	48	80.3 Å²	80.3	21%	0.211	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	126.1	173.1	-57	-80.4	0	0	0	109.2	R73 G137 E139 L202	R73-F75 HydrophobicContact CG-CE1 4.27Å; R73-F75 HydrophobicContact CG-CZ 4.16Å; F75-G137 PolarHBondContact N-O 3.32Å; F75-G137 PolarHBondContact O-N 3.11Å; F75-E139 HydrophobicContact CD2-CB 4.44Å; F75-E139 HydrophobicContact CE2-CB 3.54Å; F75-E139 WeakPolarHBondContact CE2-OE2 3.46Å; F75-E139 HydrophobicContact CZ-CB 4.34Å; F75-E139 WeakPolarHBondContact CZ-OE2 3.29Å; F75-L202 HydrophobicContact CD2-CD2 3.58Å; F75-L202 HydrophobicContact CE2-CD2 3.5Å; F75-L202 HydrophobicContact CG-CD2 4.49Å; F75-L202 HydrophobicContact CZ-CD2 4.39Å
76	A	55.4	Low	71.3	Confident	61 Å²	61	83.2 Å²	83.2	50%	0.504	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.1	108.9	177.5	0	0	0	0	0	115.4	G136	A76-G136 WeakPolarHBondContact O-CA 3.41Å
77	R	63.5	Low	70.1	Confident	185 Å²	185	91.3 Å²	91.3	70%	0.698	41%	0.413	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	105.4	176.2	-70.6	178.2	176.5	167.5	-0.6	110.9	E74 T134	E74-R77 IonicContact OE2-CZ 2.67Å; E74-R77 IonicContact OE2-NE 2.8Å; E74-R77 PolarHBondContact OE2-NE 3.46Å; E74-R77 IonicContact OE2-NH2 3.99Å; E74-R77 PolarHBondContact OE2-NH2 3.13Å; R77-T134 HydrophobicContact CB-CG2 4.04Å; R77-T134 HydrophobicContact CG-CG2 4.23Å
78	W	66.1	Low	68.8	Low	180 Å²	180	95.5 Å²	95.5	68%	0.682	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	112	173.9	-57.4	80.9	0	0	0	109.1	V80 T134 L135	W78-V80 PolarHBondContact O-N 2.93Å; W78-T134 CarbonylContact O-C 3.48Å; W78-T134 WeakPolarHBondContact O-CA 3.37Å; W78-L135 HydrophobicContact CB-CB 4.38Å; W78-L135 PolarHBondContact N-O 2.89Å; W78-L135 PolarHBondContact O-N 2.74Å
79	K	69.1	Low	67.5	Low	125 Å²	125	96.4 Å²	96.4	54%	0.543	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	103.8	171	-171.9	176.7	-177.3	178.6	0	108.7
80	V	70.4	Confident	66.3	Low	72 Å²	72	95.3 Å²	95.3	44%	0.436	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	127.1	174.1	-177.8	0	0	0	0	108.8	W78 S132 A133 L135	W78-V80 PolarHBondContact O-N 2.93Å; V80-S132 CarbonylContact O-C 3.54Å; V80-S132 VanDerWaalsContact O-CA 3.29Å; V80-S132 WeakPolarHBondContact O-CA 3.06Å; V80-S132 WeakPolarHBondContact O-CB 3.23Å; V80-A133 PolarHBondContact N-O 2.8Å; V80-A133 PolarHBondContact O-N 2.79Å; V80-L135 HydrophobicContact CB-CD1 4.05Å; V80-L135 HydrophobicContact CB-CG 4.28Å; V80-L135 HydrophobicContact CG2-CB 4.46Å; V80-L135 HydrophobicContact CG2-CD1 3.38Å; V80-L135 HydrophobicContact CG2-CG 3.81Å
81	R	68.8	Low	64.9	Low	125 Å²	125	100.3 Å²	100.3	47%	0.472	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	136.9	177.2	-69.7	167.1	-179	-130.5	13	108.8	T83 E86	R81-T83 PolarHBondContact O-N 3.34Å; R81-T83 VanDerWaalsContact O-N 3.13Å; R81-E86 WeakPolarHBondContact CB-OE2 3.41Å; R81-E86 WeakPolarHBondContact CD-OE1 3.49Å; R81-E86 WeakPolarHBondContact CD-OE2 3.44Å; R81-E86 IonicContact CZ-OE1 3.13Å; R81-E86 IonicContact NE-OE1 3.37Å; R81-E86 IonicContact NH1-OE1 2.67Å; R81-E86 PolarHBondContact NH1-OE1 2.91Å; R81-E86 IonicContact NH1-OE2 3.07Å
82	N	69.2	Low	63.5	Low	60 Å²	60	109 Å²	109	32%	0.321	49%	0.493	S	S	.	.			trans	-78.6	95.1	173	-169.4	-18.4	0	0	0	109.1	A84 I85 E86 L130 I131	N82-A84 PolarHBondContact O-N 2.77Å; N82-A84 VanDerWaalsContact O-N 3.15Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 3.39Å; N82-I85 WeakPolarHBondContact ND2-CD1 3.28Å; N82-I85 PolarHBondContact O-N 3.24Å; N82-I85 VanDerWaalsContact O-N 3.08Å; N82-E86 PolarHBondContact O-N 3.02Å; N82-E86 VanDerWaalsContact O-N 3.14Å; N82-L130 PolarHBondContact ND2-O 2.93Å; N82-I131 WeakPolarHBondContact CB-O 3.29Å; N82-I131 PolarHBondContact N-O 3.48Å
83	T	60.6	Low	62.6	Low	123 Å²	123	107.9 Å²	107.9	76%	0.755	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.9	-178.7	53.7	0	0	0	0	113.3	R81 I85	R81-T83 PolarHBondContact O-N 3.34Å; R81-T83 VanDerWaalsContact O-N 3.13Å; T83-I85 VanDerWaalsContact C-N 3.34Å
84	A	60.5	Low	62.1	Low	35 Å²	35	106.7 Å²	106.7	29%	0.289	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.3	175.2	0	0	0	0	0	113.2	N82	N82-A84 PolarHBondContact O-N 2.77Å; N82-A84 VanDerWaalsContact O-N 3.15Å; N82-A84 WeakPolarHBondContact OD1-CB 3.42Å; N82-A84 PolarHBondContact OD1-N 3.39Å
85	I	66	Low	62	Low	26 Å²	26	105.6 Å²	105.6	13%	0.133	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-31.5	-171.5	-57.9	176.9	0	0	0	112.1	N82 T83 R87 I129 I131	N82-I85 WeakPolarHBondContact ND2-CD1 3.28Å; N82-I85 PolarHBondContact O-N 3.24Å; N82-I85 VanDerWaalsContact O-N 3.08Å; T83-I85 VanDerWaalsContact C-N 3.34Å; I85-R87 VanDerWaalsContact C-N 3.32Å; I85-R87 PolarHBondContact O-N 2.99Å; I85-R87 VanDerWaalsContact O-N 3.16Å; I85-I129 HydrophobicContact CD1-CD1 3.99Å; I85-I129 HydrophobicContact CD1-CG1 4.45Å; I85-I131 HydrophobicContact CG2-CG1 4.1Å
86	E	56.6	Low	62.6	Low	71 Å²	71	108.7 Å²	108.7	33%	0.332	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-18.8	-165.5	-156.6	177.3	-159.1	0	0	115.8	R81 N82	R81-E86 WeakPolarHBondContact CB-OE2 3.41Å; R81-E86 WeakPolarHBondContact CD-OE1 3.49Å; R81-E86 WeakPolarHBondContact CD-OE2 3.44Å; R81-E86 IonicContact CZ-OE1 3.13Å; R81-E86 IonicContact NE-OE1 3.37Å; R81-E86 IonicContact NH1-OE1 2.67Å; R81-E86 PolarHBondContact NH1-OE1 2.91Å; R81-E86 IonicContact NH1-OE2 3.07Å; N82-E86 PolarHBondContact O-N 3.02Å; N82-E86 VanDerWaalsContact O-N 3.14Å
87	R	53.9	Low	63.9	Low	230 Å²	230	108 Å²	108	87%	0.868	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-149.4	38.3	-173.4	-75.6	-168.6	173.7	173.6	-3	116.2	I85	I85-R87 VanDerWaalsContact C-N 3.32Å; I85-R87 PolarHBondContact O-N 2.99Å; I85-R87 VanDerWaalsContact O-N 3.16Å
88	R	55.7	Low	64.9	Low	134 Å²	134	105.2 Å²	105.2	51%	0.506	51%	0.509	S	S	.	.			trans	-128.3	131.8	173.7	-71.2	-178.3	176	-167	1.1	111.8	L90 N93	R88-L90 PolarHBondContact O-N 2.93Å; R88-N93 HydrophobicContact CB-CB 4.45Å; R88-N93 HydrophobicContact CG-CB 4.4Å
89	D	57	Low	66	Low	114 Å²	114	101.4 Å²	101.4	61%	0.61	51%	0.507	S	S	*	.			trans	-56.9	103.2	155.6	-81.7	-27.6	0	0	0	107	I91 R92 N93	D89-I91 PolarHBondContact O-N 3.15Å; D89-R92 HydrophobicContact CB-CB 4.14Å; D89-R92 PolarHBondContact O-N 3.2Å; D89-N93 PolarHBondContact O-N 3.39Å
90	L	60	Low	67	Low	54 Å²	54	99.7 Å²	99.7	28%	0.283	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-16.4	-179.7	-66.8	166.5	0	0	0	112.4	R88 V95 V232	R88-L90 PolarHBondContact O-N 2.93Å; L90-V95 HydrophobicContact CD2-CG2 3.37Å; L90-V232 HydrophobicContact CD1-CB 4.43Å; L90-V232 HydrophobicContact CD1-CG1 3.39Å
91	I	56	Low	67.9	Low	155 Å²	155	96.9 Å²	96.9	80%	0.795	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-35.8	174.4	-56	173.7	0	0	0	111.7	D89	D89-I91 PolarHBondContact O-N 3.15Å
92	R	54.7	Low	68.8	Low	204 Å²	204	94.2 Å²	94.2	77%	0.77	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-29.8	-178.3	-79.3	-176.8	179.6	-115.7	1.5	113.6	D89	D89-R92 HydrophobicContact CB-CB 4.14Å; D89-R92 PolarHBondContact O-N 3.2Å
93	N	60.1	Low	69.8	Low	83 Å²	83	99.3 Å²	99.3	44%	0.444	49%	0.491	S	S	.	.	S	Bend	trans	-135.7	96.8	180	-76.5	-43.2	0	0	0	110.3	R88 D89	R88-N93 HydrophobicContact CB-CB 4.45Å; R88-N93 HydrophobicContact CG-CB 4.4Å; D89-N93 PolarHBondContact O-N 3.39Å
94	P	66.3	Low	71.2	Confident	103 Å²	103	94 Å²	94	67%	0.669	46%	0.458	S	S	*	.			trans	-64.4	138.5	-178.6	26.1	-33.1	0	0	0	111.1
95	V	68.4	Low	72.6	Confident	29 Å²	29	93.5 Å²	93.5	18%	0.176	45%	0.452	C	S	.	.			trans	-67.3	134.6	174.5	175.9	0	0	0	0	108.6	L90 L97	L90-V95 HydrophobicContact CD2-CG2 3.37Å; V95-L97 HydrophobicContact CB-CD2 4.42Å; V95-L97 HydrophobicContact CG1-CD2 4.29Å; V95-L97 PolarHBondContact O-N 3.2Å
96	P	76.3	Confident	73.7	Confident	113 Å²	113	101.4 Å²	101.4	73%	0.734	48%	0.48	S	S	*	.			trans	-65.7	100.1	172.2	26.7	-32.7	0	0	0	109.3
97	L	83	Confident	75.2	Confident	47 Å²	47	104.2 Å²	104.2	25%	0.246	50%	0.497	C	S	.	.			trans	-82.3	147.5	177.5	-57.2	174.9	0	0	0	110.3	V95 F101 Q102 I233	V95-L97 HydrophobicContact CB-CD2 4.42Å; V95-L97 HydrophobicContact CG1-CD2 4.29Å; V95-L97 PolarHBondContact O-N 3.2Å; L97-F101 HydrophobicContact CB-CD1 4.24Å; L97-F101 HydrophobicContact CD1-CD1 4.01Å; L97-F101 HydrophobicContact CD1-CE1 4.11Å; L97-F101 HydrophobicContact CD2-CD1 4.38Å; L97-F101 HydrophobicContact CG-CD1 4.44Å; L97-Q102 HydrophobicContact CB-CG 3.67Å; L97-Q102 HydrophobicContact CD1-CG 4.29Å; L97-Q102 PolarHBondContact O-NE2 2.88Å; L97-I233 HydrophobicContact CD1-CG2 3.65Å; L97-I233 HydrophobicContact CD2-CD1 4.18Å; L97-I233 HydrophobicContact CD2-CG2 3.64Å; L97-I233 HydrophobicContact CG-CG2 4.28Å
98	M	85.6	Confident	76.9	Confident	126 Å²	126	93.7 Å²	93.7	62%	0.621	46%	0.457	S	S	*	.			trans	-55.9	134.9	173.1	-72	174.3	67.6	0	0	110.4	E100 F101 Q102	M98-E100 PolarHBondContact O-N 2.96Å; M98-E100 VanDerWaalsContact O-N 3.11Å; M98-F101 HydrophobicContact CB-CB 4.26Å; M98-F101 WeakPolarHBondContact O-CB 3.28Å; M98-F101 PolarHBondContact O-N 2.8Å; M98-Q102 PolarHBondContact O-N 2.87Å
99	P	87.5	Confident	78.4	Confident	101 Å²	101	89.1 Å²	89.1	66%	0.656	45%	0.452	S	S	*	.	H	α-helix	trans	-55.1	-34.1	-178.4	-27.8	34.4	0	0	0	113.5	Q102 R103	P99-Q102 PolarHBondContact O-N 3.24Å; P99-R103 WeakPolarHBondContact O-CB 3.39Å; P99-R103 PolarHBondContact O-N 3.12Å
100	E	90.4	Very high	79.8	Confident	88 Å²	88	94 Å²	94	41%	0.411	46%	0.462	S	S	.	.	H	α-helix	trans	-67.5	-40.5	176.1	-166.9	-171	-173.2	0	0	112.8	M98 R103 S104 K124	M98-E100 PolarHBondContact O-N 2.96Å; M98-E100 VanDerWaalsContact O-N 3.11Å; E100-R103 PolarHBondContact O-N 2.85Å; E100-S104 PolarHBondContact O-N 2.78Å; E100-S104 PolarHBondContact O-OG 2.8Å; E100-K124 WeakPolarHBondContact OE1-CE 3.26Å; E100-K124 IonicContact OE1-NZ 2.93Å; E100-K124 PolarHBondContact OE1-NZ 2.89Å
101	F	89.8	Confident	81	Confident	14 Å²	14	102.9 Å²	102.9	6%	0.061	49%	0.492	C	S	.	.	H	α-helix	trans	-65.1	-45	175	-177.6	-99.3	0	0	0	110.2	L97 M98 R103 S104 V105 I121 Y125 L230 I233 F234	L97-F101 HydrophobicContact CB-CD1 4.24Å; L97-F101 HydrophobicContact CD1-CD1 4.01Å; L97-F101 HydrophobicContact CD1-CE1 4.11Å; L97-F101 HydrophobicContact CD2-CD1 4.38Å; L97-F101 HydrophobicContact CG-CD1 4.44Å; M98-F101 HydrophobicContact CB-CB 4.26Å; M98-F101 WeakPolarHBondContact O-CB 3.28Å; M98-F101 PolarHBondContact O-N 2.8Å; F101-R103 VanDerWaalsContact C-N 3.29Å; F101-R103 PolarHBondContact O-N 2.85Å; F101-S104 WeakPolarHBondContact O-CB 3.35Å; F101-S104 PolarHBondContact O-N 2.76Å; F101-S104 VanDerWaalsContact O-N 3.1Å; F101-V105 HydrophobicContact CD1-CG2 4Å; F101-V105 HydrophobicContact CE1-CG2 3.67Å; F101-V105 HydrophobicContact CZ-CG2 3.99Å; F101-V105 VanDerWaalsContact O-CG2 3.29Å; F101-V105 WeakPolarHBondContact O-CG2 3.27Å; F101-V105 PolarHBondContact O-N 2.86Å; F101-I121 HydrophobicContact CE2-CD1 4.3Å; F101-Y125 HydrophobicContact CB-CE1 4.35Å; F101-Y125 AromaticContact CD2-CD1 3.87Å; F101-Y125 HydrophobicContact CD2-CD1 3.87Å; F101-Y125 AromaticContact CD2-CD2 3.6Å; F101-Y125 HydrophobicContact CD2-CD2 3.6Å; F101-Y125 AromaticContact CD2-CE1 3.99Å; F101-Y125 HydrophobicContact CD2-CE1 3.99Å; F101-Y125 AromaticContact CD2-CE2 3.73Å; F101-Y125 HydrophobicContact CD2-CE2 3.73Å; F101-Y125 AromaticContact CD2-CG 3.67Å; F101-Y125 HydrophobicContact CD2-CG 3.67Å; F101-Y125 AromaticContact CD2-CZ 3.93Å; F101-Y125 AromaticContact CE2-CD2 3.88Å; F101-Y125 HydrophobicContact CE2-CD2 3.88Å; F101-Y125 HydrophobicContact CE2-CE2 4.39Å; F101-Y125 AromaticContact CE2-CG 3.94Å; F101-Y125 HydrophobicContact CE2-CG 3.94Å; F101-L230 HydrophobicContact CE2-CD2 4.2Å; F101-L230 HydrophobicContact CZ-CD1 4.07Å; F101-L230 HydrophobicContact CZ-CD2 4.23Å; F101-L230 HydrophobicContact CZ-CG 4.43Å; F101-I233 HydrophobicContact CE1-CG2 3.89Å; F101-F234 HydrophobicContact CE2-CZ 4.47Å; F101-F234 HydrophobicContact CZ-CE1 4.22Å; F101-F234 AromaticContact CZ-CZ 3.83Å; F101-F234 HydrophobicContact CZ-CZ 3.83Å
102	Q	87.3	Confident	82.7	Confident	69 Å²	69	95.9 Å²	95.9	32%	0.322	46%	0.456	S	S	.	.	H	α-helix	trans	-59	-40.3	175.6	-65.9	-177.5	-8.6	0	0	112.4	L97 M98 P99 V105 R106	L97-Q102 HydrophobicContact CB-CG 3.67Å; L97-Q102 HydrophobicContact CD1-CG 4.29Å; L97-Q102 PolarHBondContact O-NE2 2.88Å; M98-Q102 PolarHBondContact O-N 2.87Å; P99-Q102 PolarHBondContact O-N 3.24Å; Q102-V105 PolarHBondContact O-N 3.19Å; Q102-R106 WeakPolarHBondContact O-CG 3.36Å; Q102-R106 PolarHBondContact O-N 2.94Å
103	R	89.9	Confident	84.3	Confident	167 Å²	167	89.7 Å²	89.7	63%	0.63	44%	0.441	S	S	*	.	H	α-helix	trans	-61.9	-46	174.4	-170.9	-174.2	-63.2	164	-0.6	110.9	P99 E100 F101 V105 R106 L107	P99-R103 WeakPolarHBondContact O-CB 3.39Å; P99-R103 PolarHBondContact O-N 3.12Å; E100-R103 PolarHBondContact O-N 2.85Å; F101-R103 VanDerWaalsContact C-N 3.29Å; F101-R103 PolarHBondContact O-N 2.85Å; R103-V105 VanDerWaalsContact C-N 3.32Å; R103-V105 PolarHBondContact O-N 2.97Å; R103-R106 PolarHBondContact O-N 3.44Å; R103-R106 VanDerWaalsContact O-N 3.15Å; R103-L107 HydrophobicContact CG-CD1 4.34Å; R103-L107 WeakPolarHBondContact O-CG 3.08Å; R103-L107 PolarHBondContact O-N 3.43Å
104	S	90.9	Very high	85.6	Confident	10 Å²	10	86 Å²	86	7%	0.07	42%	0.422	C	S	.	.	H	α-helix	trans	-58.7	-42	176.5	-56.9	0	0	0	0	112	E100 F101 L107 Y125	E100-S104 PolarHBondContact O-N 2.78Å; E100-S104 PolarHBondContact O-OG 2.8Å; F101-S104 WeakPolarHBondContact O-CB 3.35Å; F101-S104 PolarHBondContact O-N 2.76Å; F101-S104 VanDerWaalsContact O-N 3.1Å; S104-L107 PolarHBondContact O-N 2.8Å; S104-Y125 PolarHBondContact OG-OH 2.81Å
105	V	89.1	Confident	86.6	Confident	25 Å²	25	85.1 Å²	85.1	15%	0.152	41%	0.409	C	S	.	.	H	α-helix	trans	-64.3	-41.5	175	-177.5	0	0	0	0	111.8	F101 Q102 R103 L107 L108 I121 F234 L238	F101-V105 HydrophobicContact CD1-CG2 4Å; F101-V105 HydrophobicContact CE1-CG2 3.67Å; F101-V105 HydrophobicContact CZ-CG2 3.99Å; F101-V105 VanDerWaalsContact O-CG2 3.29Å; F101-V105 WeakPolarHBondContact O-CG2 3.27Å; F101-V105 PolarHBondContact O-N 2.86Å; Q102-V105 PolarHBondContact O-N 3.19Å; R103-V105 VanDerWaalsContact C-N 3.32Å; R103-V105 PolarHBondContact O-N 2.97Å; V105-L107 VanDerWaalsContact C-N 3.31Å; V105-L107 PolarHBondContact O-N 2.99Å; V105-L108 WeakPolarHBondContact O-CB 3.18Å; V105-L108 PolarHBondContact O-N 2.97Å; V105-I121 HydrophobicContact CG2-CD1 4.39Å; V105-F234 HydrophobicContact CB-CE1 4.35Å; V105-F234 HydrophobicContact CG1-CD1 3.96Å; V105-F234 HydrophobicContact CG1-CE1 4.02Å; V105-F234 HydrophobicContact CG2-CD1 4.19Å; V105-F234 HydrophobicContact CG2-CE1 3.55Å; V105-F234 HydrophobicContact CG2-CZ 4.44Å; V105-L238 HydrophobicContact CG1-CD1 4.5Å
106	R	88.5	Confident	87.6	Confident	192 Å²	192	88.2 Å²	88.2	73%	0.725	42%	0.421	S	S	*	.	H	α-helix	trans	-65.6	-33.8	178	-70.9	175.1	-170.3	171	5.3	112.7	Q102 R103 L108 G109	Q102-R106 WeakPolarHBondContact O-CG 3.36Å; Q102-R106 PolarHBondContact O-N 2.94Å; R103-R106 PolarHBondContact O-N 3.44Å; R103-R106 VanDerWaalsContact O-N 3.15Å; R106-L108 PolarHBondContact O-N 3.41Å; R106-G109 PolarHBondContact O-N 2.86Å
107	L	89.4	Confident	88.3	Confident	130 Å²	130	82.9 Å²	82.9	68%	0.681	39%	0.387	S	S	*	.	H	α-helix	trans	-66.6	-22.9	178.8	-73.5	169.4	0	0	0	113.5	R103 S104 V105 G109	R103-L107 HydrophobicContact CG-CD1 4.34Å; R103-L107 WeakPolarHBondContact O-CG 3.08Å; R103-L107 PolarHBondContact O-N 3.43Å; S104-L107 PolarHBondContact O-N 2.8Å; V105-L107 VanDerWaalsContact C-N 3.31Å; V105-L107 PolarHBondContact O-N 2.99Å; L107-G109 VanDerWaalsContact C-N 3.29Å; L107-G109 PolarHBondContact O-N 3.5Å
108	L	89.2	Confident	88.6	Confident	9 Å²	9	80.6 Å²	80.6	5%	0.047	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.2	177.2	-67.9	171.2	0	0	0	113.5	V105 R106 P112 Q116 F117 T120 I121	V105-L108 WeakPolarHBondContact O-CB 3.18Å; V105-L108 PolarHBondContact O-N 2.97Å; R106-L108 PolarHBondContact O-N 3.41Å; L108-P112 HydrophobicContact CB-CB 4.04Å; L108-P112 HydrophobicContact CB-CG 4.22Å; L108-P112 HydrophobicContact CD2-CB 4.04Å; L108-P112 WeakPolarHBondContact O-CB 3.33Å; L108-Q116 HydrophobicContact CD2-CB 4.39Å; L108-F117 HydrophobicContact CD1-CD1 3.74Å; L108-F117 HydrophobicContact CD1-CE1 3.34Å; L108-F117 HydrophobicContact CD1-CG 4.49Å; L108-F117 HydrophobicContact CD1-CZ 3.82Å; L108-F117 HydrophobicContact CD2-CD1 4.22Å; L108-F117 HydrophobicContact CD2-CG 4.31Å; L108-T120 HydrophobicContact CD2-CG2 4.43Å; L108-I121 HydrophobicContact CD1-CD1 4.24Å; L108-I121 HydrophobicContact CD1-CG1 3.72Å; L108-I121 HydrophobicContact CG-CG1 4.47Å
109	G	86.8	Confident	88.7	Confident	38 Å²	38	78.3 Å²	78.3	39%	0.392	37%	0.365	S	S	.	.			trans	66.1	-160.3	-175.9	0	0	0	0	0	113.9	R106 L107	R106-G109 PolarHBondContact O-N 2.86Å; L107-G109 VanDerWaalsContact C-N 3.29Å; L107-G109 PolarHBondContact O-N 3.5Å
110	R	85.6	Confident	88.9	Confident	217 Å²	217	75.5 Å²	75.5	82%	0.819	35%	0.346	S	S	*	.	S	Bend	trans	-84.3	-27.2	-174.6	-72.2	-175.4	177.4	169.2	-0.5	114.6
111	R	86.3	Confident	88.9	Confident	240 Å²	240	71.3 Å²	71.3	91%	0.906	33%	0.326	S	S	*	.	S	Bend	trans	-139	67.2	-176	-66.9	-174.5	179.7	179.6	-0.5	110.6
112	P	90.6	Very high	89	Confident	8 Å²	8	70.9 Å²	70.9	5%	0.052	33%	0.325	C	S	.	.			trans	-66.1	147.1	177.4	27.3	-36	0	0	0	112	L108 Q116 F117 L238	L108-P112 HydrophobicContact CB-CB 4.04Å; L108-P112 HydrophobicContact CB-CG 4.22Å; L108-P112 HydrophobicContact CD2-CB 4.04Å; L108-P112 WeakPolarHBondContact O-CB 3.33Å; P112-Q116 HydrophobicContact CB-CB 4.45Å; P112-F117 HydrophobicContact CB-CD2 3.84Å; P112-F117 HydrophobicContact CB-CE2 3.96Å; P112-F117 HydrophobicContact CG-CD2 3.51Å; P112-F117 HydrophobicContact CG-CE2 3.11Å; P112-F117 HydrophobicContact CG-CZ 3.9Å; P112-L238 HydrophobicContact CG-CD2 3.75Å
113	T	88.8	Confident	89	Confident	74 Å²	74	73.1 Å²	73.1	45%	0.454	33%	0.333	S	S	.	.			trans	-74.7	161.1	168.9	66.9	0	0	0	0	110.8	Q115 Q116 F117	T113-Q115 PolarHBondContact O-N 2.91Å; T113-Q116 PolarHBondContact O-N 3.35Å; T113-Q116 VanDerWaalsContact OG1-CG 3.26Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.3Å; T113-Q116 PolarHBondContact OG1-N 3.05Å; T113-F117 PolarHBondContact O-N 3.28Å
114	T	87.7	Confident	88.9	Confident	6 Å²	6	70.7 Å²	70.7	4%	0.037	33%	0.327	C	S	.	.	H	α-helix	trans	-54.8	-44.3	176.6	-50.8	0	0	0	0	110.7	F117 I118 K241 E257	T114-F117 WeakPolarHBondContact O-CB 3.39Å; T114-F117 PolarHBondContact O-N 3.1Å; T114-I118 HydrophobicContact CG2-CD1 4.12Å; T114-I118 WeakPolarHBondContact O-CG1 3.37Å; T114-I118 PolarHBondContact O-N 3.23Å; T114-K241 WeakPolarHBondContact OG1-CE 3.27Å; T114-K241 PolarHBondContact OG1-NZ 3.2Å; T114-E257 WeakPolarHBondContact CB-OE1 3.41Å; T114-E257 PolarHBondContact OG1-OE1 3.29Å
115	Q	87.2	Confident	88.9	Confident	84 Å²	84	73 Å²	73	39%	0.393	34%	0.335	S	S	.	.	H	α-helix	trans	-65.9	-41.2	-179.8	-162.8	62.6	13.5	0	0	113.3	T113 F117 I118 D119 G254	T113-Q115 PolarHBondContact O-N 2.91Å; Q115-F117 VanDerWaalsContact C-N 3.28Å; Q115-F117 PolarHBondContact O-N 3.22Å; Q115-I118 PolarHBondContact O-N 2.9Å; Q115-I118 VanDerWaalsContact O-N 3.13Å; Q115-D119 PolarHBondContact NE2-OD2 3.14Å; Q115-D119 PolarHBondContact O-N 2.79Å; Q115-G254 PolarHBondContact OE1-O 3.18Å; Q115-G254 VanDerWaalsContact OE1-O 3.11Å
116	Q	89.5	Confident	88.8	Confident	95 Å²	95	73.2 Å²	73.2	44%	0.444	34%	0.342	S	S	.	.	H	α-helix	trans	-60.1	-40.1	176.6	-75.8	169.8	-14	0	0	111.7	L108 P112 T113 T120	L108-Q116 HydrophobicContact CD2-CB 4.39Å; P112-Q116 HydrophobicContact CB-CB 4.45Å; T113-Q116 PolarHBondContact O-N 3.35Å; T113-Q116 VanDerWaalsContact OG1-CG 3.26Å; T113-Q116 WeakPolarHBondContact OG1-CG 3.3Å; T113-Q116 PolarHBondContact OG1-N 3.05Å; Q116-T120 WeakPolarHBondContact O-CB 3.37Å; Q116-T120 PolarHBondContact O-N 2.87Å; Q116-T120 PolarHBondContact O-OG1 3.01Å
117	F	90.9	Very high	88.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.8	-43.5	173.9	-104.8	-62.4	0	0	0	112.6	L108 P112 T113 T114 Q115 I121 I122 F234 L238 K241 F242	L108-F117 HydrophobicContact CD1-CD1 3.74Å; L108-F117 HydrophobicContact CD1-CE1 3.34Å; L108-F117 HydrophobicContact CD1-CG 4.49Å; L108-F117 HydrophobicContact CD1-CZ 3.82Å; L108-F117 HydrophobicContact CD2-CD1 4.22Å; L108-F117 HydrophobicContact CD2-CG 4.31Å; P112-F117 HydrophobicContact CB-CD2 3.84Å; P112-F117 HydrophobicContact CB-CE2 3.96Å; P112-F117 HydrophobicContact CG-CD2 3.51Å; P112-F117 HydrophobicContact CG-CE2 3.11Å; P112-F117 HydrophobicContact CG-CZ 3.9Å; T113-F117 PolarHBondContact O-N 3.28Å; T114-F117 WeakPolarHBondContact O-CB 3.39Å; T114-F117 PolarHBondContact O-N 3.1Å; Q115-F117 VanDerWaalsContact C-N 3.28Å; Q115-F117 PolarHBondContact O-N 3.22Å; F117-I121 HydrophobicContact CD1-CB 4.35Å; F117-I121 HydrophobicContact CD1-CG1 4.14Å; F117-I121 HydrophobicContact CE1-CG1 4.44Å; F117-I121 WeakPolarHBondContact O-CB 3.41Å; F117-I121 PolarHBondContact O-N 2.86Å; F117-I122 PolarHBondContact O-N 2.94Å; F117-I122 VanDerWaalsContact O-N 3.09Å; F117-F234 HydrophobicContact CE1-CE1 4.44Å; F117-L238 HydrophobicContact CE2-CD2 4.23Å; F117-L238 HydrophobicContact CZ-CB 4.06Å; F117-L238 HydrophobicContact CZ-CD1 4.35Å; F117-L238 HydrophobicContact CZ-CD2 4.06Å; F117-L238 HydrophobicContact CZ-CG 4.36Å; F117-K241 HydrophobicContact CD2-CB 4.47Å; F117-K241 HydrophobicContact CD2-CG 3.84Å; F117-K241 HydrophobicContact CE2-CB 3.92Å; F117-K241 HydrophobicContact CE2-CG 3.72Å; F117-F242 HydrophobicContact CD1-CD2 4.04Å; F117-F242 HydrophobicContact CE1-CB 4.07Å; F117-F242 HydrophobicContact CE1-CD2 4Å; F117-F242 HydrophobicContact CZ-CB 4.18Å
118	I	88.7	Confident	88.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.305	C	S	.	.	I	π-helix	trans	-61.4	-49.6	-179.4	-70	174	0	0	0	110.7	T114 Q115 I122 K123 Y249	T114-I118 HydrophobicContact CG2-CD1 4.12Å; T114-I118 WeakPolarHBondContact O-CG1 3.37Å; T114-I118 PolarHBondContact O-N 3.23Å; Q115-I118 PolarHBondContact O-N 2.9Å; Q115-I118 VanDerWaalsContact O-N 3.13Å; I118-I122 HydrophobicContact CG1-CD1 3.91Å; I118-I122 PolarHBondContact O-N 3.21Å; I118-K123 HydrophobicContact CG2-CD 4.28Å; I118-K123 HydrophobicContact CG2-CG 4.19Å; I118-K123 WeakPolarHBondContact O-CB 3.47Å; I118-K123 WeakPolarHBondContact O-CG 3.22Å; I118-K123 PolarHBondContact O-N 3.05Å; I118-Y249 HydrophobicContact CG2-CD2 3.67Å; I118-Y249 HydrophobicContact CG2-CE2 4.27Å; I118-Y249 HydrophobicContact CG2-CG 4.46Å
119	D	89.3	Confident	88.4	Confident	77 Å²	77	64.7 Å²	64.7	41%	0.412	31%	0.309	S	S	.	.	I	π-helix	trans	-76.3	-36.9	-174.2	-67.7	-30.3	0	0	0	113	Q115 K123	Q115-D119 PolarHBondContact NE2-OD2 3.14Å; Q115-D119 PolarHBondContact O-N 2.79Å; D119-K123 WeakPolarHBondContact OD1-CE 3.39Å; D119-K123 IonicContact OD1-NZ 3.44Å; D119-K123 PolarHBondContact OD1-NZ 3.33Å
120	T	90.1	Very high	88.1	Confident	42 Å²	42	65.6 Å²	65.6	26%	0.258	31%	0.305	S	S	.	.	I	π-helix	trans	-85.2	-38.2	-175.2	-49.2	0	0	0	0	112.7	L108 Q116	L108-T120 HydrophobicContact CD2-CG2 4.43Å; Q116-T120 WeakPolarHBondContact O-CB 3.37Å; Q116-T120 PolarHBondContact O-N 2.87Å; Q116-T120 PolarHBondContact O-OG1 3.01Å
121	I	92.3	Very high	87.8	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.269	C	S	.	.	I	π-helix	trans	-111.1	-60.9	-173.7	-60.4	-58.8	0	0	0	111.7	F101 V105 L108 F117 K124 Y125 L230 F234 F242	F101-I121 HydrophobicContact CE2-CD1 4.3Å; V105-I121 HydrophobicContact CG2-CD1 4.39Å; L108-I121 HydrophobicContact CD1-CD1 4.24Å; L108-I121 HydrophobicContact CD1-CG1 3.72Å; L108-I121 HydrophobicContact CG-CG1 4.47Å; F117-I121 HydrophobicContact CD1-CB 4.35Å; F117-I121 HydrophobicContact CD1-CG1 4.14Å; F117-I121 HydrophobicContact CE1-CG1 4.44Å; F117-I121 WeakPolarHBondContact O-CB 3.41Å; F117-I121 PolarHBondContact O-N 2.86Å; I121-K124 PolarHBondContact O-N 2.84Å; I121-Y125 HydrophobicContact CD1-CD2 4.39Å; I121-Y125 PolarHBondContact O-N 2.88Å; I121-L230 HydrophobicContact CG2-CD2 3.87Å; I121-F234 HydrophobicContact CD1-CE1 4.42Å; I121-F234 HydrophobicContact CD1-CZ 4.28Å; I121-F234 HydrophobicContact CG1-CE1 4.45Å; I121-F234 HydrophobicContact CG1-CZ 4.14Å; I121-F234 HydrophobicContact CG2-CE2 4.24Å; I121-F234 HydrophobicContact CG2-CZ 3.66Å; I121-F242 HydrophobicContact CG2-CD2 4.36Å; I121-F242 HydrophobicContact CG2-CE2 3.83Å
122	I	90.3	Very high	87.4	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	23%	0.23	C	C	.	.	I	π-helix	trans	-67.8	-45.5	-163.1	-64.9	162.1	0	0	0	111.6	F117 I118 K124 G126 T127 F242 A246 Y249	F117-I122 PolarHBondContact O-N 2.94Å; F117-I122 VanDerWaalsContact O-N 3.09Å; I118-I122 HydrophobicContact CG1-CD1 3.91Å; I118-I122 PolarHBondContact O-N 3.21Å; I122-K124 VanDerWaalsContact C-N 3.27Å; I122-K124 PolarHBondContact O-N 2.9Å; I122-G126 WeakPolarHBondContact O-CA 3.17Å; I122-G126 PolarHBondContact O-N 2.96Å; I122-T127 HydrophobicContact CG2-CG2 3.8Å; I122-F242 HydrophobicContact CD1-CE2 4.48Å; I122-F242 HydrophobicContact CG1-CD2 4.48Å; I122-F242 HydrophobicContact CG1-CE2 3.87Å; I122-A246 HydrophobicContact CD1-CB 4.22Å; I122-Y249 HydrophobicContact CG2-CD1 3.54Å; I122-Y249 HydrophobicContact CG2-CD2 4.48Å; I122-Y249 HydrophobicContact CG2-CE1 3.97Å; I122-Y249 HydrophobicContact CG2-CG 3.83Å
123	K	87.1	Confident	86.6	Confident	117 Å²	117	44.9 Å²	44.9	51%	0.509	23%	0.229	S	C	.	.	H	α-helix	trans	-64.4	-31.7	177.7	-75.9	179.1	179.9	165	0	112.8	I118 D119 Y249	I118-K123 HydrophobicContact CG2-CD 4.28Å; I118-K123 HydrophobicContact CG2-CG 4.19Å; I118-K123 WeakPolarHBondContact O-CB 3.47Å; I118-K123 WeakPolarHBondContact O-CG 3.22Å; I118-K123 PolarHBondContact O-N 3.05Å; D119-K123 WeakPolarHBondContact OD1-CE 3.39Å; D119-K123 IonicContact OD1-NZ 3.44Å; D119-K123 PolarHBondContact OD1-NZ 3.33Å; K123-Y249 HydrophobicContact CG-CE2 4.03Å
124	K	89.4	Confident	85.7	Confident	115 Å²	115	43.1 Å²	43.1	50%	0.5	22%	0.218	S	C	.	.	H	α-helix	trans	-90.2	-41.4	-173.7	-172.1	170.3	-179.7	177.6	0	113.8	E100 I121 I122	E100-K124 WeakPolarHBondContact OE1-CE 3.26Å; E100-K124 IonicContact OE1-NZ 2.93Å; E100-K124 PolarHBondContact OE1-NZ 2.89Å; I121-K124 PolarHBondContact O-N 2.84Å; I122-K124 VanDerWaalsContact C-N 3.27Å; I122-K124 PolarHBondContact O-N 2.9Å
125	Y	89.4	Confident	84.8	Confident	60 Å²	60	44.2 Å²	44.2	24%	0.235	22%	0.224	C	C	.	.	H	α-helix	trans	-115.7	-7.9	-172.6	-57.6	-73.3	0	0	0	113.5	F101 S104 I121	F101-Y125 HydrophobicContact CB-CE1 4.35Å; F101-Y125 AromaticContact CD2-CD1 3.87Å; F101-Y125 HydrophobicContact CD2-CD1 3.87Å; F101-Y125 AromaticContact CD2-CD2 3.6Å; F101-Y125 HydrophobicContact CD2-CD2 3.6Å; F101-Y125 AromaticContact CD2-CE1 3.99Å; F101-Y125 HydrophobicContact CD2-CE1 3.99Å; F101-Y125 AromaticContact CD2-CE2 3.73Å; F101-Y125 HydrophobicContact CD2-CE2 3.73Å; F101-Y125 AromaticContact CD2-CG 3.67Å; F101-Y125 HydrophobicContact CD2-CG 3.67Å; F101-Y125 AromaticContact CD2-CZ 3.93Å; F101-Y125 AromaticContact CE2-CD2 3.88Å; F101-Y125 HydrophobicContact CE2-CD2 3.88Å; F101-Y125 HydrophobicContact CE2-CE2 4.39Å; F101-Y125 AromaticContact CE2-CG 3.94Å; F101-Y125 HydrophobicContact CE2-CG 3.94Å; S104-Y125 PolarHBondContact OG-OH 2.81Å; I121-Y125 HydrophobicContact CD1-CD2 4.39Å; I121-Y125 PolarHBondContact O-N 2.88Å
126	G	87.4	Confident	83.8	Confident	29 Å²	29	41 Å²	41	30%	0.299	21%	0.212	S	C	.	.			trans	81.8	-171.9	-178.3	0	0	0	0	0	113.7	I122	I122-G126 WeakPolarHBondContact O-CA 3.17Å; I122-G126 PolarHBondContact O-N 2.96Å
127	T	87.3	Confident	82.8	Confident	28 Å²	28	36.6 Å²	36.6	17%	0.172	19%	0.193	C	C	.	.	S	Bend	trans	-100.9	-16.9	-177	50.4	0	0	0	0	113.7	I122 L230 A246 I250	I122-T127 HydrophobicContact CG2-CG2 3.8Å; T127-L230 WeakPolarHBondContact O-CB 3.49Å; T127-L230 PolarHBondContact O-N 3.46Å; T127-A246 HydrophobicContact CG2-CB 3.91Å; T127-I250 HydrophobicContact CG2-CD1 4.43Å
128	H	87.3	Confident	81.9	Confident	97 Å²	97	36.9 Å²	36.9	45%	0.449	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.2	-172	-64.5	77.8	0	0	0	111.8	L227 Q228	H128-L227 HydrophobicContact CB-CB 4.08Å; H128-L227 HydrophobicContact CB-CD1 4.24Å; H128-Q228 CarbonylContact C-O 3.59Å; H128-Q228 VanDerWaalsContact CA-O 3.26Å; H128-Q228 WeakPolarHBondContact CA-O 3.23Å; H128-Q228 WeakPolarHBondContact CB-O 3.16Å
129	I	84.8	Confident	81.3	Confident	26 Å²	26	37.7 Å²	37.7	13%	0.133	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.5	170.5	62.2	-173.6	0	0	0	110.5	I85 L227 Q228 L230 I233	I85-I129 HydrophobicContact CD1-CD1 3.99Å; I85-I129 HydrophobicContact CD1-CG1 4.45Å; I129-L227 WeakPolarHBondContact O-CA 3.23Å; I129-Q228 HydrophobicContact CG1-CB 4.06Å; I129-Q228 WeakPolarHBondContact CG1-O 3.27Å; I129-Q228 PolarHBondContact N-O 3.19Å; I129-Q228 PolarHBondContact O-N 3.07Å; I129-L230 HydrophobicContact CG2-CB 4.34Å; I129-L230 HydrophobicContact CG2-CD1 3.27Å; I129-L230 HydrophobicContact CG2-CG 4.39Å; I129-I233 HydrophobicContact CD1-CD1 3.7Å; I129-I233 HydrophobicContact CD1-CG1 4.17Å; I129-I233 HydrophobicContact CG2-CD1 4.01Å
130	L	80.9	Confident	80.9	Confident	58 Å²	58	34 Å²	34	30%	0.304	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.3	178	-174.7	67.7	0	0	0	111	N82 S132 A133 L218 L225 L227	N82-L130 PolarHBondContact ND2-O 2.93Å; L130-S132 WeakPolarHBondContact CD1-O 3.25Å; L130-A133 HydrophobicContact CD1-CB 4.14Å; L130-A133 HydrophobicContact CD2-CB 4.05Å; L130-L218 HydrophobicContact CD2-CD1 4.29Å; L130-L218 HydrophobicContact CD2-CD2 3.49Å; L130-L218 VanDerWaalsContact CD2-CD2 3.49Å; L130-L225 HydrophobicContact CD1-CB 4.26Å; L130-L225 HydrophobicContact CD1-CD2 3.9Å; L130-L227 HydrophobicContact CB-CD2 4.33Å; L130-L227 HydrophobicContact CD1-CD2 3.74Å
131	I	79.6	Confident	80.7	Confident	15 Å²	15	32 Å²	32	8%	0.077	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-47.9	172.8	-59.5	168.2	0	0	0	110.6	N82 I85 H226 Q228	N82-I131 WeakPolarHBondContact CB-O 3.29Å; N82-I131 PolarHBondContact N-O 3.48Å; I85-I131 HydrophobicContact CG2-CG1 4.1Å; I131-H226 WeakPolarHBondContact CB-O 3.33Å; I131-H226 WeakPolarHBondContact CD1-NE2 3.43Å; I131-H226 PolarHBondContact N-O 2.93Å; I131-Q228 HydrophobicContact CD1-CB 3.36Å; I131-Q228 HydrophobicContact CD1-CG 4.31Å; I131-Q228 HydrophobicContact CG1-CB 3.8Å
132	S	76.3	Confident	80.5	Confident	12 Å²	12	32.4 Å²	32.4	8%	0.084	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	148.5	177.3	75	0	0	0	0	110.6	V80 L130 H226	V80-S132 CarbonylContact O-C 3.54Å; V80-S132 VanDerWaalsContact O-CA 3.29Å; V80-S132 WeakPolarHBondContact O-CA 3.06Å; V80-S132 WeakPolarHBondContact O-CB 3.23Å; L130-S132 WeakPolarHBondContact CD1-O 3.25Å; S132-H226 PolarHBondContact N-O 3.42Å; S132-H226 PolarHBondContact O-N 3.41Å; S132-H226 WeakPolarHBondContact OG-CB 3.43Å
133	A	73.8	Confident	80.4	Confident	3 Å²	3	32.4 Å²	32.4	3%	0.025	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	154	174	0	0	0	0	0	110.2	V80 L130 L135 L218 L225	V80-A133 PolarHBondContact N-O 2.8Å; V80-A133 PolarHBondContact O-N 2.79Å; L130-A133 HydrophobicContact CD1-CB 4.14Å; L130-A133 HydrophobicContact CD2-CB 4.05Å; A133-L135 HydrophobicContact CB-CD2 4.26Å; A133-L218 HydrophobicContact CB-CD2 3.4Å; A133-L225 HydrophobicContact CB-CD2 3.75Å
134	T	70.9	Confident	80.4	Confident	37 Å²	37	27.4 Å²	27.4	23%	0.227	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	115.3	160.5	-50.4	0	0	0	0	107.8	R77 W78 S223	R77-T134 HydrophobicContact CB-CG2 4.04Å; R77-T134 HydrophobicContact CG-CG2 4.23Å; W78-T134 CarbonylContact O-C 3.48Å; W78-T134 WeakPolarHBondContact O-CA 3.37Å; T134-S223 WeakPolarHBondContact O-CB 3.16Å
135	L	68	Low	80.3	Confident	29 Å²	29	22.6 Å²	22.6	15%	0.152	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.3	172.6	-58.1	-174.9	0	0	0	109.3	W78 V80 A133 I216 L218	W78-L135 HydrophobicContact CB-CB 4.38Å; W78-L135 PolarHBondContact N-O 2.89Å; W78-L135 PolarHBondContact O-N 2.74Å; V80-L135 HydrophobicContact CB-CD1 4.05Å; V80-L135 HydrophobicContact CB-CG 4.28Å; V80-L135 HydrophobicContact CG2-CB 4.46Å; V80-L135 HydrophobicContact CG2-CD1 3.38Å; V80-L135 HydrophobicContact CG2-CG 3.81Å; A133-L135 HydrophobicContact CB-CD2 4.26Å; L135-I216 HydrophobicContact CB-CG2 3.59Å; L135-I216 HydrophobicContact CD1-CG2 3.69Å; L135-I216 HydrophobicContact CD2-CG2 4.16Å; L135-I216 HydrophobicContact CG-CG2 4.01Å; L135-L218 HydrophobicContact CD2-CD2 3.48Å; L135-L218 VanDerWaalsContact CD2-CD2 3.48Å; L135-L218 HydrophobicContact CD2-CG 3.6Å
136	G	66.7	Low	80	Confident	15 Å²	15	19.7 Å²	19.7	16%	0.155	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.2	176.9	177.9	0	0	0	0	0	112.7	A76	A76-G136 WeakPolarHBondContact O-CA 3.41Å
137	G	69.1	Low	79.3	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.031	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	149.2	169.1	0	0	0	0	0	111.8	E74 F75 T199	E74-G137 CarbonylContact C-O 3.53Å; E74-G137 VanDerWaalsContact CA-O 3.29Å; E74-G137 WeakPolarHBondContact CA-O 3.49Å; F75-G137 PolarHBondContact N-O 3.32Å; F75-G137 PolarHBondContact O-N 3.11Å; G137-T199 CarbonylContact C-O 3.59Å; G137-T199 WeakPolarHBondContact CA-O 3.31Å
138	E	71.3	Confident	78.4	Confident	7 Å²	7	26.6 Å²	26.6	3%	0.033	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	130.9	174.8	-173	-172.7	159.3	0	0	109	K70 Y72 A140 T199	K70-E138 WeakPolarHBondContact CE-OE1 3.49Å; K70-E138 IonicContact NZ-OE1 2.64Å; K70-E138 PolarHBondContact NZ-OE1 3.4Å; K70-E138 IonicContact NZ-OE2 2.73Å; Y72-E138 WeakPolarHBondContact CB-OE1 3.33Å; E138-A140 HydrophobicContact CG-CB 4.31Å; E138-A140 WeakPolarHBondContact OE1-CB 3.22Å; E138-T199 PolarHBondContact N-O 3.15Å; E138-T199 PolarHBondContact O-N 3.05Å; E138-T199 PolarHBondContact O-OG1 2.98Å
139	E	77	Confident	77.7	Confident	17 Å²	17	26.1 Å²	26.1	8%	0.079	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.3	161.5	175.3	-178.8	-163	0	0	108.1	Y72 R73 F75 Y171 F172 T197 R198	Y72-E139 CarbonylContact C-O 3.44Å; Y72-E139 VanDerWaalsContact CA-O 3.25Å; Y72-E139 WeakPolarHBondContact CA-O 3.23Å; R73-E139 PolarHBondContact N-O 2.89Å; R73-E139 PolarHBondContact O-N 3.44Å; F75-E139 HydrophobicContact CD2-CB 4.44Å; F75-E139 HydrophobicContact CE2-CB 3.54Å; F75-E139 WeakPolarHBondContact CE2-OE2 3.46Å; F75-E139 HydrophobicContact CZ-CB 4.34Å; F75-E139 WeakPolarHBondContact CZ-OE2 3.29Å; E139-Y171 HydrophobicContact CG-CE1 3.98Å; E139-Y171 PolarHBondContact OE1-OH 3.42Å; E139-F172 HydrophobicContact CG-CE1 4.26Å; E139-T197 WeakPolarHBondContact CA-O 3.48Å; E139-R198 HydrophobicContact CG-CG 4.28Å; E139-R198 IonicContact OE1-CZ 3.94Å; E139-R198 IonicContact OE1-NH1 3.22Å; E139-R198 IonicContact OE1-NH2 4Å; E139-R198 PolarHBondContact OE1-NH2 3.35Å
140	A	80.3	Confident	76.8	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	143.6	-178.6	0	0	0	0	0	112.6	K70 I71 Y72 E138 T197	K70-A140 HydrophobicContact CG-CB 4.43Å; I71-A140 CarbonylContact O-C 3.49Å; I71-A140 WeakPolarHBondContact O-CA 3.39Å; I71-A140 WeakPolarHBondContact O-CB 3.4Å; Y72-A140 VanDerWaalsContact CB-CB 3.48Å; E138-A140 HydrophobicContact CG-CB 4.31Å; E138-A140 WeakPolarHBondContact OE1-CB 3.22Å; A140-T197 WeakPolarHBondContact CB-OG1 3.34Å; A140-T197 PolarHBondContact N-O 3.4Å; A140-T197 PolarHBondContact O-N 2.96Å; A140-T197 PolarHBondContact O-OG1 3.3Å
141	L	86.5	Confident	75.7	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.1	169.2	179	71.2	0	0	0	108	K70 I71 M143 A168 Y171 M179 L182 V194	K70-L141 WeakPolarHBondContact CA-O 3.38Å; I71-L141 HydrophobicContact CD1-CB 4.11Å; I71-L141 HydrophobicContact CD1-CD2 3.98Å; I71-L141 HydrophobicContact CG1-CB 3.7Å; I71-L141 HydrophobicContact CG1-CD2 4.34Å; I71-L141 HydrophobicContact CG1-CG 4.47Å; I71-L141 PolarHBondContact N-O 2.76Å; I71-L141 PolarHBondContact O-N 3.23Å; L141-M143 HydrophobicContact CD2-CG 4.39Å; L141-M143 HydrophobicContact CD2-SD 3.94Å; L141-M143 HydrophobicContact CG-CG 4.21Å; L141-M143 HydrophobicContact CG-SD 4.4Å; L141-A168 HydrophobicContact CD2-CB 4.34Å; L141-Y171 HydrophobicContact CB-CD1 4.09Å; L141-Y171 HydrophobicContact CB-CD2 4.16Å; L141-Y171 HydrophobicContact CB-CE1 4.29Å; L141-Y171 HydrophobicContact CB-CE2 4.3Å; L141-Y171 HydrophobicContact CB-CG 4.07Å; L141-Y171 HydrophobicContact CD1-CD2 4.12Å; L141-Y171 HydrophobicContact CD1-CE2 4.17Å; L141-Y171 HydrophobicContact CD2-CD2 3.85Å; L141-Y171 HydrophobicContact CD2-CG 3.88Å; L141-Y171 HydrophobicContact CG-CD2 4.27Å; L141-Y171 HydrophobicContact CG-CG 4.45Å; L141-M179 HydrophobicContact CD1-CE 4.42Å; L141-M179 HydrophobicContact CD1-SD 3.44Å; L141-M179 WeakPolarHBondContact CD1-SD 3.33Å; L141-L182 HydrophobicContact CD1-CD1 4.43Å; L141-L182 HydrophobicContact CD2-CD1 3.73Å; L141-V194 HydrophobicContact CD1-CG1 3.33Å; L141-V194 HydrophobicContact CG-CG1 4.31Å
142	T	86.9	Confident	74.5	Confident	7 Å²	7	38.2 Å²	38.2	4%	0.043	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	128.9	172.7	-57.4	0	0	0	0	110	R68 Y69 Y144 V194 T195	R68-T142 HydrophobicContact CG-CG2 3.95Å; Y69-T142 CarbonylContact O-C 3.4Å; Y69-T142 WeakPolarHBondContact O-CA 3.43Å; T142-Y144 HydrophobicContact CG2-CD2 4.33Å; T142-Y144 HydrophobicContact CG2-CE2 3.67Å; T142-V194 CarbonylContact O-C 3.53Å; T142-V194 WeakPolarHBondContact O-CA 3.48Å; T142-T195 PolarHBondContact N-O 3.26Å; T142-T195 PolarHBondContact O-N 3.26Å
143	M	87.9	Confident	73.4	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.03	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	129.7	177.8	-64	170.1	48.7	0	0	110.2	R68 Y69 L141 L164 A168 L182 K193 V194	R68-M143 CarbonylContact C-O 3.59Å; R68-M143 WeakPolarHBondContact CA-O 3.39Å; Y69-M143 HydrophobicContact CD1-SD 4.48Å; Y69-M143 PolarHBondContact N-O 3.09Å; Y69-M143 PolarHBondContact O-N 2.87Å; L141-M143 HydrophobicContact CD2-CG 4.39Å; L141-M143 HydrophobicContact CD2-SD 3.94Å; L141-M143 HydrophobicContact CG-CG 4.21Å; L141-M143 HydrophobicContact CG-SD 4.4Å; M143-L164 HydrophobicContact CE-CD2 3.25Å; M143-L164 HydrophobicContact CE-CG 3.73Å; M143-A168 HydrophobicContact CE-CB 4.41Å; M143-A168 HydrophobicContact SD-CB 3.61Å; M143-L182 HydrophobicContact CE-CD2 3.8Å; M143-L182 HydrophobicContact SD-CD1 4.06Å; M143-L182 HydrophobicContact SD-CD2 4.1Å; M143-K193 CarbonylContact C-O 3.47Å; M143-K193 WeakPolarHBondContact CA-O 3.28Å; M143-V194 HydrophobicContact CG-CB 4.45Å; M143-V194 HydrophobicContact CG-CG1 4.05Å; M143-V194 HydrophobicContact CG-CG2 3.95Å
144	Y	88	Confident	72.4	Confident	11 Å²	11	50.4 Å²	50.4	4%	0.043	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.4	173	-60.5	-92.7	0	0	0	109.2	F57 R60 F65 T67 R68 T142 I192 K193	F57-Y144 HydrophobicContact CB-CE1 4.46Å; F57-Y144 HydrophobicContact CD2-CD1 4.18Å; F57-Y144 AromaticContact CD2-CE1 3.86Å; F57-Y144 HydrophobicContact CD2-CE1 3.86Å; R60-Y144 HydrophobicContact CB-CD1 3.81Å; R60-Y144 HydrophobicContact CB-CE1 4.02Å; R60-Y144 HydrophobicContact CB-CG 4.27Å; R60-Y144 HydrophobicContact CG-CD1 4.08Å; R60-Y144 HydrophobicContact CG-CD2 4.38Å; R60-Y144 HydrophobicContact CG-CE1 3.99Å; R60-Y144 HydrophobicContact CG-CE2 4.31Å; R60-Y144 HydrophobicContact CG-CG 4.28Å; F65-Y144 WeakPolarHBondContact CD1-O 3.43Å; T67-Y144 CarbonylContact O-C 3.51Å; T67-Y144 WeakPolarHBondContact O-CA 3.41Å; R68-Y144 HydrophobicContact CB-CD1 4.1Å; R68-Y144 HydrophobicContact CB-CE1 4.14Å; R68-Y144 HydrophobicContact CG-CD1 4.16Å; R68-Y144 HydrophobicContact CG-CE1 3.84Å; T142-Y144 HydrophobicContact CG2-CD2 4.33Å; T142-Y144 HydrophobicContact CG2-CE2 3.67Å; Y144-I192 CarbonylContact O-C 3.57Å; Y144-I192 WeakPolarHBondContact O-CA 3.36Å; Y144-K193 PolarHBondContact N-O 2.98Å; Y144-K193 PolarHBondContact O-N 3.27Å
145	L	86.6	Confident	71.2	Confident	14 Å²	14	55.7 Å²	55.7	7%	0.073	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.4	-173.3	-179.4	73.4	0	0	0	111.2	F65 T66 T67 K147 L150 V161 L164 I192	F65-L145 CarbonylContact C-O 3.45Å; T66-L145 PolarHBondContact N-O 3.34Å; T67-L145 PolarHBondContact N-O 2.98Å; T67-L145 VanDerWaalsContact N-O 3.09Å; T67-L145 PolarHBondContact O-N 2.87Å; L145-K147 HydrophobicContact CD2-CG 4.45Å; L145-L150 HydrophobicContact CD1-CD1 3.93Å; L145-L150 HydrophobicContact CD1-CD2 4.18Å; L145-V161 HydrophobicContact CD2-CG2 4.35Å; L145-L164 HydrophobicContact CD1-CD2 4.29Å; L145-I192 HydrophobicContact CD1-CG2 3.47Å; L145-I192 VanDerWaalsContact CD1-CG2 3.47Å
146	A	82.7	Confident	70.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.284	C	S	.	.			trans	-100	92.4	172.8	0	0	0	0	0	109.8	G64 F65 N148 K149 L150 A191	G64-A146 WeakPolarHBondContact O-CB 3.36Å; F65-A146 HydrophobicContact CD1-CB 3.93Å; F65-A146 HydrophobicContact CE1-CB 4.32Å; A146-N148 VanDerWaalsContact C-N 3.3Å; A146-N148 PolarHBondContact O-N 2.92Å; A146-K149 HydrophobicContact CB-CB 4.19Å; A146-K149 HydrophobicContact CB-CD 4.11Å; A146-K149 HydrophobicContact CB-CG 4.2Å; A146-K149 PolarHBondContact O-N 3.41Å; A146-K149 VanDerWaalsContact O-N 3.07Å; A146-L150 PolarHBondContact O-N 2.67Å; A146-A191 PolarHBondContact N-O 2.87Å
147	K	73.8	Confident	69.8	Low	114 Å²	114	58.8 Å²	58.8	50%	0.496	29%	0.287	S	S	.	.	H	α-helix	trans	-51.9	-45.5	-175.4	-73.1	179.5	166.9	172.8	0	113.2	T67 L145 K149 L150 D151	T67-K147 WeakPolarHBondContact OG1-CE 3.41Å; L145-K147 HydrophobicContact CD2-CG 4.45Å; K147-K149 VanDerWaalsContact C-N 3.31Å; K147-K149 PolarHBondContact O-N 2.76Å; K147-L150 WeakPolarHBondContact O-CB 3.49Å; K147-L150 PolarHBondContact O-N 2.96Å; K147-L150 VanDerWaalsContact O-N 3.11Å; K147-D151 PolarHBondContact O-N 3.37Å; K147-D151 VanDerWaalsContact O-N 3.09Å
148	N	69.1	Low	69.2	Low	88 Å²	88	64.2 Å²	64.2	47%	0.471	32%	0.32	S	S	.	.	H	α-helix	trans	-61.5	-30.3	179.2	56.7	-10.4	0	0	0	115	A146	A146-N148 VanDerWaalsContact C-N 3.3Å; A146-N148 PolarHBondContact O-N 2.92Å
149	K	70.8	Confident	68.5	Low	86 Å²	86	69.6 Å²	69.6	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-82.6	-23.7	176.8	-67.6	-175.5	-177.8	175.7	0	112.2	A146 K147 A191	A146-K149 HydrophobicContact CB-CB 4.19Å; A146-K149 HydrophobicContact CB-CD 4.11Å; A146-K149 HydrophobicContact CB-CG 4.2Å; A146-K149 PolarHBondContact O-N 3.41Å; A146-K149 VanDerWaalsContact O-N 3.07Å; K147-K149 VanDerWaalsContact C-N 3.31Å; K147-K149 PolarHBondContact O-N 2.76Å; K149-A191 HydrophobicContact CB-CB 4.02Å
150	L	66.9	Low	68.1	Low	29 Å²	29	72 Å²	72	15%	0.152	36%	0.358	C	S	.	.	H	α-helix	trans	-73.7	-41.5	173.2	-133.1	77.3	0	0	0	111	L145 A146 K147 R152 V161 A191	L145-L150 HydrophobicContact CD1-CD1 3.93Å; L145-L150 HydrophobicContact CD1-CD2 4.18Å; A146-L150 PolarHBondContact O-N 2.67Å; K147-L150 WeakPolarHBondContact O-CB 3.49Å; K147-L150 PolarHBondContact O-N 2.96Å; K147-L150 VanDerWaalsContact O-N 3.11Å; L150-R152 PolarHBondContact O-N 3.49Å; L150-V161 HydrophobicContact CD2-CG2 3.54Å; L150-A191 HydrophobicContact CD1-CB 3.5Å
151	D	57.7	Low	67.7	Low	96 Å²	96	74 Å²	74	51%	0.513	37%	0.37	S	S	.	.	H	α-helix	trans	-68.6	-27.9	-177.3	-68.3	-24.8	0	0	0	113.9	K147 K153 A157	K147-D151 PolarHBondContact O-N 3.37Å; K147-D151 VanDerWaalsContact O-N 3.09Å; D151-K153 PolarHBondContact O-N 3.18Å; D151-A157 WeakPolarHBondContact OD1-CB 3.15Å
152	R	55.3	Low	67.2	Low	228 Å²	228	79.6 Å²	79.6	86%	0.86	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-13.3	-173	-89.5	-176	168.9	-177.6	-2.6	115.5	L150	L150-R152 PolarHBondContact O-N 3.49Å
153	K	52.6	Low	66.8	Low	170 Å²	170	81.5 Å²	81.5	74%	0.739	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-17	-175.5	-85.6	-169.2	174	-175.5	0	115.4	D151	D151-K153 PolarHBondContact O-N 3.18Å
154	L	51.9	Low	66.6	Low	102 Å²	102	82.2 Å²	82.2	53%	0.534	42%	0.417	S	S	.	.			trans	-141.7	131.1	-169.5	-77.7	128.9	0	0	0	112.7	N156	L154-N156 PolarHBondContact O-N 3.36Å
155	V	46.6	Very low	66.3	Low	148 Å²	148	85 Å²	85	90%	0.897	43%	0.43	S	S	*	.	S	Bend	trans	-61.9	-15.9	-169.6	176.7	0	0	0	0	114.2
156	N	53.6	Low	66.2	Low	82 Å²	82	90.2 Å²	90.2	44%	0.439	45%	0.454	S	S	.	.			trans	-131	90.5	177.7	-70.5	-9.5	0	0	0	111.7	L154 Q159	L154-N156 PolarHBondContact O-N 3.36Å; N156-Q159 HydrophobicContact CB-CB 4.49Å; N156-Q159 PolarHBondContact ND2-OE1 3.06Å
157	A	51.9	Low	66.3	Low	27 Å²	27	91.6 Å²	91.6	22%	0.223	46%	0.461	C	S	.	.	H	α-helix	trans	-70.4	-32	-177.7	0	0	0	0	0	114.4	D151 V161	D151-A157 WeakPolarHBondContact OD1-CB 3.15Å; A157-V161 WeakPolarHBondContact O-CG2 3.4Å; A157-V161 PolarHBondContact O-N 3.4Å
158	T	56.7	Low	66.9	Low	116 Å²	116	86.2 Å²	86.2	71%	0.712	44%	0.438	S	S	*	.	H	α-helix	trans	-72.4	-44.5	-175.8	45.4	0	0	0	0	113	N160 V161 E162	T158-N160 VanDerWaalsContact C-N 3.27Å; T158-N160 PolarHBondContact O-N 2.73Å; T158-V161 PolarHBondContact O-N 3.29Å; T158-E162 PolarHBondContact O-N 3.09Å
159	Q	56.3	Low	67.6	Low	120 Å²	120	85.4 Å²	85.4	56%	0.561	44%	0.439	S	S	*	.	H	α-helix	trans	-63	-31.7	177.7	-74.6	177	-25.7	0	0	112.6	N156 A163	N156-Q159 HydrophobicContact CB-CB 4.49Å; N156-Q159 PolarHBondContact ND2-OE1 3.06Å; Q159-A163 WeakPolarHBondContact O-CB 3.28Å; Q159-A163 PolarHBondContact O-N 2.76Å
160	N	67.6	Low	68.3	Low	67 Å²	67	83 Å²	83	36%	0.358	43%	0.433	S	S	.	.	H	α-helix	trans	-81	-32.7	-179.3	-78.7	-19.3	0	0	0	113.7	T158 E162 A163 L164	T158-N160 VanDerWaalsContact C-N 3.27Å; T158-N160 PolarHBondContact O-N 2.73Å; N160-E162 VanDerWaalsContact C-N 3.3Å; N160-A163 PolarHBondContact O-N 2.84Å; N160-L164 WeakPolarHBondContact O-CB 3.41Å; N160-L164 PolarHBondContact O-N 3.48Å
161	V	72.6	Confident	69.3	Low	42 Å²	42	81.7 Å²	81.7	26%	0.255	43%	0.426	S	S	.	.	H	α-helix	trans	-64.6	-41	172.3	173	0	0	0	0	109.9	L145 L150 A157 T158 L164 H165	L145-V161 HydrophobicContact CD2-CG2 4.35Å; L150-V161 HydrophobicContact CD2-CG2 3.54Å; A157-V161 WeakPolarHBondContact O-CG2 3.4Å; A157-V161 PolarHBondContact O-N 3.4Å; T158-V161 PolarHBondContact O-N 3.29Å; V161-L164 WeakPolarHBondContact O-CB 3.45Å; V161-L164 PolarHBondContact O-N 3.3Å; V161-H165 WeakPolarHBondContact CG1-NE2 3.26Å; V161-H165 PolarHBondContact O-CD2 3.08Å; V161-H165 PolarHBondContact O-N 2.65Å
162	E	76.6	Confident	70.5	Confident	119 Å²	119	80.1 Å²	80.1	56%	0.556	42%	0.415	S	S	*	.	H	α-helix	trans	-64.9	-42.6	175.3	-165.6	167	-168.2	0	0	112.3	T158 N160 L164 H165 Q166	T158-E162 PolarHBondContact O-N 3.09Å; N160-E162 VanDerWaalsContact C-N 3.3Å; E162-L164 VanDerWaalsContact C-N 3.31Å; E162-L164 PolarHBondContact O-N 3.11Å; E162-H165 WeakPolarHBondContact O-CB 3.4Å; E162-H165 PolarHBondContact O-N 2.84Å; E162-H165 VanDerWaalsContact O-N 3.15Å; E162-Q166 WeakPolarHBondContact O-CG 3.45Å; E162-Q166 PolarHBondContact O-N 2.77Å
163	A	78.4	Confident	71.9	Confident	47 Å²	47	76.6 Å²	76.6	39%	0.388	41%	0.412	S	S	.	.	H	α-helix	trans	-61.3	-37.8	172.5	0	0	0	0	0	112.6	Q159 N160 H165 Q166 L167	Q159-A163 WeakPolarHBondContact O-CB 3.28Å; Q159-A163 PolarHBondContact O-N 2.76Å; N160-A163 PolarHBondContact O-N 2.84Å; A163-H165 VanDerWaalsContact C-N 3.35Å; A163-Q166 PolarHBondContact O-N 3.12Å; A163-L167 WeakPolarHBondContact O-CB 3.39Å; A163-L167 PolarHBondContact O-N 2.69Å
164	L	83.1	Confident	73.5	Confident	20 Å²	20	72.4 Å²	72.4	11%	0.105	40%	0.397	C	S	.	.	H	α-helix	trans	-66.9	-37.1	174.9	-155.3	95.5	0	0	0	111.7	M143 L145 N160 V161 E162 L167 A168 I185 I192	M143-L164 HydrophobicContact CE-CD2 3.25Å; M143-L164 HydrophobicContact CE-CG 3.73Å; L145-L164 HydrophobicContact CD1-CD2 4.29Å; N160-L164 WeakPolarHBondContact O-CB 3.41Å; N160-L164 PolarHBondContact O-N 3.48Å; V161-L164 WeakPolarHBondContact O-CB 3.45Å; V161-L164 PolarHBondContact O-N 3.3Å; E162-L164 VanDerWaalsContact C-N 3.31Å; E162-L164 PolarHBondContact O-N 3.11Å; L164-L167 PolarHBondContact O-N 2.9Å; L164-A168 WeakPolarHBondContact O-CB 3.45Å; L164-A168 PolarHBondContact O-N 3.35Å; L164-I185 HydrophobicContact CD1-CD1 4.22Å; L164-I185 HydrophobicContact CD1-CG2 4.29Å; L164-I192 HydrophobicContact CD1-CD1 4.27Å; L164-I192 HydrophobicContact CD1-CG2 4.34Å; L164-I192 HydrophobicContact CD2-CG2 3.84Å
165	H	81.7	Confident	75	Confident	70 Å²	70	72 Å²	72	32%	0.324	39%	0.388	S	S	.	.	H	α-helix	trans	-67.9	-39.7	174.2	-73.9	-57.2	0	0	0	112.3	Y69 V161 E162 A163 A168 S169	Y69-H165 AromaticContact CD2-CE1 3.6Å; Y69-H165 AromaticContact CD2-ND1 3.75Å; Y69-H165 AromaticContact CE1-ND1 3.89Å; Y69-H165 AromaticContact CE2-CE1 3.74Å; Y69-H165 AromaticContact CE2-ND1 3.51Å; Y69-H165 AromaticContact CZ-ND1 3.59Å; V161-H165 WeakPolarHBondContact CG1-NE2 3.26Å; V161-H165 PolarHBondContact O-CD2 3.08Å; V161-H165 PolarHBondContact O-N 2.65Å; E162-H165 WeakPolarHBondContact O-CB 3.4Å; E162-H165 PolarHBondContact O-N 2.84Å; E162-H165 VanDerWaalsContact O-N 3.15Å; A163-H165 VanDerWaalsContact C-N 3.35Å; H165-A168 PolarHBondContact O-N 3.33Å; H165-S169 PolarHBondContact O-N 3.26Å
166	Q	83.9	Confident	76.8	Confident	123 Å²	123	69.2 Å²	69.2	58%	0.575	37%	0.369	S	S	*	.	H	α-helix	trans	-65.6	-40.3	173.7	-71.5	179.1	1.1	0	0	111.9	E162 A163 S169 S170	E162-Q166 WeakPolarHBondContact O-CG 3.45Å; E162-Q166 PolarHBondContact O-N 2.77Å; A163-Q166 PolarHBondContact O-N 3.12Å; Q166-S169 PolarHBondContact O-N 2.03Å; Q166-S169 PolarHBondContact O-OG 2.86Å; Q166-S170 PolarHBondContact O-N 3Å
167	L	86.3	Confident	78.4	Confident	30 Å²	30	65.9 Å²	65.9	16%	0.157	35%	0.354	C	S	.	.	H	α-helix	trans	-65	-41.3	172.8	-179.7	63.8	0	0	0	111.1	A163 L164 S169 S170 T178 K181 L182 I185	A163-L167 WeakPolarHBondContact O-CB 3.39Å; A163-L167 PolarHBondContact O-N 2.69Å; L164-L167 PolarHBondContact O-N 2.9Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 2.83Å; L167-S170 PolarHBondContact O-N 3.37Å; L167-S170 PolarHBondContact O-OG 3.4Å; L167-T178 HydrophobicContact CD1-CG2 4.18Å; L167-T178 HydrophobicContact CG-CG2 4.26Å; L167-T178 WeakPolarHBondContact O-CG2 3.49Å; L167-K181 HydrophobicContact CD1-CB 4.14Å; L167-K181 HydrophobicContact CD1-CD 3.81Å; L167-K181 HydrophobicContact CD2-CB 3.95Å; L167-L182 HydrophobicContact CD2-CD2 3.73Å; L167-L182 HydrophobicContact CD2-CG 3.99Å; L167-L182 HydrophobicContact CG-CD2 4.21Å; L167-L182 HydrophobicContact CG-CG 4.29Å; L167-I185 HydrophobicContact CD2-CD1 3.83Å
168	A	84.8	Confident	80	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-63.1	-41.3	175.6	0	0	0	0	0	111.3	Y69 I71 L141 M143 L164 H165 S170 Y171	Y69-A168 HydrophobicContact CD1-CB 4.28Å; Y69-A168 HydrophobicContact CE1-CB 3.8Å; I71-A168 HydrophobicContact CD1-CB 4.29Å; I71-A168 WeakPolarHBondContact CD1-O 3.43Å; L141-A168 HydrophobicContact CD2-CB 4.34Å; M143-A168 HydrophobicContact CE-CB 4.41Å; M143-A168 HydrophobicContact SD-CB 3.61Å; L164-A168 WeakPolarHBondContact O-CB 3.45Å; L164-A168 PolarHBondContact O-N 3.35Å; H165-A168 PolarHBondContact O-N 3.33Å; A168-S170 VanDerWaalsContact C-N 3.25Å; A168-S170 PolarHBondContact O-N 3.33Å; A168-Y171 WeakPolarHBondContact O-CB 3.25Å; A168-Y171 PolarHBondContact O-N 2.98Å; A168-Y171 VanDerWaalsContact O-N 3.07Å
169	S	83.9	Confident	81.5	Confident	71 Å²	71	60 Å²	60	50%	0.497	31%	0.314	S	S	.	.	H	α-helix	trans	-66.1	-24.3	-179.2	69.1	0	0	0	0	113.7	H165 Q166 L167 Y171	H165-S169 PolarHBondContact O-N 3.26Å; Q166-S169 PolarHBondContact O-N 2.03Å; Q166-S169 PolarHBondContact O-OG 2.86Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 2.83Å; S169-Y171 PolarHBondContact O-N 2.79Å
170	S	87	Confident	83	Confident	36 Å²	36	61.9 Å²	61.9	25%	0.252	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-73.8	-8.6	173.5	66.4	0	0	0	0	114.2	Q166 L167 A168 F172 I173 D174 T178	Q166-S170 PolarHBondContact O-N 3Å; L167-S170 PolarHBondContact O-N 3.37Å; L167-S170 PolarHBondContact O-OG 3.4Å; A168-S170 VanDerWaalsContact C-N 3.25Å; A168-S170 PolarHBondContact O-N 3.33Å; S170-F172 VanDerWaalsContact C-N 3.29Å; S170-F172 PolarHBondContact O-N 3.28Å; S170-I173 PolarHBondContact O-N 3.45Å; S170-D174 PolarHBondContact O-N 2.98Å; S170-T178 PolarHBondContact OG-OG1 3.2Å
171	Y	86.9	Confident	83.9	Confident	1 Å²	1	64.2 Å²	64.2	0%	0.004	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-53.8	-40.5	-177.7	171.5	-92.4	0	0	0	113.5	I71 E139 L141 A168 S169 I173 R175 M179 E196 R198	I71-Y171 HydrophobicContact CD1-CD1 4.48Å; E139-Y171 HydrophobicContact CG-CE1 3.98Å; E139-Y171 PolarHBondContact OE1-OH 3.42Å; L141-Y171 HydrophobicContact CB-CD1 4.09Å; L141-Y171 HydrophobicContact CB-CD2 4.16Å; L141-Y171 HydrophobicContact CB-CE1 4.29Å; L141-Y171 HydrophobicContact CB-CE2 4.3Å; L141-Y171 HydrophobicContact CB-CG 4.07Å; L141-Y171 HydrophobicContact CD1-CD2 4.12Å; L141-Y171 HydrophobicContact CD1-CE2 4.17Å; L141-Y171 HydrophobicContact CD2-CD2 3.85Å; L141-Y171 HydrophobicContact CD2-CG 3.88Å; L141-Y171 HydrophobicContact CG-CD2 4.27Å; L141-Y171 HydrophobicContact CG-CG 4.45Å; A168-Y171 WeakPolarHBondContact O-CB 3.25Å; A168-Y171 PolarHBondContact O-N 2.98Å; A168-Y171 VanDerWaalsContact O-N 3.07Å; S169-Y171 PolarHBondContact O-N 2.79Å; Y171-I173 VanDerWaalsContact C-N 3.26Å; Y171-I173 PolarHBondContact O-N 3.04Å; Y171-R175 HydrophobicContact CD2-CG 4.36Å; Y171-R175 HydrophobicContact CE2-CG 3.75Å; Y171-R175 VanDerWaalsContact O-CA 3.26Å; Y171-R175 WeakPolarHBondContact O-CA 3.4Å; Y171-R175 PolarHBondContact O-N 2.96Å; Y171-M179 HydrophobicContact CD2-CG 4.07Å; Y171-M179 HydrophobicContact CD2-SD 4.12Å; Y171-M179 HydrophobicContact CE2-CG 3.8Å; Y171-M179 HydrophobicContact CE2-SD 3.93Å; Y171-E196 HydrophobicContact CE2-CG 4.42Å; Y171-E196 VanDerWaalsContact OH-CD 3.24Å; Y171-E196 WeakPolarHBondContact OH-CG 3.25Å; Y171-E196 PolarHBondContact OH-OE1 3.25Å; Y171-R198 PolarHBondContact OH-NH2 3.5Å
172	F	83	Confident	84.6	Confident	64 Å²	64	62.2 Å²	62.2	28%	0.281	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-78	-9.7	179.9	-63.5	-62.7	0	0	0	114.2	I71 R73 E139 S170	I71-F172 HydrophobicContact CB-CE2 4.1Å; I71-F172 HydrophobicContact CD1-CE2 4.01Å; I71-F172 HydrophobicContact CG1-CE2 4.11Å; I71-F172 HydrophobicContact CG1-CZ 4.36Å; R73-F172 HydrophobicContact CB-CD1 3.79Å; R73-F172 HydrophobicContact CB-CE1 3.4Å; R73-F172 HydrophobicContact CB-CE2 4.4Å; R73-F172 HydrophobicContact CB-CG 4.46Å; R73-F172 HydrophobicContact CB-CZ 3.77Å; E139-F172 HydrophobicContact CG-CE1 4.26Å; S170-F172 VanDerWaalsContact C-N 3.29Å; S170-F172 PolarHBondContact O-N 3.28Å
173	I	84.6	Confident	85.1	Confident	154 Å²	154	60.3 Å²	60.3	79%	0.79	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-49.1	179.9	-59	174.8	0	0	0	109.8	S170 Y171	S170-I173 PolarHBondContact O-N 3.45Å; Y171-I173 VanDerWaalsContact C-N 3.26Å; Y171-I173 PolarHBondContact O-N 3.04Å
174	D	85.8	Confident	85.5	Confident	82 Å²	82	63.4 Å²	63.4	44%	0.439	31%	0.308	S	S	.	.	S	Bend	trans	-132.5	85.8	177.2	173.8	22.1	0	0	0	109.5	S170 G177 T178	S170-D174 PolarHBondContact O-N 2.98Å; D174-G177 PolarHBondContact OD1-N 3.04Å; D174-G177 WeakPolarHBondContact OD2-CA 3.37Å; D174-T178 WeakPolarHBondContact O-CB 3.43Å; D174-T178 PolarHBondContact O-N 3.45Å; D174-T178 PolarHBondContact O-OG1 3.33Å
175	R	84.1	Confident	85.5	Confident	92 Å²	92	64.9 Å²	64.9	35%	0.347	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-56.9	-177.4	179.8	-163.7	73.1	-179.2	-0.4	111.9	Y171 G177 T178 M179 R198	Y171-R175 HydrophobicContact CD2-CG 4.36Å; Y171-R175 HydrophobicContact CE2-CG 3.75Å; Y171-R175 VanDerWaalsContact O-CA 3.26Å; Y171-R175 WeakPolarHBondContact O-CA 3.4Å; Y171-R175 PolarHBondContact O-N 2.96Å; R175-G177 VanDerWaalsContact C-N 3.34Å; R175-G177 PolarHBondContact O-N 3.26Å; R175-T178 PolarHBondContact O-N 3.33Å; R175-M179 HydrophobicContact CG-CG 4.41Å; R175-M179 WeakPolarHBondContact O-CB 3.37Å; R175-M179 PolarHBondContact O-N 2.99Å; R175-R198 VanDerWaalsContact NH1-NH1 3.11Å
176	D	83.9	Confident	85.7	Confident	90 Å²	90	63.7 Å²	63.7	48%	0.481	31%	0.31	S	S	.	.	H	α-helix	trans	-67.2	-38.7	-168.9	-67.9	-30.4	0	0	0	110.8	R180	D176-R180 WeakPolarHBondContact O-CB 3.4Å; D176-R180 PolarHBondContact O-N 3.29Å
177	G	86.8	Confident	85.8	Confident	13 Å²	13	64.6 Å²	64.6	13%	0.134	32%	0.318	C	S	.	.	H	α-helix	trans	-68.7	-40	174.2	0	0	0	0	0	113	D174 R175 K181	D174-G177 PolarHBondContact OD1-N 3.04Å; D174-G177 WeakPolarHBondContact OD2-CA 3.37Å; R175-G177 VanDerWaalsContact C-N 3.34Å; R175-G177 PolarHBondContact O-N 3.26Å; G177-K181 WeakPolarHBondContact O-CG 3.44Å; G177-K181 PolarHBondContact O-N 3.44Å
178	T	87.1	Confident	85.5	Confident	1 Å²	1	67 Å²	67	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-66.9	-46.6	178	-60.8	0	0	0	0	112	L167 S170 D174 R175 R180 K181 L182	L167-T178 HydrophobicContact CD1-CG2 4.18Å; L167-T178 HydrophobicContact CG-CG2 4.26Å; L167-T178 WeakPolarHBondContact O-CG2 3.49Å; S170-T178 PolarHBondContact OG-OG1 3.2Å; D174-T178 WeakPolarHBondContact O-CB 3.43Å; D174-T178 PolarHBondContact O-N 3.45Å; D174-T178 PolarHBondContact O-OG1 3.33Å; R175-T178 PolarHBondContact O-N 3.33Å; T178-R180 VanDerWaalsContact C-N 3.35Å; T178-R180 PolarHBondContact O-N 2.94Å; T178-K181 PolarHBondContact O-N 3.37Å; T178-L182 HydrophobicContact CG2-CD1 3.87Å; T178-L182 HydrophobicContact CG2-CG 4.36Å; T178-L182 WeakPolarHBondContact O-CB 3.35Å; T178-L182 WeakPolarHBondContact O-CG 3.2Å; T178-L182 PolarHBondContact O-N 3.08Å
179	M	87.4	Confident	85.2	Confident	19 Å²	19	69.7 Å²	69.7	9%	0.094	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-38.5	179.6	-77.7	-58.8	-67.4	0	0	112.4	L141 Y171 R175 L182 H183 V194 E196	L141-M179 HydrophobicContact CD1-CE 4.42Å; L141-M179 HydrophobicContact CD1-SD 3.44Å; L141-M179 WeakPolarHBondContact CD1-SD 3.33Å; Y171-M179 HydrophobicContact CD2-CG 4.07Å; Y171-M179 HydrophobicContact CD2-SD 4.12Å; Y171-M179 HydrophobicContact CE2-CG 3.8Å; Y171-M179 HydrophobicContact CE2-SD 3.93Å; R175-M179 HydrophobicContact CG-CG 4.41Å; R175-M179 WeakPolarHBondContact O-CB 3.37Å; R175-M179 PolarHBondContact O-N 2.99Å; M179-L182 PolarHBondContact O-N 3.06Å; M179-L182 HydrophobicContact SD-CD1 4.48Å; M179-H183 WeakPolarHBondContact CE-NE2 3.06Å; M179-H183 WeakPolarHBondContact O-CB 3.05Å; M179-H183 PolarHBondContact O-CD2 2.9Å; M179-H183 PolarHBondContact O-N 3.29Å; M179-V194 HydrophobicContact CE-CG1 4.1Å; M179-V194 HydrophobicContact SD-CG1 4.13Å; M179-E196 HydrophobicContact CE-CB 4.24Å
180	R	88	Confident	85.1	Confident	159 Å²	159	70.8 Å²	70.8	60%	0.6	35%	0.354	S	S	*	.	H	α-helix	trans	-60.6	-49.9	175.8	-165.9	-179.5	-65.6	128.1	0.3	111.3	D176 T178 L182 H183 E184	D176-R180 WeakPolarHBondContact O-CB 3.4Å; D176-R180 PolarHBondContact O-N 3.29Å; T178-R180 VanDerWaalsContact C-N 3.35Å; T178-R180 PolarHBondContact O-N 2.94Å; R180-L182 PolarHBondContact O-N 3.36Å; R180-H183 PolarHBondContact O-N 3.17Å; R180-E184 WeakPolarHBondContact O-CG 3.44Å; R180-E184 PolarHBondContact O-N 2.84Å
181	K	87.1	Confident	84.8	Confident	115 Å²	115	69.1 Å²	69.1	50%	0.5	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-41.2	176.7	-71.7	176.5	179.9	175.9	0	112.6	L167 G177 T178 E184 I185	L167-K181 HydrophobicContact CD1-CB 4.14Å; L167-K181 HydrophobicContact CD1-CD 3.81Å; L167-K181 HydrophobicContact CD2-CB 3.95Å; G177-K181 WeakPolarHBondContact O-CG 3.44Å; G177-K181 PolarHBondContact O-N 3.44Å; T178-K181 PolarHBondContact O-N 3.37Å; K181-E184 PolarHBondContact O-N 3.2Å; K181-I185 VanDerWaalsContact O-CG1 3.3Å; K181-I185 WeakPolarHBondContact O-CG1 3.47Å; K181-I185 PolarHBondContact O-N 2.85Å
182	L	87.3	Confident	84.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-38.7	177.1	-75.8	175	0	0	0	112.4	L141 M143 L167 T178 M179 R180 I185 Q186 I192 V194	L141-L182 HydrophobicContact CD1-CD1 4.43Å; L141-L182 HydrophobicContact CD2-CD1 3.73Å; M143-L182 HydrophobicContact CE-CD2 3.8Å; M143-L182 HydrophobicContact SD-CD1 4.06Å; M143-L182 HydrophobicContact SD-CD2 4.1Å; L167-L182 HydrophobicContact CD2-CD2 3.73Å; L167-L182 HydrophobicContact CD2-CG 3.99Å; L167-L182 HydrophobicContact CG-CD2 4.21Å; L167-L182 HydrophobicContact CG-CG 4.29Å; T178-L182 HydrophobicContact CG2-CD1 3.87Å; T178-L182 HydrophobicContact CG2-CG 4.36Å; T178-L182 WeakPolarHBondContact O-CB 3.35Å; T178-L182 WeakPolarHBondContact O-CG 3.2Å; T178-L182 PolarHBondContact O-N 3.08Å; M179-L182 PolarHBondContact O-N 3.06Å; M179-L182 HydrophobicContact SD-CD1 4.48Å; R180-L182 PolarHBondContact O-N 3.36Å; L182-I185 PolarHBondContact O-N 3.06Å; L182-Q186 WeakPolarHBondContact O-CB 3.03Å; L182-Q186 PolarHBondContact O-N 2.85Å; L182-I192 HydrophobicContact CD2-CD1 4.15Å; L182-V194 HydrophobicContact CB-CG2 4.17Å; L182-V194 HydrophobicContact CD1-CG1 4.31Å
183	H	86.9	Confident	85	Confident	79 Å²	79	68.8 Å²	68.8	37%	0.366	34%	0.34	S	S	.	.	H	α-helix	trans	-67.8	-38.6	174.3	-81.5	-59.2	0	0	0	112.6	M179 R180 I185 Q186 I187	M179-H183 WeakPolarHBondContact CE-NE2 3.06Å; M179-H183 WeakPolarHBondContact O-CB 3.05Å; M179-H183 PolarHBondContact O-CD2 2.9Å; M179-H183 PolarHBondContact O-N 3.29Å; R180-H183 PolarHBondContact O-N 3.17Å; H183-I185 VanDerWaalsContact C-N 3.34Å; H183-I185 PolarHBondContact O-N 2.9Å; H183-Q186 WeakPolarHBondContact O-CB 3.49Å; H183-Q186 PolarHBondContact O-N 2.95Å; H183-I187 VanDerWaalsContact O-CG1 3.27Å; H183-I187 WeakPolarHBondContact O-CG1 3.46Å; H183-I187 PolarHBondContact O-N 2.93Å
184	E	86.1	Confident	85.1	Confident	113 Å²	113	62 Å²	62	53%	0.528	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-44.2	172.8	-73.2	167.5	-171.7	0	0	111.7	R180 K181 I187 S188	R180-E184 WeakPolarHBondContact O-CG 3.44Å; R180-E184 PolarHBondContact O-N 2.84Å; K181-E184 PolarHBondContact O-N 3.2Å; E184-I187 PolarHBondContact O-N 2.91Å; E184-S188 VanDerWaalsContact O-CB 3.28Å; E184-S188 WeakPolarHBondContact O-CB 3.36Å; E184-S188 PolarHBondContact O-N 2.78Å; E184-S188 PolarHBondContact O-OG 3.1Å
185	I	83.4	Confident	85	Confident	50 Å²	50	60.7 Å²	60.7	26%	0.256	30%	0.301	S	S	.	.	H	α-helix	trans	-65.9	-41.9	175.8	-63.8	165	0	0	0	110.8	L164 L167 K181 L182 H183 I187 S188 T189 I192	L164-I185 HydrophobicContact CD1-CD1 4.22Å; L164-I185 HydrophobicContact CD1-CG2 4.29Å; L167-I185 HydrophobicContact CD2-CD1 3.83Å; K181-I185 VanDerWaalsContact O-CG1 3.3Å; K181-I185 WeakPolarHBondContact O-CG1 3.47Å; K181-I185 PolarHBondContact O-N 2.85Å; L182-I185 PolarHBondContact O-N 3.06Å; H183-I185 VanDerWaalsContact C-N 3.34Å; H183-I185 PolarHBondContact O-N 2.9Å; I185-I187 PolarHBondContact O-N 3.33Å; I185-S188 WeakPolarHBondContact CA-OG 3.3Å; I185-S188 PolarHBondContact O-N 3.42Å; I185-S188 PolarHBondContact O-OG 3.35Å; I185-T189 HydrophobicContact CG2-CG2 4.27Å; I185-T189 WeakPolarHBondContact O-CB 2.98Å; I185-T189 PolarHBondContact O-N 2.96Å; I185-T189 PolarHBondContact O-OG1 3.37Å; I185-I192 HydrophobicContact CB-CD1 3.81Å; I185-I192 HydrophobicContact CG2-CD1 3.56Å; I185-I192 HydrophobicContact CG2-CG1 3.97Å
186	Q	86.5	Confident	85	Confident	45 Å²	45	59.5 Å²	59.5	21%	0.21	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-45.5	175.9	172.1	168.6	-31.6	0	0	111.8	L182 H183 N190 I192	L182-Q186 WeakPolarHBondContact O-CB 3.03Å; L182-Q186 PolarHBondContact O-N 2.85Å; H183-Q186 WeakPolarHBondContact O-CB 3.49Å; H183-Q186 PolarHBondContact O-N 2.95Å; Q186-N190 WeakPolarHBondContact O-CA 3.24Å; Q186-N190 PolarHBondContact O-N 3.37Å; Q186-I192 HydrophobicContact CB-CD1 4.42Å; Q186-I192 HydrophobicContact CB-CG1 3.94Å; Q186-I192 VanDerWaalsContact CG-O 3.27Å; Q186-I192 WeakPolarHBondContact CG-O 3.25Å
187	I	84.1	Confident	84.5	Confident	143 Å²	143	57.7 Å²	57.7	73%	0.733	29%	0.292	S	S	*	.	H	α-helix	trans	-70	-44.2	-179.2	-66.9	164.4	0	0	0	110.9	H183 E184 I185	H183-I187 VanDerWaalsContact O-CG1 3.27Å; H183-I187 WeakPolarHBondContact O-CG1 3.46Å; H183-I187 PolarHBondContact O-N 2.93Å; E184-I187 PolarHBondContact O-N 2.91Å; I185-I187 PolarHBondContact O-N 3.33Å
188	S	81.9	Confident	83.7	Confident	80 Å²	80	61.7 Å²	61.7	56%	0.559	30%	0.303	S	S	*	.	H	α-helix	trans	-74.2	-35.4	-174.9	57	0	0	0	0	114.1	E184 I185	E184-S188 VanDerWaalsContact O-CB 3.28Å; E184-S188 WeakPolarHBondContact O-CB 3.36Å; E184-S188 PolarHBondContact O-N 2.78Å; E184-S188 PolarHBondContact O-OG 3.1Å; I185-S188 WeakPolarHBondContact CA-OG 3.3Å; I185-S188 PolarHBondContact O-N 3.42Å; I185-S188 PolarHBondContact O-OG 3.35Å
189	T	77.4	Confident	82.5	Confident	57 Å²	57	64 Å²	64	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-107.5	-26	-174.1	67.9	0	0	0	0	113.4	I185 A191	I185-T189 HydrophobicContact CG2-CG2 4.27Å; I185-T189 WeakPolarHBondContact O-CB 2.98Å; I185-T189 PolarHBondContact O-N 2.96Å; I185-T189 PolarHBondContact O-OG1 3.37Å; T189-A191 PolarHBondContact O-N 3.3Å; T189-A191 WeakPolarHBondContact OG1-CB 3.48Å; T189-A191 PolarHBondContact OG1-N 3.38Å
190	N	80.9	Confident	81.1	Confident	94 Å²	94	63.9 Å²	63.9	50%	0.503	32%	0.321	S	S	.	.			trans	48.3	23.4	-167.6	-161.3	17.5	0	0	0	113.2	Q186	Q186-N190 WeakPolarHBondContact O-CA 3.24Å; Q186-N190 PolarHBondContact O-N 3.37Å
191	A	81.1	Confident	79.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.307	C	S	.	.	S	Bend	trans	-93.8	-17.6	-178.8	0	0	0	0	0	111.6	A146 K149 L150 T189	A146-A191 PolarHBondContact N-O 2.87Å; K149-A191 HydrophobicContact CB-CB 4.02Å; L150-A191 HydrophobicContact CD1-CB 3.5Å; T189-A191 PolarHBondContact O-N 3.3Å; T189-A191 WeakPolarHBondContact OG1-CB 3.48Å; T189-A191 PolarHBondContact OG1-N 3.38Å
192	I	86.5	Confident	77.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.5	176.9	63.3	169	0	0	0	111.2	Y144 L145 L164 L182 I185 Q186 V194	Y144-I192 CarbonylContact O-C 3.57Å; Y144-I192 WeakPolarHBondContact O-CA 3.36Å; L145-I192 HydrophobicContact CD1-CG2 3.47Å; L145-I192 VanDerWaalsContact CD1-CG2 3.47Å; L164-I192 HydrophobicContact CD1-CD1 4.27Å; L164-I192 HydrophobicContact CD1-CG2 4.34Å; L164-I192 HydrophobicContact CD2-CG2 3.84Å; L182-I192 HydrophobicContact CD2-CD1 4.15Å; I185-I192 HydrophobicContact CB-CD1 3.81Å; I185-I192 HydrophobicContact CG2-CD1 3.56Å; I185-I192 HydrophobicContact CG2-CG1 3.97Å; Q186-I192 HydrophobicContact CB-CD1 4.42Å; Q186-I192 HydrophobicContact CB-CG1 3.94Å; Q186-I192 VanDerWaalsContact CG-O 3.27Å; Q186-I192 WeakPolarHBondContact CG-O 3.25Å; I192-V194 HydrophobicContact CD1-CG2 4.07Å
193	K	87.5	Confident	75.8	Confident	57 Å²	57	59.3 Å²	59.3	25%	0.248	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	122.5	168.2	-178.4	161.3	-173.2	165.9	0	110	F65 M143 Y144	F65-K193 HydrophobicContact CE1-CB 3.92Å; F65-K193 HydrophobicContact CE2-CB 4.15Å; F65-K193 HydrophobicContact CE2-CD 4.29Å; F65-K193 HydrophobicContact CZ-CB 3.69Å; F65-K193 HydrophobicContact CZ-CD 4.46Å; M143-K193 CarbonylContact C-O 3.47Å; M143-K193 WeakPolarHBondContact CA-O 3.28Å; Y144-K193 PolarHBondContact N-O 2.98Å; Y144-K193 PolarHBondContact O-N 3.27Å
194	V	88	Confident	73.7	Confident	11 Å²	11	59.4 Å²	59.4	7%	0.067	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.5	-171.5	-172.2	0	0	0	0	110.5	L141 T142 M143 M179 L182 I192	L141-V194 HydrophobicContact CD1-CG1 3.33Å; L141-V194 HydrophobicContact CG-CG1 4.31Å; T142-V194 CarbonylContact O-C 3.53Å; T142-V194 WeakPolarHBondContact O-CA 3.48Å; M143-V194 HydrophobicContact CG-CB 4.45Å; M143-V194 HydrophobicContact CG-CG1 4.05Å; M143-V194 HydrophobicContact CG-CG2 3.95Å; M179-V194 HydrophobicContact CE-CG1 4.1Å; M179-V194 HydrophobicContact SD-CG1 4.13Å; L182-V194 HydrophobicContact CB-CG2 4.17Å; L182-V194 HydrophobicContact CD1-CG1 4.31Å; I192-V194 HydrophobicContact CD1-CG2 4.07Å
195	T	84.1	Confident	71.7	Confident	56 Å²	56	60.1 Å²	60.1	34%	0.344	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	116.3	178.2	-52.7	0	0	0	0	108.8	T142 T197	T142-T195 PolarHBondContact N-O 3.26Å; T142-T195 PolarHBondContact O-N 3.26Å; T195-T197 HydrophobicContact CG2-CG2 4.46Å
196	E	82.4	Confident	69.8	Low	66 Å²	66	61.6 Å²	61.6	31%	0.308	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	132.4	171.7	-173.4	-178.2	178	0	0	109.1	Y171 M179 R198	Y171-E196 HydrophobicContact CE2-CG 4.42Å; Y171-E196 VanDerWaalsContact OH-CD 3.24Å; Y171-E196 WeakPolarHBondContact OH-CG 3.25Å; Y171-E196 PolarHBondContact OH-OE1 3.25Å; M179-E196 HydrophobicContact CE-CB 4.24Å; E196-R198 IonicContact OE1-CZ 3.85Å; E196-R198 IonicContact OE1-NE 3.09Å; E196-R198 PolarHBondContact OE1-NE 3.34Å; E196-R198 IonicContact OE1-NH2 3.95Å; E196-R198 PolarHBondContact OE1-NH2 3.35Å
197	T	74.8	Confident	68	Low	53 Å²	53	68 Å²	68	33%	0.325	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.7	176.5	46.3	0	0	0	0	109.4	E139 A140 T195	E139-T197 WeakPolarHBondContact CA-O 3.48Å; A140-T197 WeakPolarHBondContact CB-OG1 3.34Å; A140-T197 PolarHBondContact N-O 3.4Å; A140-T197 PolarHBondContact O-N 2.96Å; A140-T197 PolarHBondContact O-OG1 3.3Å; T195-T197 HydrophobicContact CG2-CG2 4.46Å
198	R	69.4	Low	66.1	Low	96 Å²	96	67.9 Å²	67.9	36%	0.362	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120	177.5	-77.7	180	-172	-109.8	-24.6	109.2	E139 Y171 R175 E196 L202	E139-R198 HydrophobicContact CG-CG 4.28Å; E139-R198 IonicContact OE1-CZ 3.94Å; E139-R198 IonicContact OE1-NH1 3.22Å; E139-R198 IonicContact OE1-NH2 4Å; E139-R198 PolarHBondContact OE1-NH2 3.35Å; Y171-R198 PolarHBondContact OH-NH2 3.5Å; R175-R198 VanDerWaalsContact NH1-NH1 3.11Å; E196-R198 IonicContact OE1-CZ 3.85Å; E196-R198 IonicContact OE1-NE 3.09Å; E196-R198 PolarHBondContact OE1-NE 3.34Å; E196-R198 IonicContact OE1-NH2 3.95Å; E196-R198 PolarHBondContact OE1-NH2 3.35Å; R198-L202 HydrophobicContact CB-CD1 3.77Å; R198-L202 HydrophobicContact CG-CD1 3.9Å
199	T	61.7	Low	64.4	Low	50 Å²	50	69.8 Å²	69.8	31%	0.307	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	136.3	-175.6	43.8	0	0	0	0	110.2	G137 E138 L217	G137-T199 CarbonylContact C-O 3.59Å; G137-T199 WeakPolarHBondContact CA-O 3.31Å; E138-T199 PolarHBondContact N-O 3.15Å; E138-T199 PolarHBondContact O-N 3.05Å; E138-T199 PolarHBondContact O-OG1 2.98Å; T199-L217 HydrophobicContact CG2-CD1 3.68Å
200	G	58.2	Low	62.9	Low	16 Å²	16	73.2 Å²	73.2	17%	0.165	42%	0.415	C	S	.	.	S	Bend	trans	93.6	178.5	-179.9	0	0	0	0	0	114.7	L202	G200-L202 PolarHBondContact O-N 2.66Å
201	P	52.5	Low	61.1	Low	49 Å²	49	76.4 Å²	76.4	32%	0.318	43%	0.432	S	S	.	.			trans	-71.7	96.3	-174.1	28.5	-32.8	0	0	0	110.5	G203 V213	P201-G203 PolarHBondContact O-N 3.22Å; P201-V213 HydrophobicContact CB-CG1 3.75Å
202	L	50.8	Low	59.2	Low	68 Å²	68	80.8 Å²	80.8	36%	0.356	46%	0.463	S	S	.	.			trans	-82	91	175.4	-71.7	168.9	0	0	0	109.1	F75 R198 G200	F75-L202 HydrophobicContact CD2-CD2 3.58Å; F75-L202 HydrophobicContact CE2-CD2 3.5Å; F75-L202 HydrophobicContact CG-CD2 4.49Å; F75-L202 HydrophobicContact CZ-CD2 4.39Å; R198-L202 HydrophobicContact CB-CD1 3.77Å; R198-L202 HydrophobicContact CG-CD1 3.9Å; G200-L202 PolarHBondContact O-N 2.66Å
203	G	47.3	Very low	57.1	Low	61 Å²	61	83.8 Å²	83.8	63%	0.629	48%	0.481	S	S	*	.			trans	74.3	102.7	165	0	0	0	0	0	115.2	P201 S205	P201-G203 PolarHBondContact O-N 3.22Å; G203-S205 VanDerWaalsContact C-N 3.29Å; G203-S205 PolarHBondContact O-N 2.65Å
204	C	42.9	Very low	54.9	Low	82 Å²	82	86.3 Å²	86.3	55%	0.554	51%	0.506	S	S	*	.			trans	-70.2	88.5	151.5	-56.7	0	0	0	0	108.2	Y207	C204-Y207 HydrophobicContact CB-CD2 3.98Å; C204-Y207 HydrophobicContact CB-CE2 3.86Å
205	S	43.8	Very low	53.1	Low	128 Å²	128	89.2 Å²	89.2	90%	0.895	53%	0.527	S	S	*	.	S	Bend	trans	-94.6	-6.6	159.4	53.9	0	0	0	0	112.4	G203	G203-S205 VanDerWaalsContact C-N 3.29Å; G203-S205 PolarHBondContact O-N 2.65Å
206	S	44.1	Very low	51.6	Low	80 Å²	80	91 Å²	91	56%	0.559	53%	0.533	S	S	*	.			trans	-141.2	120.3	166.5	158	0	0	0	0	107.9	D208	S206-D208 PolarHBondContact O-N 2.88Å
207	Y	47.8	Very low	50.1	Low	180 Å²	180	90.4 Å²	90.4	71%	0.706	53%	0.532	S	S	*	.			trans	-81.9	3.6	-176.1	-110.3	-92.2	0	0	0	113.3	C204	C204-Y207 HydrophobicContact CB-CD2 3.98Å; C204-Y207 HydrophobicContact CB-CE2 3.86Å
208	D	45.4	Very low	49.1	Very low	141 Å²	141	91.7 Å²	91.7	75%	0.754	54%	0.536	S	S	*	.	S	Bend	trans	-92	-6.2	-164.4	-68.7	-34.3	0	0	0	115.2	S206	S206-D208 PolarHBondContact O-N 2.88Å
209	N	45.3	Very low	48.1	Very low	119 Å²	119	94.9 Å²	94.9	64%	0.636	56%	0.555	S	S	*	*			trans	-130	76.3	177	-84.6	-31.2	0	0	0	111.5	D211 S212	N209-D211 PolarHBondContact O-N 3.32Å; N209-S212 PolarHBondContact O-OG 3.13Å
210	L	47.6	Very low	47.7	Very low	130 Å²	130	93.2 Å²	93.2	68%	0.681	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-67.4	-15.8	171.3	-89.8	133.6	0	0	0	113.5	S212 V213	L210-S212 VanDerWaalsContact C-N 3.26Å; L210-S212 PolarHBondContact O-N 3.29Å; L210-V213 PolarHBondContact O-N 3.34Å
211	D	42.2	Very low	47.4	Very low	160 Å²	160	97.2 Å²	97.2	86%	0.856	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-74.2	-12.2	-176.3	-72	-16.2	0	0	0	114.2	N209	N209-D211 PolarHBondContact O-N 3.32Å
212	S	41.6	Very low	47.4	Very low	93 Å²	93	98 Å²	98	65%	0.65	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-100.2	-1	176	60.9	0	0	0	0	114.1	N209 L210 S214	N209-S212 PolarHBondContact O-OG 3.13Å; L210-S212 VanDerWaalsContact C-N 3.26Å; L210-S212 PolarHBondContact O-N 3.29Å; S212-S214 VanDerWaalsContact C-N 3.29Å; S212-S214 PolarHBondContact O-N 3.43Å
213	V	42.8	Very low	47.9	Very low	64 Å²	64	95.6 Å²	95.6	39%	0.388	56%	0.557	S	S	.	*			trans	-93.1	50.6	-178.1	-162.7	0	0	0	0	111.1	P201 L210	P201-V213 HydrophobicContact CB-CG1 3.75Å; L210-V213 PolarHBondContact O-N 3.34Å
214	S	40.9	Very low	48.7	Very low	110 Å²	110	100.8 Å²	100.8	77%	0.769	56%	0.563	S	S	*	*			trans	-94	-0.2	-171.5	56.1	0	0	0	0	115.5	S212	S212-S214 VanDerWaalsContact C-N 3.29Å; S212-S214 PolarHBondContact O-N 3.43Å
215	S	49	Very low	50.2	Low	71 Å²	71	100.7 Å²	100.7	50%	0.497	56%	0.556	S	S	.	*			trans	-122.2	71.6	-178.7	63.9	0	0	0	0	113.3	L217	S215-L217 PolarHBondContact O-N 3.05Å
216	I	52.4	Low	51.9	Low	94 Å²	94	99.3 Å²	99.3	48%	0.482	54%	0.535	S	S	.	.			trans	-75.7	110.6	158.9	-62.3	170.3	0	0	0	107	L135	L135-I216 HydrophobicContact CB-CG2 3.59Å; L135-I216 HydrophobicContact CD1-CG2 3.69Å; L135-I216 HydrophobicContact CD2-CG2 4.16Å; L135-I216 HydrophobicContact CG-CG2 4.01Å
217	L	52.3	Low	53.8	Low	53 Å²	53	99.5 Å²	99.5	28%	0.277	53%	0.529	S	S	.	.			trans	-89.4	120.5	-175	-75.5	163.8	0	0	0	111.4	T199 S215 Q219	T199-L217 HydrophobicContact CG2-CD1 3.68Å; S215-L217 PolarHBondContact O-N 3.05Å; L217-Q219 HydrophobicContact CB-CB 4.48Å; L217-Q219 HydrophobicContact CD2-CB 4.4Å; L217-Q219 PolarHBondContact O-N 2.92Å
218	L	52.6	Low	55.5	Low	81 Å²	81	93.7 Å²	93.7	42%	0.424	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	0.9	159.4	-84.4	158.5	0	0	0	113	L130 A133 L135 S223 L225	L130-L218 HydrophobicContact CD2-CD1 4.29Å; L130-L218 HydrophobicContact CD2-CD2 3.49Å; L130-L218 VanDerWaalsContact CD2-CD2 3.49Å; A133-L218 HydrophobicContact CB-CD2 3.4Å; L135-L218 HydrophobicContact CD2-CD2 3.48Å; L135-L218 VanDerWaalsContact CD2-CD2 3.48Å; L135-L218 HydrophobicContact CD2-CG 3.6Å; L218-S223 PolarHBondContact O-OG 3.19Å; L218-L225 HydrophobicContact CD2-CD2 4.25Å
219	Q	49.1	Very low	57.3	Low	163 Å²	163	87.3 Å²	87.3	76%	0.762	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.5	11	-166.6	-70.2	-171.8	-15.3	0	0	114.5	L217	L217-Q219 HydrophobicContact CB-CB 4.48Å; L217-Q219 HydrophobicContact CD2-CB 4.4Å; L217-Q219 PolarHBondContact O-N 2.92Å
220	S	53.4	Low	59.4	Low	15 Å²	15	82 Å²	82	11%	0.105	45%	0.448	C	S	.	.			trans	-65.1	132.3	169.5	69.3	0	0	0	0	108.5	E222 S223	S220-E222 PolarHBondContact O-N 3.47Å; S220-S223 WeakPolarHBondContact O-CB 3.48Å; S220-S223 PolarHBondContact O-N 2.99Å; S220-S223 PolarHBondContact O-OG 2.92Å; S220-S223 WeakPolarHBondContact OG-CB 3.14Å; S220-S223 PolarHBondContact OG-N 3.4Å
221	P	52.3	Low	61.3	Low	100 Å²	100	78.6 Å²	78.6	65%	0.649	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-9.4	-174.2	24.3	-34.1	0	0	0	113.9
222	E	52.4	Low	63.4	Low	64 Å²	64	73.3 Å²	73.3	30%	0.299	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	3.4	-179	-66.3	157.1	-155	0	0	112.3	K70 Y72 S220 K224	K70-E222 IonicContact NZ-OE1 2.66Å; K70-E222 PolarHBondContact NZ-OE1 3.3Å; Y72-E222 WeakPolarHBondContact CD2-OE2 3.32Å; Y72-E222 WeakPolarHBondContact CE1-OE1 3.38Å; Y72-E222 VanDerWaalsContact CE1-OE2 3.24Å; Y72-E222 WeakPolarHBondContact CE1-OE2 3.5Å; Y72-E222 WeakPolarHBondContact CE2-OE2 3.35Å; Y72-E222 PolarHBondContact OH-OE2 3.27Å; Y72-E222 VanDerWaalsContact OH-OE2 3.08Å; S220-E222 PolarHBondContact O-N 3.47Å; E222-K224 PolarHBondContact O-N 3.38Å; E222-K224 VanDerWaalsContact O-N 3.15Å
223	S	59.9	Low	65.4	Low	18 Å²	18	70.9 Å²	70.9	13%	0.126	38%	0.381	C	S	.	.			trans	-59.6	118.8	167.6	59.7	0	0	0	0	109.2	T134 L218 S220 L225	T134-S223 WeakPolarHBondContact O-CB 3.16Å; L218-S223 PolarHBondContact O-OG 3.19Å; S220-S223 WeakPolarHBondContact O-CB 3.48Å; S220-S223 PolarHBondContact O-N 2.99Å; S220-S223 PolarHBondContact O-OG 2.92Å; S220-S223 WeakPolarHBondContact OG-CB 3.14Å; S220-S223 PolarHBondContact OG-N 3.4Å; S223-L225 VanDerWaalsContact C-N 3.31Å; S223-L225 PolarHBondContact O-N 3Å
224	K	65.4	Low	67.5	Low	171 Å²	171	68.1 Å²	68.1	74%	0.743	36%	0.364	S	S	*	.			trans	-72.1	90.9	175.7	-67	-175.5	-178.1	-178.7	0	108.4	E222	E222-K224 PolarHBondContact O-N 3.38Å; E222-K224 VanDerWaalsContact O-N 3.15Å
225	L	74.4	Confident	69.7	Low	79 Å²	79	65.4 Å²	65.4	41%	0.414	34%	0.344	S	S	.	.			trans	-79.4	120.9	173.6	-57.5	179.5	0	0	0	109.1	L130 A133 L218 S223 L227	L130-L225 HydrophobicContact CD1-CB 4.26Å; L130-L225 HydrophobicContact CD1-CD2 3.9Å; A133-L225 HydrophobicContact CB-CD2 3.75Å; L218-L225 HydrophobicContact CD2-CD2 4.25Å; S223-L225 VanDerWaalsContact C-N 3.31Å; S223-L225 PolarHBondContact O-N 3Å; L225-L227 HydrophobicContact CB-CD2 4.3Å; L225-L227 HydrophobicContact CB-CG 4.15Å
226	H	79.6	Confident	71.4	Confident	100 Å²	100	69.7 Å²	69.7	46%	0.463	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	104	166.4	-171.7	45.4	0	0	0	107.8	I131 S132	I131-H226 WeakPolarHBondContact CB-O 3.33Å; I131-H226 WeakPolarHBondContact CD1-NE2 3.43Å; I131-H226 PolarHBondContact N-O 2.93Å; S132-H226 PolarHBondContact N-O 3.42Å; S132-H226 PolarHBondContact O-N 3.41Å; S132-H226 WeakPolarHBondContact OG-CB 3.43Å
227	L	82.6	Confident	73.1	Confident	83 Å²	83	71.8 Å²	71.8	44%	0.435	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	144	-178.6	-61.8	179.9	0	0	0	110.1	H128 I129 L130 L225	H128-L227 HydrophobicContact CB-CB 4.08Å; H128-L227 HydrophobicContact CB-CD1 4.24Å; I129-L227 WeakPolarHBondContact O-CA 3.23Å; L130-L227 HydrophobicContact CB-CD2 4.33Å; L130-L227 HydrophobicContact CD1-CD2 3.74Å; L225-L227 HydrophobicContact CB-CD2 4.3Å; L225-L227 HydrophobicContact CB-CG 4.15Å
228	Q	83.4	Confident	74.9	Confident	59 Å²	59	69.3 Å²	69.3	28%	0.276	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.3	166.8	173.9	172.4	28	0	0	108.6	H128 I129 I131 V232	H128-Q228 CarbonylContact C-O 3.59Å; H128-Q228 VanDerWaalsContact CA-O 3.26Å; H128-Q228 WeakPolarHBondContact CA-O 3.23Å; H128-Q228 WeakPolarHBondContact CB-O 3.16Å; I129-Q228 HydrophobicContact CG1-CB 4.06Å; I129-Q228 WeakPolarHBondContact CG1-O 3.27Å; I129-Q228 PolarHBondContact N-O 3.19Å; I129-Q228 PolarHBondContact O-N 3.07Å; I131-Q228 HydrophobicContact CD1-CB 3.36Å; I131-Q228 HydrophobicContact CD1-CG 4.31Å; I131-Q228 HydrophobicContact CG1-CB 3.8Å; Q228-V232 HydrophobicContact CG-CG2 4Å
229	G	84.8	Confident	76.7	Confident	7 Å²	7	68.5 Å²	68.5	7%	0.072	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	139.3	179.1	0	0	0	0	0	111.3	Q231 V232	G229-Q231 PolarHBondContact O-N 3.42Å; G229-Q231 VanDerWaalsContact O-N 3.11Å; G229-Q231 PolarHBondContact O-OE1 2.94Å; G229-V232 PolarHBondContact O-N 3.28Å
230	L	89	Confident	78.6	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.037	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-64.5	-15.6	-177.4	-176.3	67.9	0	0	0	112.3	F101 I121 T127 I129 V232 I233 F234 F242	F101-L230 HydrophobicContact CE2-CD2 4.2Å; F101-L230 HydrophobicContact CZ-CD1 4.07Å; F101-L230 HydrophobicContact CZ-CD2 4.23Å; F101-L230 HydrophobicContact CZ-CG 4.43Å; I121-L230 HydrophobicContact CG2-CD2 3.87Å; T127-L230 WeakPolarHBondContact O-CB 3.49Å; T127-L230 PolarHBondContact O-N 3.46Å; I129-L230 HydrophobicContact CG2-CB 4.34Å; I129-L230 HydrophobicContact CG2-CD1 3.27Å; I129-L230 HydrophobicContact CG2-CG 4.39Å; L230-V232 PolarHBondContact O-N 3.11Å; L230-I233 HydrophobicContact CD1-CB 4.5Å; L230-I233 HydrophobicContact CD1-CD1 4.01Å; L230-I233 PolarHBondContact O-N 3Å; L230-I233 VanDerWaalsContact O-N 3.08Å; L230-F234 HydrophobicContact CD2-CE2 3.92Å; L230-F234 HydrophobicContact CD2-CZ 4.25Å; L230-F234 HydrophobicContact CG-CD2 4.5Å; L230-F234 HydrophobicContact CG-CE2 3.72Å; L230-F234 HydrophobicContact CG-CZ 4.4Å; L230-F234 WeakPolarHBondContact O-CD2 3.36Å; L230-F242 HydrophobicContact CB-CE1 4.08Å; L230-F242 HydrophobicContact CB-CZ 3.72Å; L230-F242 HydrophobicContact CD2-CE2 4.13Å; L230-F242 HydrophobicContact CD2-CZ 4.06Å; L230-F242 HydrophobicContact CG-CZ 4.26Å
231	Q	87.8	Confident	80.4	Confident	58 Å²	58	70.3 Å²	70.3	27%	0.271	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-50.5	-32.5	175.8	67.1	-83.4	9.9	0	0	113.2	G229 I233 F234 Q239 F242 V243	G229-Q231 PolarHBondContact O-N 3.42Å; G229-Q231 VanDerWaalsContact O-N 3.11Å; G229-Q231 PolarHBondContact O-OE1 2.94Å; Q231-I233 PolarHBondContact O-N 3.38Å; Q231-F234 PolarHBondContact O-N 3.1Å; Q231-Q239 HydrophobicContact CB-CB 4.34Å; Q231-Q239 WeakPolarHBondContact O-CG 3.48Å; Q231-F242 HydrophobicContact CB-CD1 3.78Å; Q231-F242 HydrophobicContact CB-CE1 4.31Å; Q231-V243 HydrophobicContact CB-CG2 4.16Å; Q231-V243 HydrophobicContact CG-CG2 4.25Å
232	V	84.6	Confident	82.3	Confident	50 Å²	50	65.7 Å²	65.7	30%	0.303	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-68.9	-20.1	-174	-168.6	0	0	0	0	112.3	L90 Q228 G229 L230	L90-V232 HydrophobicContact CD1-CB 4.43Å; L90-V232 HydrophobicContact CD1-CG1 3.39Å; Q228-V232 HydrophobicContact CG-CG2 4Å; G229-V232 PolarHBondContact O-N 3.28Å; L230-V232 PolarHBondContact O-N 3.11Å
233	I	84.6	Confident	84	Confident	42 Å²	42	65.5 Å²	65.5	22%	0.215	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-85	-19.3	176.2	-68.4	178.1	0	0	0	111.8	L97 F101 I129 L230 Q231	L97-I233 HydrophobicContact CD1-CG2 3.65Å; L97-I233 HydrophobicContact CD2-CD1 4.18Å; L97-I233 HydrophobicContact CD2-CG2 3.64Å; L97-I233 HydrophobicContact CG-CG2 4.28Å; F101-I233 HydrophobicContact CE1-CG2 3.89Å; I129-I233 HydrophobicContact CD1-CD1 3.7Å; I129-I233 HydrophobicContact CD1-CG1 4.17Å; I129-I233 HydrophobicContact CG2-CD1 4.01Å; L230-I233 HydrophobicContact CD1-CB 4.5Å; L230-I233 HydrophobicContact CD1-CD1 4.01Å; L230-I233 PolarHBondContact O-N 3Å; L230-I233 VanDerWaalsContact O-N 3.08Å; Q231-I233 PolarHBondContact O-N 3.38Å
234	F	86.7	Confident	85.4	Confident	6 Å²	6	67.4 Å²	67.4	3%	0.026	33%	0.326	C	S	.	.	S	Bend	trans	-83	150.2	-178.2	-70.6	-72.8	0	0	0	112.2	F101 V105 F117 I121 L230 Q231 L238 Q239 F242	F101-F234 HydrophobicContact CE2-CZ 4.47Å; F101-F234 HydrophobicContact CZ-CE1 4.22Å; F101-F234 AromaticContact CZ-CZ 3.83Å; F101-F234 HydrophobicContact CZ-CZ 3.83Å; V105-F234 HydrophobicContact CB-CE1 4.35Å; V105-F234 HydrophobicContact CG1-CD1 3.96Å; V105-F234 HydrophobicContact CG1-CE1 4.02Å; V105-F234 HydrophobicContact CG2-CD1 4.19Å; V105-F234 HydrophobicContact CG2-CE1 3.55Å; V105-F234 HydrophobicContact CG2-CZ 4.44Å; F117-F234 HydrophobicContact CE1-CE1 4.44Å; I121-F234 HydrophobicContact CD1-CE1 4.42Å; I121-F234 HydrophobicContact CD1-CZ 4.28Å; I121-F234 HydrophobicContact CG1-CE1 4.45Å; I121-F234 HydrophobicContact CG1-CZ 4.14Å; I121-F234 HydrophobicContact CG2-CE2 4.24Å; I121-F234 HydrophobicContact CG2-CZ 3.66Å; L230-F234 HydrophobicContact CD2-CE2 3.92Å; L230-F234 HydrophobicContact CD2-CZ 4.25Å; L230-F234 HydrophobicContact CG-CD2 4.5Å; L230-F234 HydrophobicContact CG-CE2 3.72Å; L230-F234 HydrophobicContact CG-CZ 4.4Å; L230-F234 WeakPolarHBondContact O-CD2 3.36Å; Q231-F234 PolarHBondContact O-N 3.1Å; F234-L238 HydrophobicContact CB-CB 4.17Å; F234-L238 HydrophobicContact CD1-CD1 4.47Å; F234-Q239 HydrophobicContact CB-CG 4.38Å; F234-Q239 PolarHBondContact O-NE2 3.26Å; F234-F242 HydrophobicContact CD2-CB 4.45Å; F234-F242 HydrophobicContact CD2-CD2 4.14Å; F234-F242 HydrophobicContact CD2-CG 4.13Å; F234-F242 AromaticContact CE2-CD2 3.58Å; F234-F242 HydrophobicContact CE2-CD2 3.58Å; F234-F242 AromaticContact CE2-CE2 3.77Å; F234-F242 HydrophobicContact CE2-CE2 3.77Å; F234-F242 HydrophobicContact CE2-CG 4.03Å; F234-F242 HydrophobicContact CE2-CZ 4.35Å; F234-F242 HydrophobicContact CZ-CD2 4.26Å; F234-F242 HydrophobicContact CZ-CE2 4.44Å
235	P	86.5	Confident	86.6	Confident	52 Å²	52	59.3 Å²	59.3	34%	0.338	29%	0.29	S	S	.	.			trans	-53.6	145.8	167.7	-24.1	33.6	0	0	0	111.9	Y237 L238 Q239	P235-Y237 VanDerWaalsContact C-N 3.25Å; P235-Y237 HydrophobicContact CB-CD1 3.61Å; P235-Y237 HydrophobicContact CB-CE1 3.22Å; P235-Y237 HydrophobicContact CG-CE1 3.91Å; P235-Y237 PolarHBondContact O-N 3.01Å; P235-Y237 VanDerWaalsContact O-N 3.1Å; P235-L238 WeakPolarHBondContact O-CB 3.37Å; P235-L238 PolarHBondContact O-N 3.16Å; P235-Q239 WeakPolarHBondContact O-CG 3.26Å; P235-Q239 PolarHBondContact O-N 3.26Å
236	E	85.3	Confident	87.2	Confident	161 Å²	161	56 Å²	56	75%	0.752	27%	0.274	S	S	*	.	H	α-helix	trans	-48.7	-43.4	-174.6	-70.6	-179.2	174.6	0	0	113.5	L238 Q239	E236-L238 PolarHBondContact O-N 2.51Å; E236-L238 VanDerWaalsContact O-N 3.1Å; E236-Q239 PolarHBondContact O-N 3.07Å; E236-Q239 VanDerWaalsContact O-N 3.16Å
237	Y	87.8	Confident	87.6	Confident	138 Å²	138	54.3 Å²	54.3	54%	0.541	27%	0.269	S	S	.	.	H	α-helix	trans	-64.5	-15.5	-179.9	70.7	-90.7	0	0	0	114.7	P235	P235-Y237 VanDerWaalsContact C-N 3.25Å; P235-Y237 HydrophobicContact CB-CD1 3.61Å; P235-Y237 HydrophobicContact CB-CE1 3.22Å; P235-Y237 HydrophobicContact CG-CE1 3.91Å; P235-Y237 PolarHBondContact O-N 3.01Å; P235-Y237 VanDerWaalsContact O-N 3.1Å
238	L	90.9	Very high	87.8	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-101.9	-15.5	177.8	-71.5	-172.5	0	0	0	113.4	V105 P112 F117 F234 P235 E236 K241 F242	V105-L238 HydrophobicContact CG1-CD1 4.5Å; P112-L238 HydrophobicContact CG-CD2 3.75Å; F117-L238 HydrophobicContact CE2-CD2 4.23Å; F117-L238 HydrophobicContact CZ-CB 4.06Å; F117-L238 HydrophobicContact CZ-CD1 4.35Å; F117-L238 HydrophobicContact CZ-CD2 4.06Å; F117-L238 HydrophobicContact CZ-CG 4.36Å; F234-L238 HydrophobicContact CB-CB 4.17Å; F234-L238 HydrophobicContact CD1-CD1 4.47Å; P235-L238 WeakPolarHBondContact O-CB 3.37Å; P235-L238 PolarHBondContact O-N 3.16Å; E236-L238 PolarHBondContact O-N 2.51Å; E236-L238 VanDerWaalsContact O-N 3.1Å; L238-K241 PolarHBondContact O-N 3.5Å; L238-F242 WeakPolarHBondContact O-CB 3.42Å; L238-F242 PolarHBondContact O-N 2.78Å
239	Q	90.6	Very high	87.8	Confident	64 Å²	64	51.8 Å²	51.8	30%	0.299	25%	0.251	S	S	.	.	H	α-helix	trans	-64.8	-48	-170.8	-62.1	-172.9	1.8	0	0	112.1	Q231 F234 P235 E236 K241 F242 V243	Q231-Q239 HydrophobicContact CB-CB 4.34Å; Q231-Q239 WeakPolarHBondContact O-CG 3.48Å; F234-Q239 HydrophobicContact CB-CG 4.38Å; F234-Q239 PolarHBondContact O-NE2 3.26Å; P235-Q239 WeakPolarHBondContact O-CG 3.26Å; P235-Q239 PolarHBondContact O-N 3.26Å; E236-Q239 PolarHBondContact O-N 3.07Å; E236-Q239 VanDerWaalsContact O-N 3.16Å; Q239-K241 PolarHBondContact O-N 3.07Å; Q239-F242 PolarHBondContact O-N 2.94Å; Q239-V243 WeakPolarHBondContact O-CG2 3.49Å; Q239-V243 PolarHBondContact O-N 2.99Å
240	E	88.7	Confident	87.5	Confident	167 Å²	167	54.3 Å²	54.3	78%	0.78	26%	0.263	S	S	*	.	H	α-helix	trans	-61.6	-45.5	178.9	-173.6	-180	-176.6	0	0	111.2	F242 V243 Q244	E240-F242 VanDerWaalsContact C-N 3.32Å; E240-F242 PolarHBondContact O-N 3.1Å; E240-V243 PolarHBondContact O-N 3.49Å; E240-Q244 PolarHBondContact O-N 2.67Å
241	K	90.3	Very high	86.9	Confident	50 Å²	50	56.6 Å²	56.6	22%	0.217	27%	0.274	C	S	.	.	H	α-helix	trans	-65.7	-35.6	179.2	-169.6	62.9	-177	173.2	0	112.1	T114 F117 L238 Q239 S245 E257	T114-K241 WeakPolarHBondContact OG1-CE 3.27Å; T114-K241 PolarHBondContact OG1-NZ 3.2Å; F117-K241 HydrophobicContact CD2-CB 4.47Å; F117-K241 HydrophobicContact CD2-CG 3.84Å; F117-K241 HydrophobicContact CE2-CB 3.92Å; F117-K241 HydrophobicContact CE2-CG 3.72Å; L238-K241 PolarHBondContact O-N 3.5Å; Q239-K241 PolarHBondContact O-N 3.07Å; K241-S245 WeakPolarHBondContact O-CB 3.5Å; K241-S245 PolarHBondContact O-N 3.26Å; K241-S245 PolarHBondContact O-OG 3.39Å; K241-E257 IonicContact NZ-OE1 2.79Å
242	F	92.1	Very high	86.4	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.013	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-46.1	172.5	174.6	-92.8	0	0	0	111.4	F117 I121 I122 L230 Q231 F234 L238 Q239 E240 Q244 S245 A246	F117-F242 HydrophobicContact CD1-CD2 4.04Å; F117-F242 HydrophobicContact CE1-CB 4.07Å; F117-F242 HydrophobicContact CE1-CD2 4Å; F117-F242 HydrophobicContact CZ-CB 4.18Å; I121-F242 HydrophobicContact CG2-CD2 4.36Å; I121-F242 HydrophobicContact CG2-CE2 3.83Å; I122-F242 HydrophobicContact CD1-CE2 4.48Å; I122-F242 HydrophobicContact CG1-CD2 4.48Å; I122-F242 HydrophobicContact CG1-CE2 3.87Å; L230-F242 HydrophobicContact CB-CE1 4.08Å; L230-F242 HydrophobicContact CB-CZ 3.72Å; L230-F242 HydrophobicContact CD2-CE2 4.13Å; L230-F242 HydrophobicContact CD2-CZ 4.06Å; L230-F242 HydrophobicContact CG-CZ 4.26Å; Q231-F242 HydrophobicContact CB-CD1 3.78Å; Q231-F242 HydrophobicContact CB-CE1 4.31Å; F234-F242 HydrophobicContact CD2-CB 4.45Å; F234-F242 HydrophobicContact CD2-CD2 4.14Å; F234-F242 HydrophobicContact CD2-CG 4.13Å; F234-F242 AromaticContact CE2-CD2 3.58Å; F234-F242 HydrophobicContact CE2-CD2 3.58Å; F234-F242 AromaticContact CE2-CE2 3.77Å; F234-F242 HydrophobicContact CE2-CE2 3.77Å; F234-F242 HydrophobicContact CE2-CG 4.03Å; F234-F242 HydrophobicContact CE2-CZ 4.35Å; F234-F242 HydrophobicContact CZ-CD2 4.26Å; F234-F242 HydrophobicContact CZ-CE2 4.44Å; L238-F242 WeakPolarHBondContact O-CB 3.42Å; L238-F242 PolarHBondContact O-N 2.78Å; Q239-F242 PolarHBondContact O-N 2.94Å; E240-F242 VanDerWaalsContact C-N 3.32Å; E240-F242 PolarHBondContact O-N 3.1Å; F242-Q244 PolarHBondContact O-N 3.29Å; F242-S245 PolarHBondContact O-N 3.18Å; F242-A246 HydrophobicContact CE1-CB 4.47Å; F242-A246 WeakPolarHBondContact O-CB 3.31Å; F242-A246 PolarHBondContact O-N 2.95Å
243	V	89.9	Confident	86.1	Confident	60 Å²	60	55.5 Å²	55.5	36%	0.364	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-45.8	178	173.8	0	0	0	0	110.8	Q231 Q239 E240 S245 A246 L247	Q231-V243 HydrophobicContact CB-CG2 4.16Å; Q231-V243 HydrophobicContact CG-CG2 4.25Å; Q239-V243 WeakPolarHBondContact O-CG2 3.49Å; Q239-V243 PolarHBondContact O-N 2.99Å; E240-V243 PolarHBondContact O-N 3.49Å; V243-S245 VanDerWaalsContact C-N 3.31Å; V243-S245 PolarHBondContact O-N 3.32Å; V243-A246 PolarHBondContact O-N 3.35Å; V243-L247 HydrophobicContact CG1-CD1 4.13Å; V243-L247 WeakPolarHBondContact O-CG 3.49Å; V243-L247 PolarHBondContact O-N 2.81Å
244	Q	88.6	Confident	85.7	Confident	58 Å²	58	53.9 Å²	53.9	27%	0.271	26%	0.262	S	S	.	.	H	α-helix	trans	-59.1	-43.1	175.4	-168.6	-169.5	15.7	0	0	111.6	E240 F242 L247 S248	E240-Q244 PolarHBondContact O-N 2.67Å; F242-Q244 PolarHBondContact O-N 3.29Å; Q244-L247 PolarHBondContact O-N 3.04Å; Q244-S248 WeakPolarHBondContact O-CB 3.45Å; Q244-S248 PolarHBondContact O-N 2.91Å; Q244-S248 PolarHBondContact O-OG 3.16Å
245	S	90.3	Very high	85.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-69	-38	179.6	-53.3	0	0	0	0	112.3	K241 F242 V243 S248 Y249	K241-S245 WeakPolarHBondContact O-CB 3.5Å; K241-S245 PolarHBondContact O-N 3.26Å; K241-S245 PolarHBondContact O-OG 3.39Å; F242-S245 PolarHBondContact O-N 3.18Å; V243-S245 VanDerWaalsContact C-N 3.31Å; V243-S245 PolarHBondContact O-N 3.32Å; S245-S248 PolarHBondContact O-N 2.99Å; S245-Y249 WeakPolarHBondContact O-CB 3.37Å; S245-Y249 PolarHBondContact O-N 3.15Å
246	A	88.2	Confident	85.4	Confident	10 Å²	10	55.1 Å²	55.1	8%	0.083	27%	0.266	C	S	.	.	H	α-helix	trans	-65.6	-42.5	174.9	0	0	0	0	0	111.6	I122 T127 F242 V243 Y249 I250	I122-A246 HydrophobicContact CD1-CB 4.22Å; T127-A246 HydrophobicContact CG2-CB 3.91Å; F242-A246 HydrophobicContact CE1-CB 4.47Å; F242-A246 WeakPolarHBondContact O-CB 3.31Å; F242-A246 PolarHBondContact O-N 2.95Å; V243-A246 PolarHBondContact O-N 3.35Å; A246-Y249 PolarHBondContact O-N 3.37Å; A246-I250 VanDerWaalsContact O-CG1 3.25Å; A246-I250 WeakPolarHBondContact O-CG1 2.99Å; A246-I250 PolarHBondContact O-N 3.18Å
247	L	86.4	Confident	85.4	Confident	65 Å²	65	51 Å²	51	34%	0.34	25%	0.247	S	C	.	.	H	α-helix	trans	-66	-38.8	174.3	-69.9	174.1	0	0	0	111.8	V243 Q244 I250 M251 Y258	V243-L247 HydrophobicContact CG1-CD1 4.13Å; V243-L247 WeakPolarHBondContact O-CG 3.49Å; V243-L247 PolarHBondContact O-N 2.81Å; Q244-L247 PolarHBondContact O-N 3.04Å; L247-I250 PolarHBondContact O-N 3.3Å; L247-M251 VanDerWaalsContact O-CB 3.25Å; L247-M251 WeakPolarHBondContact O-CB 3.39Å; L247-M251 WeakPolarHBondContact O-CG 3.2Å; L247-M251 PolarHBondContact O-N 2.95Å; L247-Y258 HydrophobicContact CB-CD1 3.81Å; L247-Y258 HydrophobicContact CB-CE1 4.47Å; L247-Y258 HydrophobicContact CB-CG 4.19Å; L247-Y258 HydrophobicContact CD1-CD1 4.08Å; L247-Y258 HydrophobicContact CD1-CE1 4.25Å; L247-Y258 HydrophobicContact CG-CD1 4.49Å
248	S	86.4	Confident	85.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-41	174.8	-58.5	0	0	0	0	111.9	Q244 S245 C252 N253 G254 G256 Y258	Q244-S248 WeakPolarHBondContact O-CB 3.45Å; Q244-S248 PolarHBondContact O-N 2.91Å; Q244-S248 PolarHBondContact O-OG 3.16Å; S245-S248 PolarHBondContact O-N 2.99Å; S248-C252 CarbonylContact O-C 3.54Å; S248-C252 VanDerWaalsContact O-CA 3.28Å; S248-C252 WeakPolarHBondContact O-CA 3.48Å; S248-C252 WeakPolarHBondContact O-CB 3.32Å; S248-C252 PolarHBondContact O-N 3.17Å; S248-N253 PolarHBondContact O-N 3.32Å; S248-G254 PolarHBondContact O-N 3.3Å; S248-G256 WeakPolarHBondContact CB-O 3.3Å; S248-Y258 PolarHBondContact OG-N 3.38Å
249	Y	85.4	Confident	85	Confident	88 Å²	88	49.3 Å²	49.3	35%	0.345	25%	0.245	S	C	.	.	H	α-helix	trans	-63.5	-44.6	174	-179.5	-109.1	0	0	0	112.6	I118 I122 K123 S245 A246 N253	I118-Y249 HydrophobicContact CG2-CD2 3.67Å; I118-Y249 HydrophobicContact CG2-CE2 4.27Å; I118-Y249 HydrophobicContact CG2-CG 4.46Å; I122-Y249 HydrophobicContact CG2-CD1 3.54Å; I122-Y249 HydrophobicContact CG2-CD2 4.48Å; I122-Y249 HydrophobicContact CG2-CE1 3.97Å; I122-Y249 HydrophobicContact CG2-CG 3.83Å; K123-Y249 HydrophobicContact CG-CE2 4.03Å; S245-Y249 WeakPolarHBondContact O-CB 3.37Å; S245-Y249 PolarHBondContact O-N 3.15Å; A246-Y249 PolarHBondContact O-N 3.37Å; Y249-N253 CarbonylContact O-C 3.52Å; Y249-N253 VanDerWaalsContact O-CA 3.29Å; Y249-N253 WeakPolarHBondContact O-CA 3.46Å; Y249-N253 PolarHBondContact O-N 3.39Å
250	I	78.6	Confident	84.5	Confident	61 Å²	61	49.7 Å²	49.7	31%	0.313	25%	0.254	S	S	.	.	H	α-helix	trans	-76	-46.1	-176.3	-65.6	166.2	0	0	0	111.8	T127 A246 L247	T127-I250 HydrophobicContact CG2-CD1 4.43Å; A246-I250 VanDerWaalsContact O-CG1 3.25Å; A246-I250 WeakPolarHBondContact O-CG1 2.99Å; A246-I250 PolarHBondContact O-N 3.18Å; L247-I250 PolarHBondContact O-N 3.3Å
251	M	75.4	Confident	84.1	Confident	54 Å²	54	48.2 Å²	48.2	27%	0.266	25%	0.247	S	C	.	.	H	α-helix	trans	-91.4	-26	-171.1	-62.9	-65.6	-179.9	0	0	113.3	R45 L247 Y258 C267	R45-M251 WeakPolarHBondContact CD-O 3.27Å; R45-M251 PolarHBondContact NH1-O 2.89Å; L247-M251 VanDerWaalsContact O-CB 3.25Å; L247-M251 WeakPolarHBondContact O-CB 3.39Å; L247-M251 WeakPolarHBondContact O-CG 3.2Å; L247-M251 PolarHBondContact O-N 2.95Å; M251-Y258 HydrophobicContact CB-CD2 3.55Å; M251-Y258 HydrophobicContact CB-CE2 3.72Å; M251-Y258 HydrophobicContact CB-CG 4.34Å; M251-Y258 HydrophobicContact CG-CD2 4Å; M251-Y258 HydrophobicContact CG-CE2 3.78Å; M251-C267 VanDerWaalsContact C-SG 3.57Å; M251-C267 PolarHBondContact O-SG 3.49Å
252	C	78.3	Confident	83.1	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	-120.7	15.7	-175.5	-41.4	0	0	0	0	112.8	S248 G254 E255 C267	S248-C252 CarbonylContact O-C 3.54Å; S248-C252 VanDerWaalsContact O-CA 3.28Å; S248-C252 WeakPolarHBondContact O-CA 3.48Å; S248-C252 WeakPolarHBondContact O-CB 3.32Å; S248-C252 PolarHBondContact O-N 3.17Å; C252-G254 PolarHBondContact O-N 3.12Å; C252-E255 PolarHBondContact O-N 3Å; C252-C267 WeakPolarHBondContact CA-SG 3.47Å; C252-C267 HydrophobicContact CB-CB 3.72Å; C252-C267 WeakPolarHBondContact CB-SG 3.27Å; C252-C267 VanDerWaalsContact SG-CA 3.55Å; C252-C267 WeakPolarHBondContact SG-CB 3.39Å; C252-C267 CovalentContact SG-SG 2.03Å; C252-C267 PolarHBondContact SG-SG 3.47Å
253	N	76.4	Confident	82.2	Confident	86 Å²	86	60.2 Å²	60.2	46%	0.46	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	15.6	-176.3	-80	-3.7	0	0	0	115.4	S248 Y249 E255	S248-N253 PolarHBondContact O-N 3.32Å; Y249-N253 CarbonylContact O-C 3.52Å; Y249-N253 VanDerWaalsContact O-CA 3.29Å; Y249-N253 WeakPolarHBondContact O-CA 3.46Å; Y249-N253 PolarHBondContact O-N 3.39Å; N253-E255 PolarHBondContact O-N 3.29Å
254	G	77.1	Confident	81	Confident	8 Å²	8	64.5 Å²	64.5	8%	0.082	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	13.9	-173.5	0	0	0	0	0	114.6	Q115 S248 C252	Q115-G254 PolarHBondContact OE1-O 3.18Å; Q115-G254 VanDerWaalsContact OE1-O 3.11Å; S248-G254 PolarHBondContact O-N 3.3Å; C252-G254 PolarHBondContact O-N 3.12Å
255	E	82.9	Confident	80.5	Confident	73 Å²	73	64.4 Å²	64.4	34%	0.341	34%	0.335	S	S	.	.	S	Bend	trans	-102.1	6.1	176.1	-67.6	176.9	175.7	0	0	112.3	C252 N253 A270 Y273 C276	C252-E255 PolarHBondContact O-N 3Å; N253-E255 PolarHBondContact O-N 3.29Å; E255-A270 WeakPolarHBondContact O-CB 3.43Å; E255-A270 PolarHBondContact O-N 3.44Å; E255-A270 VanDerWaalsContact O-N 3.13Å; E255-Y273 HydrophobicContact CB-CD2 4.4Å; E255-Y273 HydrophobicContact CB-CG 4.12Å; E255-Y273 HydrophobicContact CG-CD1 4.27Å; E255-Y273 HydrophobicContact CG-CD2 4.38Å; E255-Y273 HydrophobicContact CG-CG 4.12Å; E255-C276 HydrophobicContact CB-CB 3.74Å
256	G	83.5	Confident	79.9	Confident	11 Å²	11	69.4 Å²	69.4	11%	0.113	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.3	172.1	179.4	0	0	0	0	0	112.5	S248 Q268	S248-G256 WeakPolarHBondContact CB-O 3.3Å; G256-Q268 CarbonylContact C-O 3.59Å; G256-Q268 WeakPolarHBondContact CA-O 3.29Å
257	E	86	Confident	79.5	Confident	74 Å²	74	69.5 Å²	69.5	35%	0.346	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.5	179.3	-61.2	-156.8	145.1	0	0	111.8	T114 K241 V259 C267 Q268	T114-E257 WeakPolarHBondContact CB-OE1 3.41Å; T114-E257 PolarHBondContact OG1-OE1 3.29Å; K241-E257 IonicContact NZ-OE1 2.79Å; E257-V259 HydrophobicContact CB-CG2 4.38Å; E257-C267 CarbonylContact O-C 3.59Å; E257-C267 WeakPolarHBondContact O-CA 3.48Å; E257-Q268 PolarHBondContact N-O 3.33Å; E257-Q268 PolarHBondContact O-N 2.98Å
258	Y	85.1	Confident	79.3	Confident	51 Å²	51	72.5 Å²	72.5	20%	0.2	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	114.8	174.9	-170	-104.2	0	0	0	110.4	L247 S248 M251 C260 C265	L247-Y258 HydrophobicContact CB-CD1 3.81Å; L247-Y258 HydrophobicContact CB-CE1 4.47Å; L247-Y258 HydrophobicContact CB-CG 4.19Å; L247-Y258 HydrophobicContact CD1-CD1 4.08Å; L247-Y258 HydrophobicContact CD1-CE1 4.25Å; L247-Y258 HydrophobicContact CG-CD1 4.49Å; S248-Y258 PolarHBondContact OG-N 3.38Å; M251-Y258 HydrophobicContact CB-CD2 3.55Å; M251-Y258 HydrophobicContact CB-CE2 3.72Å; M251-Y258 HydrophobicContact CB-CG 4.34Å; M251-Y258 HydrophobicContact CG-CD2 4Å; M251-Y258 HydrophobicContact CG-CE2 3.78Å; Y258-C260 VanDerWaalsContact CE1-SG 3.58Å; Y258-C265 HydrophobicContact CE1-CB 3.92Å; Y258-C265 HydrophobicContact CE2-CB 3.9Å; Y258-C265 WeakPolarHBondContact OH-CB 3.3Å
259	V	84.2	Confident	79.2	Confident	52 Å²	52	74 Å²	74	32%	0.315	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.6	-175.5	-174.5	0	0	0	0	110.1	E257 C265 I266	E257-V259 HydrophobicContact CB-CG2 4.38Å; V259-C265 CarbonylContact O-C 3.46Å; V259-C265 WeakPolarHBondContact O-CA 3.48Å; V259-I266 PolarHBondContact N-O 2.71Å; V259-I266 PolarHBondContact O-N 2.87Å
260	C	80.9	Confident	78.9	Confident	73 Å²	73	71.9 Å²	71.9	49%	0.493	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	122.4	176.1	-61	0	0	0	0	110.6	Y258 Q264 C265	Y258-C260 VanDerWaalsContact CE1-SG 3.58Å; C260-Q264 WeakPolarHBondContact CA-O 3.32Å; C260-C265 HydrophobicContact CB-CB 4.05Å; C260-C265 WeakPolarHBondContact CB-SG 3.49Å; C260-C265 WeakPolarHBondContact SG-CB 3.24Å; C260-C265 CovalentContact SG-SG 2.04Å; C260-C265 PolarHBondContact SG-SG 3.18Å
261	H	80.6	Confident	79	Confident	135 Å²	135	76.7 Å²	76.7	63%	0.625	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.5	173.5	-167	70	0	0	0	109.6	N263 Q264	H261-N263 PolarHBondContact O-N 3.01Å; H261-Q264 PolarHBondContact N-O 3.39Å; H261-Q264 PolarHBondContact O-N 3.05Å; H261-Q264 VanDerWaalsContact O-O 3.06Å
262	N	69	Low	79.1	Confident	133 Å²	133	80.9 Å²	80.9	71%	0.711	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	51.7	177.9	-58.9	-24.7	0	0	0	114.8	Q264	N262-Q264 PolarHBondContact O-N 3.29Å; N262-Q264 VanDerWaalsContact O-N 3.12Å
263	N	72.6	Confident	79	Confident	173 Å²	173	86.8 Å²	86.8	93%	0.925	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	11.8	-175.5	-77.5	4.6	0	0	0	116	H261	H261-N263 PolarHBondContact O-N 3.01Å
264	Q	65.7	Low	78.7	Confident	149 Å²	149	86.6 Å²	86.6	70%	0.696	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.4	172	-65.8	-174.9	-7.9	0	0	109.6	C260 H261 N262	C260-Q264 WeakPolarHBondContact CA-O 3.32Å; H261-Q264 PolarHBondContact N-O 3.39Å; H261-Q264 PolarHBondContact O-N 3.05Å; H261-Q264 VanDerWaalsContact O-O 3.06Å; N262-Q264 PolarHBondContact O-N 3.29Å; N262-Q264 VanDerWaalsContact O-N 3.12Å
265	C	78.6	Confident	78.4	Confident	57 Å²	57	89.8 Å²	89.8	39%	0.385	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	129.6	176.1	-56.3	0	0	0	0	110.6	Y258 V259 C260	Y258-C265 HydrophobicContact CE1-CB 3.92Å; Y258-C265 HydrophobicContact CE2-CB 3.9Å; Y258-C265 WeakPolarHBondContact OH-CB 3.3Å; V259-C265 CarbonylContact O-C 3.46Å; V259-C265 WeakPolarHBondContact O-CA 3.48Å; C260-C265 HydrophobicContact CB-CB 4.05Å; C260-C265 WeakPolarHBondContact CB-SG 3.49Å; C260-C265 WeakPolarHBondContact SG-CB 3.24Å; C260-C265 CovalentContact SG-SG 2.04Å; C260-C265 PolarHBondContact SG-SG 3.18Å
266	I	76.1	Confident	77.9	Confident	104 Å²	104	86.5 Å²	86.5	53%	0.533	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.5	-179.9	61.1	169.9	0	0	0	110.3	V259	V259-I266 PolarHBondContact N-O 2.71Å; V259-I266 PolarHBondContact O-N 2.87Å
267	C	80.1	Confident	77.3	Confident	12 Å²	12	87 Å²	87	8%	0.081	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	116	167.1	-72	0	0	0	0	108.8	M251 C252 E257 C269 N277	M251-C267 VanDerWaalsContact C-SG 3.57Å; M251-C267 PolarHBondContact O-SG 3.49Å; C252-C267 WeakPolarHBondContact CA-SG 3.47Å; C252-C267 HydrophobicContact CB-CB 3.72Å; C252-C267 WeakPolarHBondContact CB-SG 3.27Å; C252-C267 VanDerWaalsContact SG-CA 3.55Å; C252-C267 WeakPolarHBondContact SG-CB 3.39Å; C252-C267 CovalentContact SG-SG 2.03Å; C252-C267 PolarHBondContact SG-SG 3.47Å; E257-C267 CarbonylContact O-C 3.59Å; E257-C267 WeakPolarHBondContact O-CA 3.48Å; C267-C269 PolarHBondContact O-N 3.49Å; C267-N277 HydrophobicContact CB-CB 4.05Å
268	Q	83.4	Confident	76.7	Confident	128 Å²	128	84.1 Å²	84.1	60%	0.598	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	104.7	168.1	-175.6	172.7	0.5	0	0	108.1	G256 E257	G256-Q268 CarbonylContact C-O 3.59Å; G256-Q268 WeakPolarHBondContact CA-O 3.29Å; E257-Q268 PolarHBondContact N-O 3.33Å; E257-Q268 PolarHBondContact O-N 2.98Å
269	C	82.6	Confident	76.1	Confident	33 Å²	33	82.4 Å²	82.4	22%	0.223	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	146.2	-178	-63.6	0	0	0	0	112.6	C267 Y273 C276 N277	C267-C269 PolarHBondContact O-N 3.49Å; C269-Y273 VanDerWaalsContact CB-O 3.24Å; C269-Y273 WeakPolarHBondContact CB-O 3.3Å; C269-C276 WeakPolarHBondContact CA-SG 3.32Å; C269-C276 HydrophobicContact CB-CB 3.83Å; C269-C276 WeakPolarHBondContact CB-SG 3.25Å; C269-C276 VanDerWaalsContact SG-CA 3.54Å; C269-C276 WeakPolarHBondContact SG-CB 3.42Å; C269-C276 PolarHBondContact SG-N 3.07Å; C269-C276 VanDerWaalsContact SG-N 3.35Å; C269-C276 CovalentContact SG-SG 2.03Å; C269-C276 PolarHBondContact SG-SG 3.43Å; C269-N277 PolarHBondContact SG-N 2.93Å
270	A	80.8	Confident	75.7	Confident	43 Å²	43	83.8 Å²	83.8	36%	0.355	45%	0.446	S	S	.	.			trans	-67.1	154.3	168	0	0	0	0	0	110.8	E255 D272 Y273	E255-A270 WeakPolarHBondContact O-CB 3.43Å; E255-A270 PolarHBondContact O-N 3.44Å; E255-A270 VanDerWaalsContact O-N 3.13Å; A270-D272 PolarHBondContact O-N 2.94Å; A270-Y273 CarbonylContact O-C 3.52Å; A270-Y273 PolarHBondContact O-N 3.35Å
271	D	79.5	Confident	75.4	Confident	162 Å²	162	84.1 Å²	84.1	87%	0.866	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-30.9	-178.5	-64.7	-37.9	0	0	0	112.7	Y273	D271-Y273 VanDerWaalsContact C-N 3.27Å; D271-Y273 PolarHBondContact O-N 2.97Å
272	D	78.8	Confident	75.2	Confident	141 Å²	141	79.5 Å²	79.5	75%	0.754	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-21.2	176	-62.3	-34.3	0	0	0	112.9	A270	A270-D272 PolarHBondContact O-N 2.94Å
273	Y	74.7	Confident	75.7	Confident	124 Å²	124	73.3 Å²	73.3	49%	0.486	39%	0.393	S	S	.	.			trans	-133.9	60.4	-174.5	-62.2	-83.3	0	0	0	111.8	E255 C269 A270 D271 Q275 C276	E255-Y273 HydrophobicContact CB-CD2 4.4Å; E255-Y273 HydrophobicContact CB-CG 4.12Å; E255-Y273 HydrophobicContact CG-CD1 4.27Å; E255-Y273 HydrophobicContact CG-CD2 4.38Å; E255-Y273 HydrophobicContact CG-CG 4.12Å; C269-Y273 VanDerWaalsContact CB-O 3.24Å; C269-Y273 WeakPolarHBondContact CB-O 3.3Å; A270-Y273 CarbonylContact O-C 3.52Å; A270-Y273 PolarHBondContact O-N 3.35Å; D271-Y273 VanDerWaalsContact C-N 3.27Å; D271-Y273 PolarHBondContact O-N 2.97Å; Y273-Q275 PolarHBondContact O-N 3.45Å; Y273-C276 VanDerWaalsContact O-CB 3.31Å; Y273-C276 WeakPolarHBondContact O-CB 3.3Å; Y273-C276 PolarHBondContact O-N 3.26Å
274	P	71.2	Confident	76.2	Confident	83 Å²	83	70.1 Å²	70.1	54%	0.539	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.8	-172.6	26.9	-35.8	0	0	0	113.9
275	Q	69.4	Low	77	Confident	74 Å²	74	66.5 Å²	66.5	35%	0.346	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	15.3	176.8	-61.1	-69	-15.8	0	0	112.9	Y273 N277 C278 I280	Y273-Q275 PolarHBondContact O-N 3.45Å; Q275-N277 PolarHBondContact O-N 3.43Å; Q275-C278 HydrophobicContact CB-CB 4.14Å; Q275-C278 WeakPolarHBondContact O-CB 3.42Å; Q275-C278 PolarHBondContact O-N 3.1Å; Q275-I280 HydrophobicContact CB-CD1 4.43Å
276	C	73.1	Confident	77.3	Confident	5 Å²	5	65.7 Å²	65.7	3%	0.034	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	-25	179.5	85.8	0	0	0	0	112.8	R45 E255 C269 Y273	R45-C276 PolarHBondContact NH2-O 3.48Å; E255-C276 HydrophobicContact CB-CB 3.74Å; C269-C276 WeakPolarHBondContact CA-SG 3.32Å; C269-C276 HydrophobicContact CB-CB 3.83Å; C269-C276 WeakPolarHBondContact CB-SG 3.25Å; C269-C276 VanDerWaalsContact SG-CA 3.54Å; C269-C276 WeakPolarHBondContact SG-CB 3.42Å; C269-C276 PolarHBondContact SG-N 3.07Å; C269-C276 VanDerWaalsContact SG-N 3.35Å; C269-C276 CovalentContact SG-SG 2.03Å; C269-C276 PolarHBondContact SG-SG 3.43Å; Y273-C276 VanDerWaalsContact O-CB 3.31Å; Y273-C276 WeakPolarHBondContact O-CB 3.3Å; Y273-C276 PolarHBondContact O-N 3.26Å
277	N	70.8	Confident	77.9	Confident	21 Å²	21	63.4 Å²	63.4	11%	0.112	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	1.2	179.3	-156.8	23.9	0	0	0	114.3	R45 C267 C269 Q275	R45-N277 PolarHBondContact NH1-OD1 3.06Å; R45-N277 PolarHBondContact NH2-O 3.08Å; C267-N277 HydrophobicContact CB-CB 4.05Å; C269-N277 PolarHBondContact SG-N 2.93Å; Q275-N277 PolarHBondContact O-N 3.43Å
278	C	72.9	Confident	78.2	Confident	14 Å²	14	67.4 Å²	67.4	10%	0.095	36%	0.356	C	S	.	.			trans	-100.5	121.8	-172.7	-160.7	0	0	0	0	114.3	Q275 I280 C370	Q275-C278 HydrophobicContact CB-CB 4.14Å; Q275-C278 WeakPolarHBondContact O-CB 3.42Å; Q275-C278 PolarHBondContact O-N 3.1Å; C278-I280 VanDerWaalsContact C-N 3.3Å; C278-I280 HydrophobicContact CB-CG1 4.13Å; C278-I280 PolarHBondContact O-N 2.93Å; C278-C370 WeakPolarHBondContact CA-SG 2.99Å; C278-C370 HydrophobicContact CB-CB 3.85Å; C278-C370 WeakPolarHBondContact CB-SG 3.49Å; C278-C370 WeakPolarHBondContact SG-CB 3Å; C278-C370 CovalentContact SG-SG 2.04Å; C278-C370 PolarHBondContact SG-SG 2.91Å
279	P	73.3	Confident	78.5	Confident	14 Å²	14	64 Å²	64	9%	0.091	34%	0.344	C	S	.	.			trans	-81.8	74.5	172.9	34.8	-34.5	0	0	0	110.5	D44 T281 D282 I283 L366	D44-P279 HydrophobicContact CB-CB 4.45Å; P279-T281 VanDerWaalsContact C-N 3.31Å; P279-T281 PolarHBondContact O-N 2.93Å; P279-D282 HydrophobicContact CB-CB 4.21Å; P279-D282 PolarHBondContact O-N 3.47Å; P279-I283 HydrophobicContact CG-CD1 4.47Å; P279-I283 VanDerWaalsContact O-CG1 3.31Å; P279-I283 WeakPolarHBondContact O-CG1 3.35Å; P279-I283 PolarHBondContact O-N 3.25Å; P279-L366 HydrophobicContact CG-CB 4.28Å; P279-L366 HydrophobicContact CG-CD2 4.01Å
280	I	75.3	Confident	78.8	Confident	82 Å²	82	62.7 Å²	62.7	42%	0.421	33%	0.334	S	S	.	.	H	α-helix	trans	-60.7	-40	-173.7	-64.5	167.1	0	0	0	111.6	Q275 C278 I283 Q284	Q275-I280 HydrophobicContact CB-CD1 4.43Å; C278-I280 VanDerWaalsContact C-N 3.3Å; C278-I280 HydrophobicContact CB-CG1 4.13Å; C278-I280 PolarHBondContact O-N 2.93Å; I280-I283 PolarHBondContact O-N 3.37Å; I280-Q284 HydrophobicContact CG2-CG 4.37Å; I280-Q284 WeakPolarHBondContact O-CB 3.38Å; I280-Q284 VanDerWaalsContact O-CG 3.3Å; I280-Q284 WeakPolarHBondContact O-CG 3.47Å; I280-Q284 PolarHBondContact O-N 3.37Å
281	T	75.4	Confident	79.2	Confident	80 Å²	80	65.7 Å²	65.7	49%	0.491	34%	0.344	S	S	.	.	H	α-helix	trans	-62.2	-48.1	178.7	33	0	0	0	0	112.2	D44 P279 Q284 I285	D44-T281 PolarHBondContact OD2-OG1 3.5Å; P279-T281 VanDerWaalsContact C-N 3.31Å; P279-T281 PolarHBondContact O-N 2.93Å; T281-Q284 PolarHBondContact O-N 3.46Å; T281-I285 WeakPolarHBondContact O-CD1 3.47Å; T281-I285 WeakPolarHBondContact O-CG1 3.42Å; T281-I285 PolarHBondContact O-N 3.08Å
282	D	75.4	Confident	79.7	Confident	37 Å²	37	62.3 Å²	62.3	20%	0.198	33%	0.329	C	S	.	.	H	α-helix	trans	-64.4	-40.9	176.6	-78.5	-28.9	0	0	0	111.9	D44 P279 I285 M286 L366	D44-D282 VanDerWaalsContact CG-CG 3.46Å; D44-D282 VanDerWaalsContact OD2-CG 3.27Å; P279-D282 HydrophobicContact CB-CB 4.21Å; P279-D282 PolarHBondContact O-N 3.47Å; D282-I285 PolarHBondContact O-N 2.88Å; D282-M286 WeakPolarHBondContact O-CG 3.35Å; D282-M286 PolarHBondContact O-N 2.91Å; D282-L366 HydrophobicContact CB-CD1 4Å
283	I	81.1	Confident	80.2	Confident	4 Å²	4	57 Å²	57	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-50.6	176.1	-73.4	170	0	0	0	110.3	P279 I280 I285 M286 E287 L363 L366 H372	P279-I283 HydrophobicContact CG-CD1 4.47Å; P279-I283 VanDerWaalsContact O-CG1 3.31Å; P279-I283 WeakPolarHBondContact O-CG1 3.35Å; P279-I283 PolarHBondContact O-N 3.25Å; I280-I283 PolarHBondContact O-N 3.37Å; I283-I285 VanDerWaalsContact C-N 3.32Å; I283-I285 PolarHBondContact O-N 3.26Å; I283-M286 PolarHBondContact O-N 3.42Å; I283-M286 VanDerWaalsContact O-N 3.17Å; I283-E287 WeakPolarHBondContact O-CG 3.4Å; I283-E287 PolarHBondContact O-N 2.81Å; I283-L363 HydrophobicContact CB-CD1 4.33Å; I283-L363 HydrophobicContact CG1-CD1 4.38Å; I283-L363 HydrophobicContact CG2-CD1 3.87Å; I283-L366 HydrophobicContact CG1-CB 4.1Å; I283-H372 VanDerWaalsContact CG2-CD2 3.49Å; I283-H372 WeakPolarHBondContact CG2-CD2 3.18Å
284	Q	82.8	Confident	81	Confident	105 Å²	105	53.5 Å²	53.5	49%	0.491	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-39.1	177.9	-74.1	175.6	-10	0	0	112.3	I280 T281 E287 N288	I280-Q284 HydrophobicContact CG2-CG 4.37Å; I280-Q284 WeakPolarHBondContact O-CB 3.38Å; I280-Q284 VanDerWaalsContact O-CG 3.3Å; I280-Q284 WeakPolarHBondContact O-CG 3.47Å; I280-Q284 PolarHBondContact O-N 3.37Å; T281-Q284 PolarHBondContact O-N 3.46Å; Q284-E287 PolarHBondContact O-N 3.45Å; Q284-N288 WeakPolarHBondContact O-CB 3.29Å; Q284-N288 VanDerWaalsContact O-CG 3.29Å; Q284-N288 PolarHBondContact O-N 3.44Å; Q284-N288 PolarHBondContact O-ND2 2.96Å
285	I	82.5	Confident	81.9	Confident	73 Å²	73	56 Å²	56	37%	0.374	30%	0.298	S	S	.	.	H	α-helix	trans	-64	-44.3	176	-70.7	164.6	0	0	0	110.6	T281 D282 I283 T289	T281-I285 WeakPolarHBondContact O-CD1 3.47Å; T281-I285 WeakPolarHBondContact O-CG1 3.42Å; T281-I285 PolarHBondContact O-N 3.08Å; D282-I285 PolarHBondContact O-N 2.88Å; I283-I285 VanDerWaalsContact C-N 3.32Å; I283-I285 PolarHBondContact O-N 3.26Å; I285-T289 WeakPolarHBondContact O-CB 3.37Å; I285-T289 PolarHBondContact O-N 3.04Å; I285-T289 PolarHBondContact O-OG1 2.87Å
286	M	85.2	Confident	82.9	Confident	40 Å²	40	54.8 Å²	54.8	20%	0.197	30%	0.298	C	S	.	.	H	α-helix	trans	-65.7	-41.4	178.7	-66.9	-68.9	172.7	0	0	111.4	D282 I283 T289 L290 T359 K362 L363 L366	D282-M286 WeakPolarHBondContact O-CG 3.35Å; D282-M286 PolarHBondContact O-N 2.91Å; I283-M286 PolarHBondContact O-N 3.42Å; I283-M286 VanDerWaalsContact O-N 3.17Å; M286-T289 PolarHBondContact O-N 3.28Å; M286-L290 WeakPolarHBondContact O-CG 3.32Å; M286-L290 PolarHBondContact O-N 3.28Å; M286-T359 HydrophobicContact SD-CG2 3.91Å; M286-K362 HydrophobicContact CE-CD 4.29Å; M286-K362 HydrophobicContact SD-CB 4.44Å; M286-L363 HydrophobicContact CB-CB 4.24Å; M286-L363 HydrophobicContact CB-CD1 4.09Å; M286-L366 HydrophobicContact CG-CD1 4.14Å
287	E	87.1	Confident	83.8	Confident	57 Å²	57	55.2 Å²	55.2	27%	0.266	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-48.9	175.4	-73.8	175.6	166.2	0	0	111.9	I283 Q284 T289 L290 L291 L363 H372	I283-E287 WeakPolarHBondContact O-CG 3.4Å; I283-E287 PolarHBondContact O-N 2.81Å; Q284-E287 PolarHBondContact O-N 3.45Å; E287-T289 VanDerWaalsContact C-N 3.28Å; E287-T289 PolarHBondContact O-N 3.48Å; E287-L290 PolarHBondContact O-N 3.48Å; E287-L290 VanDerWaalsContact O-N 3.15Å; E287-L291 WeakPolarHBondContact O-CG 3.29Å; E287-L291 PolarHBondContact O-N 3.28Å; E287-L363 HydrophobicContact CG-CD1 4Å; E287-L363 HydrophobicContact CG-CD2 3.99Å; E287-H372 IonicContact OE1-CD2 3.41Å; E287-H372 IonicContact OE1-CE1 3.45Å; E287-H372 IonicContact OE1-NE2 3.48Å; E287-H372 PolarHBondContact OE1-NE2 2.9Å
288	N	87.1	Confident	84.7	Confident	96 Å²	96	57 Å²	57	51%	0.513	32%	0.317	S	S	.	.	H	α-helix	trans	-61.1	-38.3	175.7	-74.8	-27.3	0	0	0	111.9	Q284 L291 V292	Q284-N288 WeakPolarHBondContact O-CB 3.29Å; Q284-N288 VanDerWaalsContact O-CG 3.29Å; Q284-N288 PolarHBondContact O-N 3.44Å; Q284-N288 PolarHBondContact O-ND2 2.96Å; N288-L291 PolarHBondContact O-N 2.91Å; N288-V292 WeakPolarHBondContact O-CG2 3.14Å; N288-V292 PolarHBondContact O-N 2.88Å
289	T	88.9	Confident	85.6	Confident	57 Å²	57	58.3 Å²	58.3	35%	0.35	33%	0.328	S	S	.	.	H	α-helix	trans	-63.4	-43.7	175.7	-56.9	0	0	0	0	110.9	I285 M286 E287 L291 V292 M293 T359	I285-T289 WeakPolarHBondContact O-CB 3.37Å; I285-T289 PolarHBondContact O-N 3.04Å; I285-T289 PolarHBondContact O-OG1 2.87Å; M286-T289 PolarHBondContact O-N 3.28Å; E287-T289 VanDerWaalsContact C-N 3.28Å; E287-T289 PolarHBondContact O-N 3.48Å; T289-L291 VanDerWaalsContact C-N 3.35Å; T289-L291 PolarHBondContact O-N 2.8Å; T289-V292 PolarHBondContact O-N 2.85Å; T289-M293 HydrophobicContact CG2-CG 4.49Å; T289-M293 HydrophobicContact CG2-SD 4.02Å; T289-M293 WeakPolarHBondContact O-CG 3.1Å; T289-M293 PolarHBondContact O-N 2.87Å; T289-T359 HydrophobicContact CG2-CG2 4.47Å
290	L	89.9	Confident	86.5	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	33%	0.331	C	S	.	.	H	α-helix	trans	-63.7	-38	176.5	-73.6	171.9	0	0	0	112.4	M286 E287 M293 S294 I356 T359 L363	M286-L290 WeakPolarHBondContact O-CG 3.32Å; M286-L290 PolarHBondContact O-N 3.28Å; E287-L290 PolarHBondContact O-N 3.48Å; E287-L290 VanDerWaalsContact O-N 3.15Å; L290-M293 PolarHBondContact O-N 3.05Å; L290-S294 PolarHBondContact O-N 3.2Å; L290-I356 HydrophobicContact CD2-CG2 3.94Å; L290-T359 HydrophobicContact CD2-CG2 3.85Å; L290-T359 HydrophobicContact CG-CG2 3.87Å; L290-L363 HydrophobicContact CD1-CD2 3.71Å
291	L	88.7	Confident	87.3	Confident	106 Å²	106	55.3 Å²	55.3	56%	0.555	31%	0.313	S	S	*	.	H	α-helix	trans	-60.6	-51.5	174	-71.4	173	0	0	0	111.3	E287 N288 T289 M293 S294 E295	E287-L291 WeakPolarHBondContact O-CG 3.29Å; E287-L291 PolarHBondContact O-N 3.28Å; N288-L291 PolarHBondContact O-N 2.91Å; T289-L291 VanDerWaalsContact C-N 3.35Å; T289-L291 PolarHBondContact O-N 2.8Å; L291-M293 VanDerWaalsContact C-N 3.27Å; L291-M293 PolarHBondContact O-N 3.38Å; L291-S294 WeakPolarHBondContact O-CB 3.47Å; L291-S294 PolarHBondContact O-N 3.02Å; L291-E295 PolarHBondContact O-N 3.43Å
292	V	89.9	Confident	88	Confident	92 Å²	92	58 Å²	58	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-59.8	-38.5	177.7	172.5	0	0	0	0	111.6	N288 T289 E295 S296	N288-V292 WeakPolarHBondContact O-CG2 3.14Å; N288-V292 PolarHBondContact O-N 2.88Å; T289-V292 PolarHBondContact O-N 2.85Å; V292-E295 PolarHBondContact O-N 2.92Å; V292-S296 WeakPolarHBondContact O-CB 2.99Å; V292-S296 PolarHBondContact O-N 3.42Å
293	M	90.4	Very high	88.8	Confident	30 Å²	30	60.6 Å²	60.6	15%	0.148	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-36.9	176.3	-69	175.3	85.9	0	0	112.3	T289 L290 L291 S296 W297 K355 I356	T289-M293 HydrophobicContact CG2-CG 4.49Å; T289-M293 HydrophobicContact CG2-SD 4.02Å; T289-M293 WeakPolarHBondContact O-CG 3.1Å; T289-M293 PolarHBondContact O-N 2.87Å; L290-M293 PolarHBondContact O-N 3.05Å; L291-M293 VanDerWaalsContact C-N 3.27Å; L291-M293 PolarHBondContact O-N 3.38Å; M293-S296 PolarHBondContact O-N 2.74Å; M293-W297 WeakPolarHBondContact O-CB 3.31Å; M293-W297 PolarHBondContact O-N 3.25Å; M293-K355 HydrophobicContact CE-CB 3.32Å; M293-K355 HydrophobicContact CE-CD 4.47Å; M293-I356 HydrophobicContact CB-CD1 4.22Å; M293-I356 HydrophobicContact CB-CG1 3.92Å; M293-I356 HydrophobicContact CE-CB 4.49Å; M293-I356 HydrophobicContact CE-CG1 3.64Å; M293-I356 HydrophobicContact SD-CG1 4.19Å
294	S	89.7	Confident	89.5	Confident	50 Å²	50	60.6 Å²	60.6	35%	0.35	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.3	-174.5	0	0	0	0	112	L290 L291 W297 A298	L290-S294 PolarHBondContact O-N 3.2Å; L291-S294 WeakPolarHBondContact O-CB 3.47Å; L291-S294 PolarHBondContact O-N 3.02Å; S294-W297 WeakPolarHBondContact O-CB 3.47Å; S294-W297 PolarHBondContact O-N 2.91Å; S294-A298 PolarHBondContact O-N 2.82Å; S294-A298 VanDerWaalsContact O-N 3.1Å
295	E	90.3	Very high	89.9	Confident	136 Å²	136	57 Å²	57	64%	0.636	32%	0.315	S	S	*	.	H	α-helix	trans	-63.1	-43.6	173.4	-69.6	177	174.5	0	0	111.5	L291 V292 W297 A298 A299	L291-E295 PolarHBondContact O-N 3.43Å; V292-E295 PolarHBondContact O-N 2.92Å; E295-W297 VanDerWaalsContact C-N 3.3Å; E295-W297 PolarHBondContact O-N 3.09Å; E295-A298 PolarHBondContact O-N 3.3Å; E295-A299 WeakPolarHBondContact O-CB 3.34Å; E295-A299 PolarHBondContact O-N 3.15Å
296	S	90.6	Very high	90.3	Very high	47 Å²	47	57.2 Å²	57.2	33%	0.329	32%	0.317	S	S	.	.	H	α-helix	trans	-62.4	-35.7	175.8	-179.3	0	0	0	0	113.1	V292 M293 A299 S300 Q352	V292-S296 WeakPolarHBondContact O-CB 2.99Å; V292-S296 PolarHBondContact O-N 3.42Å; M293-S296 PolarHBondContact O-N 2.74Å; S296-A299 PolarHBondContact O-N 3.24Å; S296-S300 PolarHBondContact O-N 3.38Å; S296-S300 PolarHBondContact O-OG 3.29Å; S296-Q352 PolarHBondContact OG-NE2 3.37Å
297	W	91.6	Very high	90.8	Very high	14 Å²	14	55.8 Å²	55.8	5%	0.053	31%	0.311	C	S	.	.	H	α-helix	trans	-63.5	-47.5	174.7	-179.2	-79.9	0	0	0	111	M293 S294 E295 S300 Y301 L349 Q352 R353 I356 P379 E381	M293-W297 WeakPolarHBondContact O-CB 3.31Å; M293-W297 PolarHBondContact O-N 3.25Å; S294-W297 WeakPolarHBondContact O-CB 3.47Å; S294-W297 PolarHBondContact O-N 2.91Å; E295-W297 VanDerWaalsContact C-N 3.3Å; E295-W297 PolarHBondContact O-N 3.09Å; W297-S300 PolarHBondContact O-N 2.94Å; W297-Y301 AromaticContact CD1-CE2 3.87Å; W297-Y301 AromaticContact NE1-CD2 4Å; W297-Y301 AromaticContact NE1-CE2 3.29Å; W297-Y301 VanDerWaalsContact NE1-CE2 3.29Å; W297-Y301 PolarHBondContact O-N 3.1Å; W297-L349 HydrophobicContact CD2-CD2 3.64Å; W297-L349 HydrophobicContact CE3-CD2 3.67Å; W297-L349 HydrophobicContact CG-CD2 4.24Å; W297-L349 HydrophobicContact CH2-CB 3.85Å; W297-L349 HydrophobicContact CH2-CD2 4.01Å; W297-L349 HydrophobicContact CH2-CG 4.4Å; W297-L349 HydrophobicContact CZ2-CB 4.42Å; W297-L349 HydrophobicContact CZ2-CD1 4.5Å; W297-L349 HydrophobicContact CZ2-CD2 3.98Å; W297-L349 HydrophobicContact CZ3-CB 3.99Å; W297-L349 HydrophobicContact CZ3-CD2 3.87Å; W297-L349 WeakPolarHBondContact CZ3-O 3.09Å; W297-Q352 HydrophobicContact CE3-CB 3.98Å; W297-Q352 HydrophobicContact CZ3-CB 4.16Å; W297-R353 HydrophobicContact CH2-CB 4.25Å; W297-R353 HydrophobicContact CZ3-CB 3.97Å; W297-I356 HydrophobicContact CE3-CD1 4.28Å; W297-P379 HydrophobicContact CD2-CB 3.86Å; W297-P379 HydrophobicContact CD2-CG 4.4Å; W297-P379 HydrophobicContact CG-CB 3.91Å; W297-P379 HydrophobicContact CG-CG 4.37Å; W297-P379 HydrophobicContact CZ2-CB 4.38Å; W297-E381 HydrophobicContact CZ2-CB 4.33Å
298	A	90.5	Very high	91.1	Very high	60 Å²	60	59.1 Å²	59.1	50%	0.496	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-39.5	176.5	0	0	0	0	0	112.4	S294 E295 S300 Y301 K302	S294-A298 PolarHBondContact O-N 2.82Å; S294-A298 VanDerWaalsContact O-N 3.1Å; E295-A298 PolarHBondContact O-N 3.3Å; A298-S300 VanDerWaalsContact C-N 3.35Å; A298-S300 PolarHBondContact O-N 3.37Å; A298-Y301 PolarHBondContact O-N 3.35Å; A298-K302 PolarHBondContact O-N 3.46Å; A298-K302 VanDerWaalsContact O-N 3.17Å
299	A	91.6	Very high	91.5	Very high	41 Å²	41	57.7 Å²	57.7	34%	0.339	32%	0.321	S	S	.	.	H	α-helix	trans	-60.8	-42.6	175.5	0	0	0	0	0	111.8	E295 S296 Y301 K302 D303	E295-A299 WeakPolarHBondContact O-CB 3.34Å; E295-A299 PolarHBondContact O-N 3.15Å; S296-A299 PolarHBondContact O-N 3.24Å; A299-Y301 VanDerWaalsContact C-N 3.29Å; A299-Y301 PolarHBondContact O-N 3.28Å; A299-K302 CarbonylContact O-C 3.54Å; A299-K302 WeakPolarHBondContact O-CA 3.42Å; A299-K302 WeakPolarHBondContact O-CB 3.49Å; A299-K302 PolarHBondContact O-N 2.95Å; A299-D303 VanDerWaalsContact O-CG 3.25Å; A299-D303 PolarHBondContact O-N 3.48Å
300	S	91.8	Very high	91.7	Very high	21 Å²	21	55 Å²	55	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-59.8	-37.9	179.1	-64.6	0	0	0	0	112.7	S296 W297 A298 F304	S296-S300 PolarHBondContact O-N 3.38Å; S296-S300 PolarHBondContact O-OG 3.29Å; W297-S300 PolarHBondContact O-N 2.94Å; A298-S300 VanDerWaalsContact C-N 3.35Å; A298-S300 PolarHBondContact O-N 3.37Å; S300-F304 PolarHBondContact O-N 3.02Å; S300-F304 VanDerWaalsContact O-N 3.15Å
301	Y	91.9	Very high	91.9	Very high	12 Å²	12	59 Å²	59	5%	0.047	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-39	173.1	-77.2	-45.9	0	0	0	113.1	W297 A298 A299 D303 F304 E305 L345 L349 E381 R382 W387	W297-Y301 AromaticContact CD1-CE2 3.87Å; W297-Y301 AromaticContact NE1-CD2 4Å; W297-Y301 AromaticContact NE1-CE2 3.29Å; W297-Y301 VanDerWaalsContact NE1-CE2 3.29Å; W297-Y301 PolarHBondContact O-N 3.1Å; A298-Y301 PolarHBondContact O-N 3.35Å; A299-Y301 VanDerWaalsContact C-N 3.29Å; A299-Y301 PolarHBondContact O-N 3.28Å; Y301-D303 VanDerWaalsContact C-N 3.32Å; Y301-F304 PolarHBondContact O-N 3.39Å; Y301-E305 PolarHBondContact O-N 2.82Å; Y301-L345 HydrophobicContact CD1-CD1 4.27Å; Y301-L345 HydrophobicContact CD1-CD2 3.86Å; Y301-L345 HydrophobicContact CE1-CD2 3.95Å; Y301-L349 HydrophobicContact CD1-CD1 4.26Å; Y301-L349 HydrophobicContact CE1-CD1 3.42Å; Y301-L349 VanDerWaalsContact CE1-CD1 3.42Å; Y301-L349 HydrophobicContact CE2-CD1 4.43Å; Y301-L349 VanDerWaalsContact CZ-CD1 3.5Å; Y301-L349 WeakPolarHBondContact OH-CD1 3.45Å; Y301-E381 WeakPolarHBondContact OH-CA 3.32Å; Y301-E381 WeakPolarHBondContact OH-CG 3.23Å; Y301-R382 HydrophobicContact CE1-CB 4.12Å; Y301-R382 HydrophobicContact CE1-CG 4.47Å; Y301-R382 HydrophobicContact CE2-CB 4.49Å; Y301-R382 HydrophobicContact CE2-CG 4.15Å; Y301-R382 PolarHBondContact OH-N 2.83Å; Y301-W387 AromaticContact CD1-CZ2 3.64Å; Y301-W387 HydrophobicContact CD1-CZ2 3.64Å; Y301-W387 HydrophobicContact CE1-CZ2 4.23Å; Y301-W387 HydrophobicContact CG-CZ2 4.37Å
302	K	91.1	Very high	92.1	Very high	135 Å²	135	56.3 Å²	56.3	59%	0.587	31%	0.312	S	S	*	.	H	α-helix	trans	-66.1	-36	176.1	-168.2	177.4	-179.2	-178.7	0	111.6	A298 A299 E305 N306	A298-K302 PolarHBondContact O-N 3.46Å; A298-K302 VanDerWaalsContact O-N 3.17Å; A299-K302 CarbonylContact O-C 3.54Å; A299-K302 WeakPolarHBondContact O-CA 3.42Å; A299-K302 WeakPolarHBondContact O-CB 3.49Å; A299-K302 PolarHBondContact O-N 2.95Å; K302-E305 PolarHBondContact O-N 3.32Å; K302-N306 VanDerWaalsContact O-CB 3.3Å; K302-N306 WeakPolarHBondContact O-CB 3.49Å; K302-N306 PolarHBondContact O-N 2.86Å; K302-N306 PolarHBondContact O-ND2 3.34Å; K302-N306 VanDerWaalsContact O-ND2 3.09Å
303	D	92.8	Very high	92.3	Very high	93 Å²	93	52.2 Å²	52.2	50%	0.497	29%	0.286	S	S	.	.	H	α-helix	trans	-68.9	-34.1	176.8	-68.6	-15.5	0	0	0	112.3	A299 Y301 S307	A299-D303 VanDerWaalsContact O-CG 3.25Å; A299-D303 PolarHBondContact O-N 3.48Å; Y301-D303 VanDerWaalsContact C-N 3.32Å; D303-S307 WeakPolarHBondContact O-CB 3.32Å; D303-S307 PolarHBondContact O-N 3.36Å
304	F	94.1	Very high	92.4	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.013	29%	0.288	C	S	.	.	H	α-helix	trans	-68.7	-47.3	170.8	177.8	-95.8	0	0	0	111.7	S300 Y301 N306 S307 F310 W332 L338 R341 Y342 L345 W387	S300-F304 PolarHBondContact O-N 3.02Å; S300-F304 VanDerWaalsContact O-N 3.15Å; Y301-F304 PolarHBondContact O-N 3.39Å; F304-N306 PolarHBondContact O-N 3.04Å; F304-S307 WeakPolarHBondContact O-CB 2.96Å; F304-S307 PolarHBondContact O-N 3.49Å; F304-S307 VanDerWaalsContact O-N 3.08Å; F304-S307 PolarHBondContact O-OG 2.03Å; F304-F310 HydrophobicContact CD1-CD2 4.35Å; F304-F310 AromaticContact CE1-CD2 3.66Å; F304-F310 HydrophobicContact CE1-CD2 3.66Å; F304-F310 HydrophobicContact CE1-CE2 4.11Å; F304-F310 HydrophobicContact CE1-CG 4.5Å; F304-F310 HydrophobicContact CZ-CD2 4.11Å; F304-F310 WeakPolarHBondContact O-CB 3.4Å; F304-W332 AromaticContact CE1-CH2 3.93Å; F304-W332 HydrophobicContact CE1-CH2 3.93Å; F304-W332 HydrophobicContact CE1-CZ2 4.48Å; F304-W332 AromaticContact CZ-CH2 3.86Å; F304-W332 HydrophobicContact CZ-CH2 3.86Å; F304-W332 HydrophobicContact CZ-CZ2 4.07Å; F304-L338 HydrophobicContact CE2-CD1 4.24Å; F304-L338 HydrophobicContact CZ-CD1 3.77Å; F304-R341 HydrophobicContact CD2-CG 3.8Å; F304-R341 HydrophobicContact CE2-CB 4.27Å; F304-R341 HydrophobicContact CE2-CG 3.86Å; F304-Y342 HydrophobicContact CE1-CD2 4.36Å; F304-Y342 HydrophobicContact CE2-CD2 4.18Å; F304-Y342 AromaticContact CZ-CD2 3.89Å; F304-Y342 HydrophobicContact CZ-CD2 3.89Å; F304-Y342 HydrophobicContact CZ-CG 4.44Å; F304-L345 HydrophobicContact CB-CD1 4.4Å; F304-L345 HydrophobicContact CB-CD2 3.87Å; F304-L345 HydrophobicContact CD1-CD2 4.18Å; F304-L345 HydrophobicContact CD2-CB 4.36Å; F304-L345 HydrophobicContact CD2-CD2 4.04Å; F304-L345 HydrophobicContact CG-CD2 3.75Å; F304-W387 HydrophobicContact CD1-CD2 4.5Å; F304-W387 HydrophobicContact CD1-CE3 4.33Å; F304-W387 AromaticContact CD1-CH2 3.57Å; F304-W387 HydrophobicContact CD1-CH2 3.57Å; F304-W387 AromaticContact CD1-CZ2 3.73Å; F304-W387 HydrophobicContact CD1-CZ2 3.73Å; F304-W387 AromaticContact CD1-CZ3 3.88Å; F304-W387 HydrophobicContact CD1-CZ3 3.88Å; F304-W387 HydrophobicContact CE1-CD2 4.22Å; F304-W387 HydrophobicContact CE1-CE3 4.14Å; F304-W387 HydrophobicContact CE1-CH2 4.18Å; F304-W387 HydrophobicContact CE1-CZ2 4.24Å; F304-W387 HydrophobicContact CE1-CZ3 4.12Å
305	E	91.4	Very high	92.5	Very high	29 Å²	29	59 Å²	59	14%	0.136	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-30.4	178	-170.2	169.5	175.5	0	0	112.4	Y301 K302 F310 R382 W387 R390 F394	Y301-E305 PolarHBondContact O-N 2.82Å; K302-E305 PolarHBondContact O-N 3.32Å; E305-F310 HydrophobicContact CG-CE1 4.19Å; E305-F310 VanDerWaalsContact O-CD1 3.27Å; E305-F310 WeakPolarHBondContact O-CD1 3.44Å; E305-R382 IonicContact OE2-NH1 2.68Å; E305-W387 HydrophobicContact CB-CH2 4.18Å; E305-W387 HydrophobicContact CB-CZ3 4.18Å; E305-W387 HydrophobicContact CG-CZ3 4.41Å; E305-R390 IonicContact OE1-CZ 2.71Å; E305-R390 VanDerWaalsContact OE1-CZ 3.31Å; E305-R390 IonicContact OE1-NE 3.48Å; E305-R390 PolarHBondContact OE1-NE 3.13Å; E305-R390 IonicContact OE1-NH2 3.3Å; E305-R390 PolarHBondContact OE1-NH2 2.03Å; E305-F394 HydrophobicContact CG-CE2 4.18Å; E305-F394 HydrophobicContact CG-CZ 4.19Å; E305-F394 VanDerWaalsContact OE1-CE2 3.3Å; E305-F394 WeakPolarHBondContact OE1-CE2 3.35Å; E305-F394 WeakPolarHBondContact OE1-CZ 3.26Å
306	N	92.4	Very high	92.5	Very high	79 Å²	79	58.9 Å²	58.9	42%	0.422	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.6	177.1	-74.8	-39.3	0	0	0	114.7	K302 F304 K311	K302-N306 VanDerWaalsContact O-CB 3.3Å; K302-N306 WeakPolarHBondContact O-CB 3.49Å; K302-N306 PolarHBondContact O-N 2.86Å; K302-N306 PolarHBondContact O-ND2 3.34Å; K302-N306 VanDerWaalsContact O-ND2 3.09Å; F304-N306 PolarHBondContact O-N 3.04Å; N306-K311 WeakPolarHBondContact O-CE 3.35Å; N306-K311 PolarHBondContact O-NZ 2.9Å
307	S	94.9	Very high	92.6	Very high	10 Å²	10	57.2 Å²	57.2	7%	0.07	29%	0.291	C	S	.	.	S	Bend	trans	-67.9	151.6	-176	97.1	0	0	0	0	111.5	D303 F304 E309 F310 K311	D303-S307 WeakPolarHBondContact O-CB 3.32Å; D303-S307 PolarHBondContact O-N 3.36Å; F304-S307 WeakPolarHBondContact O-CB 2.96Å; F304-S307 PolarHBondContact O-N 3.49Å; F304-S307 VanDerWaalsContact O-N 3.08Å; F304-S307 PolarHBondContact O-OG 2.03Å; S307-E309 VanDerWaalsContact C-N 3.26Å; S307-E309 WeakPolarHBondContact CB-OE2 2.99Å; S307-E309 PolarHBondContact O-N 3.04Å; S307-E309 PolarHBondContact OG-OE2 3.28Å; S307-F310 PolarHBondContact O-N 3.43Å; S307-F310 PolarHBondContact OG-N 2.76Å; S307-K311 WeakPolarHBondContact O-CG 2.93Å; S307-K311 PolarHBondContact O-N 3.11Å; S307-K311 VanDerWaalsContact O-N 3.08Å
308	D	93.9	Very high	92.5	Very high	127 Å²	127	58.8 Å²	58.8	68%	0.679	30%	0.303	S	S	*	.	H	α-helix	trans	-67	-31.3	-178.7	-68.9	-35.6	0	0	0	111.4	K311 S312	D308-K311 PolarHBondContact O-N 3.32Å; D308-S312 WeakPolarHBondContact O-CB 3.48Å; D308-S312 PolarHBondContact O-N 3.32Å
309	E	94.8	Very high	92.2	Very high	66 Å²	66	60.4 Å²	60.4	31%	0.308	31%	0.311	S	S	.	.	H	α-helix	trans	-63.4	-46.3	175.3	-52.3	83.9	172.4	0	0	111.3	S307 S312 F313 D337 R341	S307-E309 VanDerWaalsContact C-N 3.26Å; S307-E309 WeakPolarHBondContact CB-OE2 2.99Å; S307-E309 PolarHBondContact O-N 3.04Å; S307-E309 PolarHBondContact OG-OE2 3.28Å; E309-S312 PolarHBondContact O-N 3.37Å; E309-F313 WeakPolarHBondContact O-CB 3.06Å; E309-F313 PolarHBondContact O-N 3.04Å; E309-D337 HydrophobicContact CG-CB 4.3Å; E309-R341 HydrophobicContact CB-CB 4.41Å; E309-R341 HydrophobicContact CG-CB 4.34Å
310	F	94.1	Very high	91.9	Very high	1 Å²	1	62.6 Å²	62.6	0%	0.004	32%	0.32	C	S	.	.	H	α-helix	trans	-65.3	-44.4	177.6	-174.3	-95.2	0	0	0	111.8	F304 E305 S307 S312 F313 L314 W332 L338 W387 V391 F394	F304-F310 HydrophobicContact CD1-CD2 4.35Å; F304-F310 AromaticContact CE1-CD2 3.66Å; F304-F310 HydrophobicContact CE1-CD2 3.66Å; F304-F310 HydrophobicContact CE1-CE2 4.11Å; F304-F310 HydrophobicContact CE1-CG 4.5Å; F304-F310 HydrophobicContact CZ-CD2 4.11Å; F304-F310 WeakPolarHBondContact O-CB 3.4Å; E305-F310 HydrophobicContact CG-CE1 4.19Å; E305-F310 VanDerWaalsContact O-CD1 3.27Å; E305-F310 WeakPolarHBondContact O-CD1 3.44Å; S307-F310 PolarHBondContact O-N 3.43Å; S307-F310 PolarHBondContact OG-N 2.76Å; F310-S312 VanDerWaalsContact C-N 3.35Å; F310-S312 PolarHBondContact O-N 2.9Å; F310-F313 PolarHBondContact O-N 3.21Å; F310-L314 HydrophobicContact CD1-CD1 4Å; F310-L314 HydrophobicContact CD1-CG 4.4Å; F310-L314 HydrophobicContact CE1-CD1 3.6Å; F310-L314 HydrophobicContact CE1-CG 4.12Å; F310-L314 HydrophobicContact CZ-CD1 4.38Å; F310-L314 WeakPolarHBondContact O-CG 3.11Å; F310-L314 PolarHBondContact O-N 2.93Å; F310-W332 HydrophobicContact CD2-CH2 4.24Å; F310-W332 HydrophobicContact CD2-CZ3 4.24Å; F310-W332 HydrophobicContact CE2-CH2 4.03Å; F310-W332 AromaticContact CE2-CZ3 3.82Å; F310-W332 HydrophobicContact CE2-CZ3 3.82Å; F310-L338 HydrophobicContact CB-CD1 4.23Å; F310-L338 HydrophobicContact CD2-CD1 4.06Å; F310-W387 HydrophobicContact CE2-CE3 4.04Å; F310-W387 HydrophobicContact CE2-CZ3 4.25Å; F310-W387 HydrophobicContact CZ-CE3 4.31Å; F310-W387 HydrophobicContact CZ-CZ3 4.32Å; F310-V391 HydrophobicContact CE2-CG2 4.02Å; F310-V391 HydrophobicContact CZ-CG2 3.94Å; F310-F394 HydrophobicContact CE1-CD2 4.33Å; F310-F394 HydrophobicContact CE1-CE2 4.08Å; F310-F394 HydrophobicContact CZ-CD2 4.49Å; F310-F394 HydrophobicContact CZ-CE2 4.42Å
311	K	93.1	Very high	91.7	Very high	88 Å²	88	63.8 Å²	63.8	38%	0.383	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-37.1	176.3	-71.5	170.7	177.6	157.5	0	112.5	N306 S307 D308 L314 K315	N306-K311 WeakPolarHBondContact O-CE 3.35Å; N306-K311 PolarHBondContact O-NZ 2.9Å; S307-K311 WeakPolarHBondContact O-CG 2.93Å; S307-K311 PolarHBondContact O-N 3.11Å; S307-K311 VanDerWaalsContact O-N 3.08Å; D308-K311 PolarHBondContact O-N 3.32Å; K311-L314 PolarHBondContact O-N 2.67Å; K311-K315 WeakPolarHBondContact O-CG 3.36Å; K311-K315 PolarHBondContact O-N 3.28Å; K311-K315 VanDerWaalsContact O-N 3.13Å
312	S	93.5	Very high	91.7	Very high	49 Å²	49	63.6 Å²	63.6	34%	0.343	32%	0.323	S	S	.	.	H	α-helix	trans	-65.9	-44.7	176	-176.9	0	0	0	0	111	D308 E309 F310 L314 K315 R316	D308-S312 WeakPolarHBondContact O-CB 3.48Å; D308-S312 PolarHBondContact O-N 3.32Å; E309-S312 PolarHBondContact O-N 3.37Å; F310-S312 VanDerWaalsContact C-N 3.35Å; F310-S312 PolarHBondContact O-N 2.9Å; S312-L314 PolarHBondContact O-N 3.3Å; S312-K315 PolarHBondContact O-N 2.01Å; S312-K315 VanDerWaalsContact O-N 3.15Å; S312-R316 WeakPolarHBondContact O-CG 3.45Å; S312-R316 PolarHBondContact O-N 3.06Å
313	F	94.8	Very high	91.7	Very high	5 Å²	5	57.3 Å²	57.3	2%	0.022	30%	0.296	C	S	.	.	H	α-helix	trans	-54.8	-50.4	172.2	172.7	-109.2	0	0	0	111.6	E309 F310 K315 R316 L317 V328 L331 W332 D335 L338 V391	E309-F313 WeakPolarHBondContact O-CB 3.06Å; E309-F313 PolarHBondContact O-N 3.04Å; F310-F313 PolarHBondContact O-N 3.21Å; F313-K315 VanDerWaalsContact C-N 3.26Å; F313-K315 PolarHBondContact O-N 2.93Å; F313-R316 PolarHBondContact O-N 3.38Å; F313-L317 HydrophobicContact CD1-CD1 4.37Å; F313-L317 HydrophobicContact CE1-CD1 3.91Å; F313-L317 HydrophobicContact CE1-CD2 4.31Å; F313-L317 HydrophobicContact CE1-CG 4.35Å; F313-L317 HydrophobicContact CE2-CD2 3.92Å; F313-L317 HydrophobicContact CE2-CG 4.48Å; F313-L317 HydrophobicContact CZ-CD1 4.19Å; F313-L317 HydrophobicContact CZ-CD2 3.75Å; F313-L317 HydrophobicContact CZ-CG 4.26Å; F313-L317 WeakPolarHBondContact O-CG 3.45Å; F313-L317 PolarHBondContact O-N 2.86Å; F313-V328 HydrophobicContact CZ-CG1 4.39Å; F313-L331 HydrophobicContact CE2-CB 4.11Å; F313-L331 HydrophobicContact CZ-CB 4.44Å; F313-W332 HydrophobicContact CD1-CE3 4.29Å; F313-W332 AromaticContact CE1-CE3 3.69Å; F313-W332 HydrophobicContact CE1-CE3 3.69Å; F313-W332 HydrophobicContact CE1-CZ3 4.27Å; F313-W332 HydrophobicContact CE2-CB 4.46Å; F313-W332 HydrophobicContact CZ-CB 3.99Å; F313-W332 HydrophobicContact CZ-CE3 4.11Å; F313-D335 HydrophobicContact CD2-CB 4.18Å; F313-D335 VanDerWaalsContact CD2-OD2 3.32Å; F313-D335 WeakPolarHBondContact CD2-OD2 3.39Å; F313-L338 HydrophobicContact CB-CD2 3.95Å; F313-L338 HydrophobicContact CD1-CD2 3.73Å; F313-L338 HydrophobicContact CD2-CD2 3.88Å; F313-L338 HydrophobicContact CE1-CD2 4.15Å; F313-L338 HydrophobicContact CE2-CD2 4.28Å; F313-L338 HydrophobicContact CG-CD2 3.58Å; F313-L338 HydrophobicContact CZ-CD2 4.4Å; F313-V391 HydrophobicContact CE1-CG1 4.21Å; F313-V391 HydrophobicContact CE1-CG2 4.22Å
314	L	92	Very high	91.6	Very high	37 Å²	37	54.3 Å²	54.3	19%	0.194	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-37.5	177.4	-72.2	179.5	0	0	0	113.3	F310 K311 S312 L317 V391 F394	F310-L314 HydrophobicContact CD1-CD1 4Å; F310-L314 HydrophobicContact CD1-CG 4.4Å; F310-L314 HydrophobicContact CE1-CD1 3.6Å; F310-L314 HydrophobicContact CE1-CG 4.12Å; F310-L314 HydrophobicContact CZ-CD1 4.38Å; F310-L314 WeakPolarHBondContact O-CG 3.11Å; F310-L314 PolarHBondContact O-N 2.93Å; K311-L314 PolarHBondContact O-N 2.67Å; S312-L314 PolarHBondContact O-N 3.3Å; L314-L317 HydrophobicContact CD2-CD1 4.2Å; L314-V391 HydrophobicContact CD2-CB 4.29Å; L314-V391 HydrophobicContact CD2-CG1 3.75Å; L314-V391 HydrophobicContact CD2-CG2 4.13Å; L314-F394 HydrophobicContact CD1-CB 4.28Å; L314-F394 HydrophobicContact CD1-CD2 4.24Å; L314-F394 HydrophobicContact CD1-CG 4.16Å; L314-F394 HydrophobicContact CD2-CB 4.28Å
315	K	91.1	Very high	91.5	Very high	185 Å²	185	55.6 Å²	55.6	80%	0.804	29%	0.288	S	S	*	.	H	α-helix	trans	-72.6	-29.3	177.3	-72.8	176	-179.7	179.9	0	113.3	K311 S312 F313 L317	K311-K315 WeakPolarHBondContact O-CG 3.36Å; K311-K315 PolarHBondContact O-N 3.28Å; K311-K315 VanDerWaalsContact O-N 3.13Å; S312-K315 PolarHBondContact O-N 2.01Å; S312-K315 VanDerWaalsContact O-N 3.15Å; F313-K315 VanDerWaalsContact C-N 3.26Å; F313-K315 PolarHBondContact O-N 2.93Å; K315-L317 VanDerWaalsContact C-N 3.34Å
316	R	91.2	Very high	91.5	Very high	134 Å²	134	58.1 Å²	58.1	51%	0.506	31%	0.309	S	S	.	.	H	α-helix	trans	-78.6	-16.8	178.6	-73.3	-173	-73.6	-166.9	-6.9	113.2	S312 F313 D335	S312-R316 WeakPolarHBondContact O-CG 3.45Å; S312-R316 PolarHBondContact O-N 3.06Å; F313-R316 PolarHBondContact O-N 3.38Å; R316-D335 IonicContact CZ-OD1 2.66Å; R316-D335 IonicContact CZ-OD2 3.59Å; R316-D335 VanDerWaalsContact CZ-OD2 3.22Å; R316-D335 IonicContact NE-OD2 2.66Å; R316-D335 IonicContact NH2-OD1 3.44Å; R316-D335 PolarHBondContact NH2-OD1 2.9Å; R316-D335 VanDerWaalsContact NH2-OD1 3.09Å; R316-D335 IonicContact NH2-OD2 3.87Å; R316-D335 PolarHBondContact NH2-OD2 3.45Å
317	L	92.1	Very high	91.5	Very high	13 Å²	13	56.5 Å²	56.5	7%	0.068	30%	0.304	C	S	.	.	S	Bend	trans	-65	134.8	179.7	-70.7	174.8	0	0	0	111.2	F313 L314 K315 S319 L323 L331 V391 L395	F313-L317 HydrophobicContact CD1-CD1 4.37Å; F313-L317 HydrophobicContact CE1-CD1 3.91Å; F313-L317 HydrophobicContact CE1-CD2 4.31Å; F313-L317 HydrophobicContact CE1-CG 4.35Å; F313-L317 HydrophobicContact CE2-CD2 3.92Å; F313-L317 HydrophobicContact CE2-CG 4.48Å; F313-L317 HydrophobicContact CZ-CD1 4.19Å; F313-L317 HydrophobicContact CZ-CD2 3.75Å; F313-L317 HydrophobicContact CZ-CG 4.26Å; F313-L317 WeakPolarHBondContact O-CG 3.45Å; F313-L317 PolarHBondContact O-N 2.86Å; L314-L317 HydrophobicContact CD2-CD1 4.2Å; K315-L317 VanDerWaalsContact C-N 3.34Å; L317-S319 PolarHBondContact O-N 2.97Å; L317-L323 HydrophobicContact CB-CD1 4.1Å; L317-L323 HydrophobicContact CD2-CD1 4.27Å; L317-L331 HydrophobicContact CD2-CB 4.15Å; L317-L331 HydrophobicContact CD2-CD1 3.59Å; L317-V391 HydrophobicContact CD1-CG1 3.58Å; L317-L395 HydrophobicContact CB-CD2 4.39Å; L317-L395 HydrophobicContact CD1-CD1 4.05Å; L317-L395 HydrophobicContact CD1-CD2 4.23Å; L317-L395 HydrophobicContact CD1-CG 4.46Å
318	P	89.2	Confident	91.4	Very high	47 Å²	47	56 Å²	56	31%	0.305	30%	0.3	S	S	.	.			trans	-60.1	126.7	177.9	-22.2	30.5	0	0	0	111.9	L323	P318-L323 HydrophobicContact CB-CD2 4.47Å; P318-L323 HydrophobicContact CG-CD2 4.39Å; P318-L323 WeakPolarHBondContact O-CD1 3.22Å
319	S	84	Confident	91.4	Very high	93 Å²	93	54.8 Å²	54.8	65%	0.65	29%	0.29	S	S	*	.			trans	-94.3	-7.2	171.6	57.6	0	0	0	0	113.1	L317 H321 I444	L317-S319 PolarHBondContact O-N 2.97Å; S319-H321 VanDerWaalsContact C-N 3.31Å; S319-H321 PolarHBondContact O-N 2.86Å; S319-I444 WeakPolarHBondContact O-CD1 3.32Å
320	T	85.3	Confident	91.3	Very high	88 Å²	88	58 Å²	58	54%	0.54	31%	0.309	S	S	.	.	S	Bend	trans	-72.5	-20.5	-173.5	54.9	0	0	0	0	114.1	C439	T320-C439 WeakPolarHBondContact O-CB 3.34Å; T320-C439 PolarHBondContact O-SG 3.43Å
321	H	88.7	Confident	91.3	Very high	45 Å²	45	60.6 Å²	60.6	21%	0.208	32%	0.323	C	S	.	.	S	Bend	trans	-153.8	169.5	-176.3	63.3	-77.8	0	0	0	111.1	S319 P427 I430	S319-H321 VanDerWaalsContact C-N 3.31Å; S319-H321 PolarHBondContact O-N 2.86Å; H321-P427 VanDerWaalsContact C-CB 3.4Å; H321-I430 HydrophobicContact CB-CB 4.38Å; H321-I430 HydrophobicContact CB-CD1 3.51Å; H321-I430 HydrophobicContact CB-CG1 3.74Å
322	F	91.3	Very high	91.3	Very high	9 Å²	9	56.6 Å²	56.6	4%	0.039	31%	0.305	C	S	.	.			trans	-75.6	135.9	-177.9	177.1	-101.4	0	0	0	110.9	P324 Y396 F406 E408 I426 P427 C428 V429	F322-P324 HydrophobicContact CE1-CB 4.18Å; F322-P324 WeakPolarHBondContact O-CD 3.35Å; F322-Y396 HydrophobicContact CD2-CE1 4.36Å; F322-Y396 AromaticContact CD2-CE2 3.92Å; F322-Y396 HydrophobicContact CD2-CE2 3.92Å; F322-Y396 AromaticContact CD2-CZ 3.71Å; F322-Y396 HydrophobicContact CE2-CD2 4.26Å; F322-Y396 AromaticContact CE2-CE2 3.6Å; F322-Y396 HydrophobicContact CE2-CE2 3.6Å; F322-Y396 AromaticContact CE2-CZ 3.9Å; F322-F406 AromaticContact CE2-CE1 3.85Å; F322-F406 HydrophobicContact CE2-CE1 3.85Å; F322-F406 AromaticContact CE2-CZ 3.69Å; F322-F406 HydrophobicContact CE2-CZ 3.69Å; F322-F406 AromaticContact CZ-CE1 4Å; F322-F406 HydrophobicContact CZ-CE1 4Å; F322-F406 HydrophobicContact CZ-CZ 4.16Å; F322-E408 HydrophobicContact CZ-CG 4.21Å; F322-I426 HydrophobicContact CD2-CG2 3.66Å; F322-I426 HydrophobicContact CE2-CG2 4.11Å; F322-P427 HydrophobicContact CB-CB 4.46Å; F322-P427 WeakPolarHBondContact CB-O 3.45Å; F322-C428 WeakPolarHBondContact CB-O 3.24Å; F322-C428 PolarHBondContact N-O 3.41Å; F322-V429 HydrophobicContact CB-CG2 4.13Å; F322-V429 HydrophobicContact CD1-CG2 3.93Å; F322-V429 HydrophobicContact CG-CG2 4.29Å
323	L	91.8	Very high	91.2	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.016	31%	0.313	C	S	.	.			trans	-108.9	104.8	179.8	-61.1	177.4	0	0	0	109.8	L317 P318 V328 Q392 L395 Y396	L317-L323 HydrophobicContact CB-CD1 4.1Å; L317-L323 HydrophobicContact CD2-CD1 4.27Å; P318-L323 HydrophobicContact CB-CD2 4.47Å; P318-L323 HydrophobicContact CG-CD2 4.39Å; P318-L323 WeakPolarHBondContact O-CD1 3.22Å; L323-V328 HydrophobicContact CB-CG2 3.81Å; L323-Q392 PolarHBondContact O-NE2 3.29Å; L323-L395 HydrophobicContact CD1-CD1 4.2Å; L323-Y396 PolarHBondContact N-OH 3.46Å
324	P	90.9	Very high	91.2	Very high	30 Å²	30	60.1 Å²	60.1	20%	0.195	34%	0.338	C	S	.	.			trans	-66	159.4	170.8	29	-34	0	0	0	110.4	F322 S326 S327 V328 E408	F322-P324 HydrophobicContact CE1-CB 4.18Å; F322-P324 WeakPolarHBondContact O-CD 3.35Å; P324-S326 PolarHBondContact O-N 2.83Å; P324-S326 VanDerWaalsContact O-N 3.1Å; P324-S327 WeakPolarHBondContact CD-OG 3.35Å; P324-S327 WeakPolarHBondContact CG-OG 3.31Å; P324-S327 PolarHBondContact O-N 2.87Å; P324-V328 PolarHBondContact O-N 3.14Å; P324-V328 VanDerWaalsContact O-N 3.09Å; P324-E408 WeakPolarHBondContact CB-OE1 3.08Å
325	I	91.9	Very high	91.2	Very high	29 Å²	29	59 Å²	59	15%	0.149	33%	0.332	C	S	.	.	H	α-helix	trans	-51.1	-38.4	179.4	-83.2	165.5	0	0	0	112.3	S327 V328 H329 M385 L388 N389 Q392 E408	I325-S327 PolarHBondContact O-N 3.07Å; I325-V328 PolarHBondContact O-N 3.35Å; I325-H329 WeakPolarHBondContact O-CB 3.01Å; I325-H329 PolarHBondContact O-N 3.43Å; I325-M385 HydrophobicContact CD1-CE 3.57Å; I325-M385 HydrophobicContact CD1-SD 4.47Å; I325-M385 HydrophobicContact CG2-CE 3.94Å; I325-M385 HydrophobicContact CG2-SD 3.8Å; I325-L388 HydrophobicContact CG2-CD1 3.99Å; I325-N389 WeakPolarHBondContact CD1-OD1 3.49Å; I325-Q392 VanDerWaalsContact CG1-CD 3.48Å; I325-Q392 HydrophobicContact CG1-CG 4.47Å; I325-Q392 VanDerWaalsContact CG1-OE1 3.26Å; I325-E408 WeakPolarHBondContact CD1-OE2 3.43Å; I325-E408 VanDerWaalsContact CG1-OE2 3.24Å; I325-E408 WeakPolarHBondContact CG1-OE2 3.37Å; I325-E408 PolarHBondContact N-OE2 2.93Å
326	S	91.3	Very high	91.3	Very high	82 Å²	82	59.6 Å²	59.6	57%	0.573	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-42	178.5	52.1	0	0	0	0	112.7	P324 H329 L330	P324-S326 PolarHBondContact O-N 2.83Å; P324-S326 VanDerWaalsContact O-N 3.1Å; S326-H329 PolarHBondContact O-N 2.02Å; S326-L330 PolarHBondContact O-N 3.5Å
327	S	91.4	Very high	91.4	Very high	46 Å²	46	58 Å²	58	32%	0.322	33%	0.331	S	S	.	.	H	α-helix	trans	-69.1	-42	176.5	-62.7	0	0	0	0	111.7	P324 I325 H329 L330 L331	P324-S327 WeakPolarHBondContact CD-OG 3.35Å; P324-S327 WeakPolarHBondContact CG-OG 3.31Å; P324-S327 PolarHBondContact O-N 2.87Å; I325-S327 PolarHBondContact O-N 3.07Å; S327-H329 VanDerWaalsContact C-N 3.29Å; S327-H329 PolarHBondContact O-N 3.33Å; S327-L330 PolarHBondContact O-N 3.06Å; S327-L331 WeakPolarHBondContact O-CG 3.03Å; S327-L331 PolarHBondContact O-N 2.95Å
328	V	93.4	Very high	91.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-40.4	175.4	-176.4	0	0	0	0	110.4	F313 L323 P324 I325 L331 W332 L388 V391 Q392	F313-V328 HydrophobicContact CZ-CG1 4.39Å; L323-V328 HydrophobicContact CB-CG2 3.81Å; P324-V328 PolarHBondContact O-N 3.14Å; P324-V328 VanDerWaalsContact O-N 3.09Å; I325-V328 PolarHBondContact O-N 3.35Å; V328-L331 PolarHBondContact O-N 2.63Å; V328-W332 WeakPolarHBondContact O-CB 3.34Å; V328-W332 PolarHBondContact O-N 3.48Å; V328-L388 HydrophobicContact CB-CD2 4.37Å; V328-L388 HydrophobicContact CG1-CD2 3.84Å; V328-V391 HydrophobicContact CG1-CB 4.22Å; V328-V391 HydrophobicContact CG1-CG1 3.64Å; V328-Q392 HydrophobicContact CG2-CG 4.47Å
329	H	93.6	Very high	91.7	Very high	101 Å²	101	56.9 Å²	56.9	47%	0.468	32%	0.321	S	S	.	.	H	α-helix	trans	-62.8	-41.9	176.1	-175.6	-111.3	0	0	0	112.6	I325 S326 S327 W332 G333 L388	I325-H329 WeakPolarHBondContact O-CB 3.01Å; I325-H329 PolarHBondContact O-N 3.43Å; S326-H329 PolarHBondContact O-N 2.02Å; S327-H329 VanDerWaalsContact C-N 3.29Å; S327-H329 PolarHBondContact O-N 3.33Å; H329-W332 PolarHBondContact O-N 2.88Å; H329-G333 PolarHBondContact O-N 3.05Å; H329-L388 HydrophobicContact CB-CD1 3.72Å; H329-L388 HydrophobicContact CB-CD2 4.3Å
330	L	93.2	Very high	92.2	Very high	133 Å²	133	55 Å²	55	70%	0.696	31%	0.311	S	S	*	.	H	α-helix	trans	-61.6	-47.3	176	-173	75.9	0	0	0	111.1	S326 S327 G333 S334	S326-L330 PolarHBondContact O-N 3.5Å; S327-L330 PolarHBondContact O-N 3.06Å; L330-G333 PolarHBondContact O-N 2.76Å; L330-S334 PolarHBondContact O-N 3.45Å
331	L	92.9	Very high	92.6	Very high	56 Å²	56	55 Å²	55	29%	0.293	30%	0.302	S	S	.	.	H	α-helix	trans	-64.1	-41.7	177.9	-68.2	170.5	0	0	0	111.3	F313 L317 S327 V328 G333 S334 D335	F313-L331 HydrophobicContact CE2-CB 4.11Å; F313-L331 HydrophobicContact CZ-CB 4.44Å; L317-L331 HydrophobicContact CD2-CB 4.15Å; L317-L331 HydrophobicContact CD2-CD1 3.59Å; S327-L331 WeakPolarHBondContact O-CG 3.03Å; S327-L331 PolarHBondContact O-N 2.95Å; V328-L331 PolarHBondContact O-N 2.63Å; L331-G333 VanDerWaalsContact C-N 3.3Å; L331-G333 PolarHBondContact O-N 2.02Å; L331-S334 WeakPolarHBondContact CA-OG 3.49Å; L331-S334 PolarHBondContact O-N 3.22Å; L331-S334 VanDerWaalsContact O-N 3.14Å; L331-S334 PolarHBondContact O-OG 3.28Å; L331-D335 PolarHBondContact O-N 3.02Å
332	W	93.8	Very high	92.8	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.015	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-40.5	173.5	-178.4	-74.4	0	0	0	112	F304 F310 F313 V328 H329 S334 L338 Q339 Y342 W387 L388 V391	F304-W332 AromaticContact CE1-CH2 3.93Å; F304-W332 HydrophobicContact CE1-CH2 3.93Å; F304-W332 HydrophobicContact CE1-CZ2 4.48Å; F304-W332 AromaticContact CZ-CH2 3.86Å; F304-W332 HydrophobicContact CZ-CH2 3.86Å; F304-W332 HydrophobicContact CZ-CZ2 4.07Å; F310-W332 HydrophobicContact CD2-CH2 4.24Å; F310-W332 HydrophobicContact CD2-CZ3 4.24Å; F310-W332 HydrophobicContact CE2-CH2 4.03Å; F310-W332 AromaticContact CE2-CZ3 3.82Å; F310-W332 HydrophobicContact CE2-CZ3 3.82Å; F313-W332 HydrophobicContact CD1-CE3 4.29Å; F313-W332 AromaticContact CE1-CE3 3.69Å; F313-W332 HydrophobicContact CE1-CE3 3.69Å; F313-W332 HydrophobicContact CE1-CZ3 4.27Å; F313-W332 HydrophobicContact CE2-CB 4.46Å; F313-W332 HydrophobicContact CZ-CB 3.99Å; F313-W332 HydrophobicContact CZ-CE3 4.11Å; V328-W332 WeakPolarHBondContact O-CB 3.34Å; V328-W332 PolarHBondContact O-N 3.48Å; H329-W332 PolarHBondContact O-N 2.88Å; W332-S334 VanDerWaalsContact C-N 3.32Å; W332-L338 HydrophobicContact CD2-CD2 3.57Å; W332-L338 HydrophobicContact CD2-CG 4.47Å; W332-L338 HydrophobicContact CE3-CD2 3.54Å; W332-L338 HydrophobicContact CG-CD2 4.17Å; W332-L338 HydrophobicContact CH2-CD1 4.3Å; W332-L338 HydrophobicContact CH2-CD2 4.04Å; W332-L338 HydrophobicContact CH2-CG 4.35Å; W332-L338 HydrophobicContact CZ2-CD2 4.07Å; W332-L338 HydrophobicContact CZ2-CG 4.2Å; W332-L338 HydrophobicContact CZ3-CD2 3.79Å; W332-Q339 VanDerWaalsContact NE1-NE2 3.17Å; W332-Q339 PolarHBondContact O-NE2 3.32Å; W332-Y342 HydrophobicContact CZ2-CD2 4.15Å; W332-Y342 HydrophobicContact CZ2-CG 4.29Å; W332-W387 HydrophobicContact CH2-CB 4.09Å; W332-W387 HydrophobicContact CH2-CG 4.42Å; W332-W387 HydrophobicContact CZ3-CB 4.4Å; W332-L388 HydrophobicContact CB-CD2 4.25Å; W332-L388 HydrophobicContact CD2-CD2 4.44Å; W332-L388 HydrophobicContact CE3-CD2 4.3Å; W332-L388 HydrophobicContact CG-CD2 4.4Å; W332-V391 HydrophobicContact CE3-CG2 4.38Å; W332-V391 HydrophobicContact CZ3-CG2 3.99Å
333	G	92.3	Very high	92.9	Very high	50 Å²	50	60 Å²	60	52%	0.515	32%	0.318	S	S	.	.	H	α-helix	trans	-68.9	-28.3	176.3	0	0	0	0	0	113.8	H329 L330 L331	H329-G333 PolarHBondContact O-N 3.05Å; L330-G333 PolarHBondContact O-N 2.76Å; L331-G333 VanDerWaalsContact C-N 3.3Å; L331-G333 PolarHBondContact O-N 2.02Å
334	S	93.3	Very high	93	Very high	78 Å²	78	65.1 Å²	65.1	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-82.2	-17.2	179.9	70.1	0	0	0	0	114.4	L330 L331 W332 W336	L330-S334 PolarHBondContact O-N 3.45Å; L331-S334 WeakPolarHBondContact CA-OG 3.49Å; L331-S334 PolarHBondContact O-N 3.22Å; L331-S334 VanDerWaalsContact O-N 3.14Å; L331-S334 PolarHBondContact O-OG 3.28Å; W332-S334 VanDerWaalsContact C-N 3.32Å; S334-W336 PolarHBondContact O-N 3.49Å
335	D	93.8	Very high	93.1	Very high	12 Å²	12	64.4 Å²	64.4	6%	0.064	34%	0.339	C	S	.	.			trans	-87.6	98.9	-175.2	-166.6	-37.2	0	0	0	111.5	F313 R316 L331 D337 L338 Q339	F313-D335 HydrophobicContact CD2-CB 4.18Å; F313-D335 VanDerWaalsContact CD2-OD2 3.32Å; F313-D335 WeakPolarHBondContact CD2-OD2 3.39Å; R316-D335 IonicContact CZ-OD1 2.66Å; R316-D335 IonicContact CZ-OD2 3.59Å; R316-D335 VanDerWaalsContact CZ-OD2 3.22Å; R316-D335 IonicContact NE-OD2 2.66Å; R316-D335 IonicContact NH2-OD1 3.44Å; R316-D335 PolarHBondContact NH2-OD1 2.9Å; R316-D335 VanDerWaalsContact NH2-OD1 3.09Å; R316-D335 IonicContact NH2-OD2 3.87Å; R316-D335 PolarHBondContact NH2-OD2 3.45Å; L331-D335 PolarHBondContact O-N 3.02Å; D335-D337 PolarHBondContact O-N 3.39Å; D335-D337 PolarHBondContact OD1-N 3.17Å; D335-L338 HydrophobicContact CB-CB 4Å; D335-L338 PolarHBondContact OD1-N 3.18Å; D335-Q339 WeakPolarHBondContact O-CB 2.97Å; D335-Q339 WeakPolarHBondContact O-CG 3.46Å; D335-Q339 PolarHBondContact O-N 2.81Å
336	W	92.6	Very high	93.1	Very high	199 Å²	199	66.5 Å²	66.5	75%	0.754	35%	0.349	S	S	*	.	H	α-helix	trans	-61.5	-41.1	-176	-78.8	102	0	0	0	114	S334 Q339 A340	S334-W336 PolarHBondContact O-N 3.49Å; W336-Q339 PolarHBondContact O-N 2.86Å; W336-A340 WeakPolarHBondContact O-CB 3.23Å; W336-A340 PolarHBondContact O-N 3.33Å
337	D	93.4	Very high	93.2	Very high	100 Å²	100	65.6 Å²	65.6	54%	0.535	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-45	-177.1	-60.9	-41.7	0	0	0	110.6	E309 D335 A340 R341	E309-D337 HydrophobicContact CG-CB 4.3Å; D335-D337 PolarHBondContact O-N 3.39Å; D335-D337 PolarHBondContact OD1-N 3.17Å; D337-A340 PolarHBondContact O-N 3.49Å; D337-R341 WeakPolarHBondContact O-CB 3.42Å; D337-R341 PolarHBondContact O-N 2.99Å
338	L	94.3	Very high	93.2	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.8	-43.6	175.8	-177.8	66.4	0	0	0	111.7	F304 F310 F313 W332 D335 R341 Y342	F304-L338 HydrophobicContact CE2-CD1 4.24Å; F304-L338 HydrophobicContact CZ-CD1 3.77Å; F310-L338 HydrophobicContact CB-CD1 4.23Å; F310-L338 HydrophobicContact CD2-CD1 4.06Å; F313-L338 HydrophobicContact CB-CD2 3.95Å; F313-L338 HydrophobicContact CD1-CD2 3.73Å; F313-L338 HydrophobicContact CD2-CD2 3.88Å; F313-L338 HydrophobicContact CE1-CD2 4.15Å; F313-L338 HydrophobicContact CE2-CD2 4.28Å; F313-L338 HydrophobicContact CG-CD2 3.58Å; F313-L338 HydrophobicContact CZ-CD2 4.4Å; W332-L338 HydrophobicContact CD2-CD2 3.57Å; W332-L338 HydrophobicContact CD2-CG 4.47Å; W332-L338 HydrophobicContact CE3-CD2 3.54Å; W332-L338 HydrophobicContact CG-CD2 4.17Å; W332-L338 HydrophobicContact CH2-CD1 4.3Å; W332-L338 HydrophobicContact CH2-CD2 4.04Å; W332-L338 HydrophobicContact CH2-CG 4.35Å; W332-L338 HydrophobicContact CZ2-CD2 4.07Å; W332-L338 HydrophobicContact CZ2-CG 4.2Å; W332-L338 HydrophobicContact CZ3-CD2 3.79Å; D335-L338 HydrophobicContact CB-CB 4Å; D335-L338 PolarHBondContact OD1-N 3.18Å; L338-R341 PolarHBondContact O-N 2.93Å; L338-Y342 VanDerWaalsContact O-CB 3.32Å; L338-Y342 WeakPolarHBondContact O-CB 3.37Å; L338-Y342 PolarHBondContact O-N 3.36Å
339	Q	93.8	Very high	93.1	Very high	36 Å²	36	65.9 Å²	65.9	17%	0.168	34%	0.344	C	S	.	.	H	α-helix	trans	-61	-44	177.1	-74.8	-69.2	-34.7	0	0	111.9	W332 D335 W336 Y342 R343	W332-Q339 VanDerWaalsContact NE1-NE2 3.17Å; W332-Q339 PolarHBondContact O-NE2 3.32Å; D335-Q339 WeakPolarHBondContact O-CB 2.97Å; D335-Q339 WeakPolarHBondContact O-CG 3.46Å; D335-Q339 PolarHBondContact O-N 2.81Å; W336-Q339 PolarHBondContact O-N 2.86Å; Q339-Y342 PolarHBondContact O-N 3.06Å; Q339-R343 WeakPolarHBondContact O-CG 3.01Å; Q339-R343 PolarHBondContact O-N 2.85Å
340	A	93.3	Very high	93	Very high	53 Å²	53	64.5 Å²	64.5	44%	0.438	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-47.1	176.7	0	0	0	0	0	111.1	W336 D337 Y342 R343 L344	W336-A340 WeakPolarHBondContact O-CB 3.23Å; W336-A340 PolarHBondContact O-N 3.33Å; D337-A340 PolarHBondContact O-N 3.49Å; A340-Y342 VanDerWaalsContact C-N 3.34Å; A340-Y342 PolarHBondContact O-N 3.28Å; A340-R343 PolarHBondContact O-N 3.35Å; A340-L344 WeakPolarHBondContact O-CG 3.26Å; A340-L344 PolarHBondContact O-N 3.48Å; A340-L344 VanDerWaalsContact O-N 3.13Å
341	R	94.1	Very high	92.8	Very high	90 Å²	90	62.7 Å²	62.7	34%	0.34	33%	0.328	S	S	.	.	H	α-helix	trans	-61.9	-40.1	176.9	-175.1	65.6	-176.7	177.7	0.5	112.4	F304 E309 D337 L338 L344 L345	F304-R341 HydrophobicContact CD2-CG 3.8Å; F304-R341 HydrophobicContact CE2-CB 4.27Å; F304-R341 HydrophobicContact CE2-CG 3.86Å; E309-R341 HydrophobicContact CB-CB 4.41Å; E309-R341 HydrophobicContact CG-CB 4.34Å; D337-R341 WeakPolarHBondContact O-CB 3.42Å; D337-R341 PolarHBondContact O-N 2.99Å; L338-R341 PolarHBondContact O-N 2.93Å; R341-L344 PolarHBondContact O-N 3.29Å; R341-L345 PolarHBondContact O-N 3.09Å; R341-L345 VanDerWaalsContact O-N 3.12Å
342	Y	93.8	Very high	92.7	Very high	13 Å²	13	61.6 Å²	61.6	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-67.9	-39.8	177.9	-177.8	-107.3	0	0	0	112.2	F304 W332 L338 Q339 A340 L344 L345 Q346 V384 W387	F304-Y342 HydrophobicContact CE1-CD2 4.36Å; F304-Y342 HydrophobicContact CE2-CD2 4.18Å; F304-Y342 AromaticContact CZ-CD2 3.89Å; F304-Y342 HydrophobicContact CZ-CD2 3.89Å; F304-Y342 HydrophobicContact CZ-CG 4.44Å; W332-Y342 HydrophobicContact CZ2-CD2 4.15Å; W332-Y342 HydrophobicContact CZ2-CG 4.29Å; L338-Y342 VanDerWaalsContact O-CB 3.32Å; L338-Y342 WeakPolarHBondContact O-CB 3.37Å; L338-Y342 PolarHBondContact O-N 3.36Å; Q339-Y342 PolarHBondContact O-N 3.06Å; A340-Y342 VanDerWaalsContact C-N 3.34Å; A340-Y342 PolarHBondContact O-N 3.28Å; Y342-L344 VanDerWaalsContact C-N 3.32Å; Y342-L344 PolarHBondContact O-N 3.31Å; Y342-L345 HydrophobicContact CD2-CD2 4.27Å; Y342-L345 HydrophobicContact CE2-CD2 4.44Å; Y342-L345 WeakPolarHBondContact O-CB 3.46Å; Y342-L345 PolarHBondContact O-N 3.26Å; Y342-L345 VanDerWaalsContact O-N 3.17Å; Y342-Q346 HydrophobicContact CD1-CG 4.26Å; Y342-Q346 HydrophobicContact CE1-CG 3.85Å; Y342-Q346 HydrophobicContact CE2-CG 4.48Å; Y342-Q346 WeakPolarHBondContact O-CG 3.3Å; Y342-Q346 PolarHBondContact O-N 3.45Å; Y342-V384 HydrophobicContact CE1-CG2 4.01Å; Y342-V384 WeakPolarHBondContact OH-CG2 3.09Å; Y342-W387 AromaticContact CE2-CD1 3.93Å; Y342-W387 AromaticContact CE2-NE1 3.96Å
343	R	93.1	Very high	92.5	Very high	145 Å²	145	65.2 Å²	65.2	55%	0.547	34%	0.335	S	S	.	.	H	α-helix	trans	-62.3	-38.1	173.9	-73.3	177.1	-168.4	166.8	5.1	112.5	Q339 A340 L345 Q346 S347	Q339-R343 WeakPolarHBondContact O-CG 3.01Å; Q339-R343 PolarHBondContact O-N 2.85Å; A340-R343 PolarHBondContact O-N 3.35Å; R343-L345 VanDerWaalsContact C-N 3.34Å; R343-Q346 PolarHBondContact O-N 3.44Å; R343-S347 PolarHBondContact O-N 3.04Å; R343-S347 PolarHBondContact O-OG 3.29Å
344	L	93.1	Very high	92.5	Very high	110 Å²	110	65.9 Å²	65.9	58%	0.576	33%	0.326	S	S	*	.	H	α-helix	trans	-63.8	-39	173.8	-70.3	172.6	0	0	0	112.1	A340 R341 Y342 S347 S348	A340-L344 WeakPolarHBondContact O-CG 3.26Å; A340-L344 PolarHBondContact O-N 3.48Å; A340-L344 VanDerWaalsContact O-N 3.13Å; R341-L344 PolarHBondContact O-N 3.29Å; Y342-L344 VanDerWaalsContact C-N 3.32Å; Y342-L344 PolarHBondContact O-N 3.31Å; L344-S347 PolarHBondContact O-OG 2.88Å; L344-S347 VanDerWaalsContact O-OG 3.05Å; L344-S348 WeakPolarHBondContact O-CB 3.41Å; L344-S348 PolarHBondContact O-N 2.89Å; L344-S348 VanDerWaalsContact O-N 3.11Å
345	L	93.5	Very high	92.4	Very high	15 Å²	15	67.5 Å²	67.5	8%	0.079	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-48.2	172.8	174.5	71	0	0	0	110.8	Y301 F304 R341 Y342 R343 S347 S348 L349	Y301-L345 HydrophobicContact CD1-CD1 4.27Å; Y301-L345 HydrophobicContact CD1-CD2 3.86Å; Y301-L345 HydrophobicContact CE1-CD2 3.95Å; F304-L345 HydrophobicContact CB-CD1 4.4Å; F304-L345 HydrophobicContact CB-CD2 3.87Å; F304-L345 HydrophobicContact CD1-CD2 4.18Å; F304-L345 HydrophobicContact CD2-CB 4.36Å; F304-L345 HydrophobicContact CD2-CD2 4.04Å; F304-L345 HydrophobicContact CG-CD2 3.75Å; R341-L345 PolarHBondContact O-N 3.09Å; R341-L345 VanDerWaalsContact O-N 3.12Å; Y342-L345 HydrophobicContact CD2-CD2 4.27Å; Y342-L345 HydrophobicContact CE2-CD2 4.44Å; Y342-L345 WeakPolarHBondContact O-CB 3.46Å; Y342-L345 PolarHBondContact O-N 3.26Å; Y342-L345 VanDerWaalsContact O-N 3.17Å; R343-L345 VanDerWaalsContact C-N 3.34Å; L345-S347 PolarHBondContact O-N 2.97Å; L345-S348 PolarHBondContact O-N 3.1Å; L345-L349 HydrophobicContact CD1-CD1 3.88Å; L345-L349 HydrophobicContact CD1-CG 4.04Å; L345-L349 HydrophobicContact CD2-CD1 4.42Å; L345-L349 HydrophobicContact CG-CD1 3.79Å; L345-L349 HydrophobicContact CG-CG 4.3Å; L345-L349 WeakPolarHBondContact O-CB 3.21Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 2.99Å
346	Q	92.3	Very high	92.2	Very high	74 Å²	74	67 Å²	67	35%	0.346	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-44.7	-179.8	-71.3	-175.7	-58.7	0	0	112.5	Y342 R343 L349 E350	Y342-Q346 HydrophobicContact CD1-CG 4.26Å; Y342-Q346 HydrophobicContact CE1-CG 3.85Å; Y342-Q346 HydrophobicContact CE2-CG 4.48Å; Y342-Q346 WeakPolarHBondContact O-CG 3.3Å; Y342-Q346 PolarHBondContact O-N 3.45Å; R343-Q346 PolarHBondContact O-N 3.44Å; Q346-L349 PolarHBondContact O-N 3.44Å; Q346-E350 WeakPolarHBondContact O-CB 3.39Å; Q346-E350 PolarHBondContact O-N 3.18Å
347	S	91.7	Very high	92.1	Very high	63 Å²	63	59.8 Å²	59.8	44%	0.441	30%	0.295	S	S	.	.	H	α-helix	trans	-66.4	-40.2	178.6	65.4	0	0	0	0	112.3	R343 L344 L345 E350 I351	R343-S347 PolarHBondContact O-N 3.04Å; R343-S347 PolarHBondContact O-OG 3.29Å; L344-S347 PolarHBondContact O-OG 2.88Å; L344-S347 VanDerWaalsContact O-OG 3.05Å; L345-S347 PolarHBondContact O-N 2.97Å; S347-E350 PolarHBondContact O-N 2.92Å; S347-I351 WeakPolarHBondContact O-CG1 3.29Å; S347-I351 PolarHBondContact O-N 3.26Å; S347-I351 VanDerWaalsContact O-N 3.17Å
348	S	91.3	Very high	91.9	Very high	49 Å²	49	62.9 Å²	62.9	34%	0.343	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-46.8	174.8	-178.1	0	0	0	0	111.7	L344 L345 E350 I351 Q352	L344-S348 WeakPolarHBondContact O-CB 3.41Å; L344-S348 PolarHBondContact O-N 2.89Å; L344-S348 VanDerWaalsContact O-N 3.11Å; L345-S348 PolarHBondContact O-N 3.1Å; S348-E350 PolarHBondContact O-N 3.12Å; S348-I351 PolarHBondContact O-N 3.29Å; S348-Q352 WeakPolarHBondContact O-CG 3.48Å; S348-Q352 PolarHBondContact O-N 3.35Å
349	L	91.8	Very high	91.6	Very high	3 Å²	3	63.9 Å²	63.9	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-64.5	-39.3	178.7	-69.9	174.6	0	0	0	111.7	W297 Y301 L345 Q346 I351 Q352 R353	W297-L349 HydrophobicContact CD2-CD2 3.64Å; W297-L349 HydrophobicContact CE3-CD2 3.67Å; W297-L349 HydrophobicContact CG-CD2 4.24Å; W297-L349 HydrophobicContact CH2-CB 3.85Å; W297-L349 HydrophobicContact CH2-CD2 4.01Å; W297-L349 HydrophobicContact CH2-CG 4.4Å; W297-L349 HydrophobicContact CZ2-CB 4.42Å; W297-L349 HydrophobicContact CZ2-CD1 4.5Å; W297-L349 HydrophobicContact CZ2-CD2 3.98Å; W297-L349 HydrophobicContact CZ3-CB 3.99Å; W297-L349 HydrophobicContact CZ3-CD2 3.87Å; W297-L349 WeakPolarHBondContact CZ3-O 3.09Å; Y301-L349 HydrophobicContact CD1-CD1 4.26Å; Y301-L349 HydrophobicContact CE1-CD1 3.42Å; Y301-L349 VanDerWaalsContact CE1-CD1 3.42Å; Y301-L349 HydrophobicContact CE2-CD1 4.43Å; Y301-L349 VanDerWaalsContact CZ-CD1 3.5Å; Y301-L349 WeakPolarHBondContact OH-CD1 3.45Å; L345-L349 HydrophobicContact CD1-CD1 3.88Å; L345-L349 HydrophobicContact CD1-CG 4.04Å; L345-L349 HydrophobicContact CD2-CD1 4.42Å; L345-L349 HydrophobicContact CG-CD1 3.79Å; L345-L349 HydrophobicContact CG-CG 4.3Å; L345-L349 WeakPolarHBondContact O-CB 3.21Å; L345-L349 VanDerWaalsContact O-CG 3.26Å; L345-L349 WeakPolarHBondContact O-CG 3.47Å; L345-L349 PolarHBondContact O-N 2.99Å; Q346-L349 PolarHBondContact O-N 3.44Å; L349-I351 VanDerWaalsContact C-N 3.33Å; L349-I351 PolarHBondContact O-N 3.31Å; L349-Q352 CarbonylContact O-C 3.56Å; L349-Q352 PolarHBondContact O-N 2.04Å; L349-Q352 VanDerWaalsContact O-N 3.16Å; L349-R353 WeakPolarHBondContact O-CB 3.31Å; L349-R353 PolarHBondContact O-N 3.46Å
350	E	91.3	Very high	91.4	Very high	72 Å²	72	62.7 Å²	62.7	34%	0.336	30%	0.302	S	S	.	.	H	α-helix	trans	-62.4	-41.8	177.1	-176.4	56.2	-160.3	0	0	111.7	Q346 S347 S348 Q352 R353 L354	Q346-E350 WeakPolarHBondContact O-CB 3.39Å; Q346-E350 PolarHBondContact O-N 3.18Å; S347-E350 PolarHBondContact O-N 2.92Å; S348-E350 PolarHBondContact O-N 3.12Å; E350-Q352 PolarHBondContact O-N 2.84Å; E350-R353 WeakPolarHBondContact O-CB 3.07Å; E350-R353 PolarHBondContact O-N 3.23Å; E350-R353 IonicContact OE1-CZ 3.86Å; E350-R353 IonicContact OE1-NE 3.19Å; E350-R353 PolarHBondContact OE1-NE 2.94Å; E350-R353 IonicContact OE1-NH2 3.32Å; E350-R353 PolarHBondContact OE1-NH2 2.73Å; E350-R353 IonicContact OE2-CZ 3.6Å; E350-R353 IonicContact OE2-NE 3.05Å; E350-R353 PolarHBondContact OE2-NE 3.43Å; E350-R353 IonicContact OE2-NH2 2.88Å; E350-R353 PolarHBondContact OE2-NH2 3.18Å; E350-L354 WeakPolarHBondContact O-CG 3.43Å; E350-L354 PolarHBondContact O-N 3.02Å
351	I	90.6	Very high	91.1	Very high	95 Å²	95	68.6 Å²	68.6	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-62.1	-44.1	173.6	-65.9	165	0	0	0	110.7	S347 S348 L349 K355	S347-I351 WeakPolarHBondContact O-CG1 3.29Å; S347-I351 PolarHBondContact O-N 3.26Å; S347-I351 VanDerWaalsContact O-N 3.17Å; S348-I351 PolarHBondContact O-N 3.29Å; L349-I351 VanDerWaalsContact C-N 3.33Å; L349-I351 PolarHBondContact O-N 3.31Å; I351-K355 HydrophobicContact CG2-CD 4.38Å; I351-K355 WeakPolarHBondContact O-CG 3.03Å; I351-K355 PolarHBondContact O-N 3.46Å; I351-K355 VanDerWaalsContact O-N 3.15Å
352	Q	90.1	Very high	90.6	Very high	32 Å²	32	70.1 Å²	70.1	15%	0.15	32%	0.322	C	S	.	.	H	α-helix	trans	-64.5	-41.8	177.1	-70.3	-148	-32.3	0	0	112.1	S296 W297 S348 L349 E350 L354 K355 I356	S296-Q352 PolarHBondContact OG-NE2 3.37Å; W297-Q352 HydrophobicContact CE3-CB 3.98Å; W297-Q352 HydrophobicContact CZ3-CB 4.16Å; S348-Q352 WeakPolarHBondContact O-CG 3.48Å; S348-Q352 PolarHBondContact O-N 3.35Å; L349-Q352 CarbonylContact O-C 3.56Å; L349-Q352 PolarHBondContact O-N 2.04Å; L349-Q352 VanDerWaalsContact O-N 3.16Å; E350-Q352 PolarHBondContact O-N 2.84Å; Q352-L354 PolarHBondContact O-N 2.82Å; Q352-K355 WeakPolarHBondContact O-CB 3.34Å; Q352-K355 PolarHBondContact O-N 3.07Å; Q352-K355 VanDerWaalsContact O-N 3.11Å; Q352-I356 WeakPolarHBondContact O-CG1 3.24Å; Q352-I356 PolarHBondContact O-N 3.27Å
353	R	90.4	Very high	90.2	Very high	80 Å²	80	69.6 Å²	69.6	30%	0.302	32%	0.32	S	S	.	.	H	α-helix	trans	-57.7	-48.4	178	-171.3	-176.3	75.5	97.8	3.9	111	W297 L349 E350 K355 I356 Q357 M378	W297-R353 HydrophobicContact CH2-CB 4.25Å; W297-R353 HydrophobicContact CZ3-CB 3.97Å; L349-R353 WeakPolarHBondContact O-CB 3.31Å; L349-R353 PolarHBondContact O-N 3.46Å; E350-R353 WeakPolarHBondContact O-CB 3.07Å; E350-R353 PolarHBondContact O-N 3.23Å; E350-R353 IonicContact OE1-CZ 3.86Å; E350-R353 IonicContact OE1-NE 3.19Å; E350-R353 PolarHBondContact OE1-NE 2.94Å; E350-R353 IonicContact OE1-NH2 3.32Å; E350-R353 PolarHBondContact OE1-NH2 2.73Å; E350-R353 IonicContact OE2-CZ 3.6Å; E350-R353 IonicContact OE2-NE 3.05Å; E350-R353 PolarHBondContact OE2-NE 3.43Å; E350-R353 IonicContact OE2-NH2 2.88Å; E350-R353 PolarHBondContact OE2-NH2 3.18Å; R353-K355 VanDerWaalsContact C-N 3.31Å; R353-K355 PolarHBondContact O-N 2.97Å; R353-I356 PolarHBondContact O-N 2.95Å; R353-Q357 VanDerWaalsContact NH1-NE2 3.15Å; R353-Q357 WeakPolarHBondContact O-CG 3.27Å; R353-Q357 PolarHBondContact O-N 2.93Å; R353-M378 HydrophobicContact CG-CE 4.21Å
354	L	91.1	Very high	89.7	Confident	64 Å²	64	67.3 Å²	67.3	34%	0.335	31%	0.314	S	S	.	.	H	α-helix	trans	-61.7	-38.8	177.1	-69.7	172.4	0	0	0	111.8	E350 Q352 R358	E350-L354 WeakPolarHBondContact O-CG 3.43Å; E350-L354 PolarHBondContact O-N 3.02Å; Q352-L354 PolarHBondContact O-N 2.82Å; L354-R358 VanDerWaalsContact O-CG 3.22Å; L354-R358 WeakPolarHBondContact O-CG 3.32Å; L354-R358 PolarHBondContact O-N 3.42Å; L354-R358 VanDerWaalsContact O-N 3.08Å
355	K	90.9	Very high	89.1	Confident	112 Å²	112	65.5 Å²	65.5	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-46.4	175.2	-69.1	174.6	180	177	0	111.6	M293 I351 Q352 R353 Q357 R358 T359	M293-K355 HydrophobicContact CE-CB 3.32Å; M293-K355 HydrophobicContact CE-CD 4.47Å; I351-K355 HydrophobicContact CG2-CD 4.38Å; I351-K355 WeakPolarHBondContact O-CG 3.03Å; I351-K355 PolarHBondContact O-N 3.46Å; I351-K355 VanDerWaalsContact O-N 3.15Å; Q352-K355 WeakPolarHBondContact O-CB 3.34Å; Q352-K355 PolarHBondContact O-N 3.07Å; Q352-K355 VanDerWaalsContact O-N 3.11Å; R353-K355 VanDerWaalsContact C-N 3.31Å; R353-K355 PolarHBondContact O-N 2.97Å; K355-Q357 VanDerWaalsContact C-N 3.35Å; K355-Q357 PolarHBondContact O-N 3.4Å; K355-R358 PolarHBondContact O-N 3.41Å; K355-T359 PolarHBondContact O-N 3.24Å; K355-T359 PolarHBondContact O-OG1 3.33Å; K355-T359 VanDerWaalsContact O-OG1 3.09Å
356	I	90.7	Very high	88.2	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-45.9	178.6	-66.9	172.8	0	0	0	110	L290 M293 W297 Q352 R353 R358 T359 A360 M378 P379	L290-I356 HydrophobicContact CD2-CG2 3.94Å; M293-I356 HydrophobicContact CB-CD1 4.22Å; M293-I356 HydrophobicContact CB-CG1 3.92Å; M293-I356 HydrophobicContact CE-CB 4.49Å; M293-I356 HydrophobicContact CE-CG1 3.64Å; M293-I356 HydrophobicContact SD-CG1 4.19Å; W297-I356 HydrophobicContact CE3-CD1 4.28Å; Q352-I356 WeakPolarHBondContact O-CG1 3.24Å; Q352-I356 PolarHBondContact O-N 3.27Å; R353-I356 PolarHBondContact O-N 2.95Å; I356-R358 VanDerWaalsContact C-N 3.34Å; I356-R358 PolarHBondContact O-N 3.47Å; I356-T359 PolarHBondContact O-N 3.12Å; I356-A360 VanDerWaalsContact O-CB 3.32Å; I356-A360 WeakPolarHBondContact O-CB 3.26Å; I356-A360 PolarHBondContact O-N 3Å; I356-M378 HydrophobicContact CG2-CE 4.34Å; I356-M378 HydrophobicContact CG2-SD 3.65Å; I356-P379 HydrophobicContact CD1-CG 3.95Å
357	Q	89.7	Confident	87.4	Confident	47 Å²	47	63.9 Å²	63.9	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-42.9	176.4	-74.1	178.9	-10.2	0	0	112.6	R353 K355 R361 M378	R353-Q357 VanDerWaalsContact NH1-NE2 3.15Å; R353-Q357 WeakPolarHBondContact O-CG 3.27Å; R353-Q357 PolarHBondContact O-N 2.93Å; K355-Q357 VanDerWaalsContact C-N 3.35Å; K355-Q357 PolarHBondContact O-N 3.4Å; Q357-R361 WeakPolarHBondContact O-CB 3.33Å; Q357-R361 VanDerWaalsContact O-CG 3.26Å; Q357-R361 WeakPolarHBondContact O-CG 3.37Å; Q357-R361 PolarHBondContact O-N 3.39Å; Q357-M378 HydrophobicContact CG-CE 3.42Å; Q357-M378 VanDerWaalsContact CG-CE 3.42Å; Q357-M378 HydrophobicContact CG-SD 4.28Å
358	R	89.8	Confident	86.4	Confident	165 Å²	165	67.6 Å²	67.6	62%	0.623	32%	0.319	S	S	*	.	H	α-helix	trans	-64.1	-44.4	177.4	-72.4	171.2	-169.9	-178.8	3.9	111.3	L354 K355 I356 R361 K362	L354-R358 VanDerWaalsContact O-CG 3.22Å; L354-R358 WeakPolarHBondContact O-CG 3.32Å; L354-R358 PolarHBondContact O-N 3.42Å; L354-R358 VanDerWaalsContact O-N 3.08Å; K355-R358 PolarHBondContact O-N 3.41Å; I356-R358 VanDerWaalsContact C-N 3.34Å; I356-R358 PolarHBondContact O-N 3.47Å; R358-R361 PolarHBondContact O-N 3.49Å; R358-K362 WeakPolarHBondContact O-CG 3.35Å; R358-K362 PolarHBondContact O-N 2.91Å; R358-K362 VanDerWaalsContact O-N 3.14Å
359	T	88	Confident	85.3	Confident	22 Å²	22	73 Å²	73	14%	0.135	33%	0.332	C	S	.	.	H	α-helix	trans	-67.3	-43.4	178.8	-54.8	0	0	0	0	111.7	M286 T289 L290 K355 I356 R361 K362 L363	M286-T359 HydrophobicContact SD-CG2 3.91Å; T289-T359 HydrophobicContact CG2-CG2 4.47Å; L290-T359 HydrophobicContact CD2-CG2 3.85Å; L290-T359 HydrophobicContact CG-CG2 3.87Å; K355-T359 PolarHBondContact O-N 3.24Å; K355-T359 PolarHBondContact O-OG1 3.33Å; K355-T359 VanDerWaalsContact O-OG1 3.09Å; I356-T359 PolarHBondContact O-N 3.12Å; T359-R361 PolarHBondContact O-N 2.84Å; T359-K362 WeakPolarHBondContact O-CB 3.26Å; T359-K362 PolarHBondContact O-N 3.17Å; T359-K362 VanDerWaalsContact O-N 3.1Å; T359-L363 PolarHBondContact O-N 2.8Å
360	A	88.8	Confident	84.2	Confident	10 Å²	10	73.9 Å²	73.9	8%	0.083	34%	0.338	C	S	.	.	H	α-helix	trans	-60	-45	175.7	0	0	0	0	0	111.4	I356 K362 L363 F364	I356-A360 VanDerWaalsContact O-CB 3.32Å; I356-A360 WeakPolarHBondContact O-CB 3.26Å; I356-A360 PolarHBondContact O-N 3Å; A360-K362 VanDerWaalsContact C-N 3.28Å; A360-K362 PolarHBondContact O-N 2.83Å; A360-L363 WeakPolarHBondContact O-CB 3.37Å; A360-L363 PolarHBondContact O-N 2.91Å; A360-L363 VanDerWaalsContact O-N 3.16Å; A360-F364 WeakPolarHBondContact O-CD2 3.37Å; A360-F364 PolarHBondContact O-N 3.13Å
361	R	86.7	Confident	83	Confident	177 Å²	177	77.5 Å²	77.5	67%	0.668	36%	0.359	S	S	*	.	H	α-helix	trans	-59.1	-37.9	174.4	-73.8	175.1	-172.1	170.9	4	112.6	Q357 R358 T359 S365	Q357-R361 WeakPolarHBondContact O-CB 3.33Å; Q357-R361 VanDerWaalsContact O-CG 3.26Å; Q357-R361 WeakPolarHBondContact O-CG 3.37Å; Q357-R361 PolarHBondContact O-N 3.39Å; R358-R361 PolarHBondContact O-N 3.49Å; T359-R361 PolarHBondContact O-N 2.84Å; R361-S365 WeakPolarHBondContact O-CB 3.07Å; R361-S365 PolarHBondContact O-N 3.34Å
362	K	84.6	Confident	82.1	Confident	122 Å²	122	76.5 Å²	76.5	53%	0.53	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-46.4	174.1	-72.5	-179.5	178.9	-170.3	0	111.4	M286 R358 T359 A360 F364 S365 L366	M286-K362 HydrophobicContact CE-CD 4.29Å; M286-K362 HydrophobicContact SD-CB 4.44Å; R358-K362 WeakPolarHBondContact O-CG 3.35Å; R358-K362 PolarHBondContact O-N 2.91Å; R358-K362 VanDerWaalsContact O-N 3.14Å; T359-K362 WeakPolarHBondContact O-CB 3.26Å; T359-K362 PolarHBondContact O-N 3.17Å; T359-K362 VanDerWaalsContact O-N 3.1Å; A360-K362 VanDerWaalsContact C-N 3.28Å; A360-K362 PolarHBondContact O-N 2.83Å; K362-F364 PolarHBondContact O-N 2.73Å; K362-S365 WeakPolarHBondContact O-CB 2.99Å; K362-S365 PolarHBondContact O-N 3.48Å; K362-L366 WeakPolarHBondContact O-CG 3.24Å; K362-L366 PolarHBondContact O-N 2.91Å
363	L	85.4	Confident	81.3	Confident	3 Å²	3	81.8 Å²	81.8	2%	0.016	38%	0.381	C	S	.	.	H	α-helix	trans	-56.1	-50.4	175.9	176.7	64	0	0	0	111.3	I283 M286 E287 L290 T359 A360 S365 L366 S367 P374	I283-L363 HydrophobicContact CB-CD1 4.33Å; I283-L363 HydrophobicContact CG1-CD1 4.38Å; I283-L363 HydrophobicContact CG2-CD1 3.87Å; M286-L363 HydrophobicContact CB-CB 4.24Å; M286-L363 HydrophobicContact CB-CD1 4.09Å; E287-L363 HydrophobicContact CG-CD1 4Å; E287-L363 HydrophobicContact CG-CD2 3.99Å; L290-L363 HydrophobicContact CD1-CD2 3.71Å; T359-L363 PolarHBondContact O-N 2.8Å; A360-L363 WeakPolarHBondContact O-CB 3.37Å; A360-L363 PolarHBondContact O-N 2.91Å; A360-L363 VanDerWaalsContact O-N 3.16Å; L363-S365 VanDerWaalsContact C-N 3.33Å; L363-S365 PolarHBondContact O-N 3.05Å; L363-L366 PolarHBondContact O-N 3.39Å; L363-S367 PolarHBondContact O-N 3.41Å; L363-S367 PolarHBondContact O-OG 2.88Å; L363-P374 HydrophobicContact CD1-CB 4.25Å; L363-P374 HydrophobicContact CD2-CB 3.64Å; L363-P374 HydrophobicContact CD2-CG 4.47Å; L363-P374 HydrophobicContact CG-CB 3.76Å; L363-P374 HydrophobicContact CG-CG 4.15Å
364	F	82.9	Confident	80.6	Confident	96 Å²	96	78.3 Å²	78.3	42%	0.421	37%	0.369	S	S	.	.	H	α-helix	trans	-59.3	-44.5	176.2	-76.7	-68.4	0	0	0	111.5	A360 K362 L366 S367 I368 P374	A360-F364 WeakPolarHBondContact O-CD2 3.37Å; A360-F364 PolarHBondContact O-N 3.13Å; K362-F364 PolarHBondContact O-N 2.73Å; F364-L366 VanDerWaalsContact C-N 3.3Å; F364-L366 PolarHBondContact O-N 3.31Å; F364-S367 VanDerWaalsContact CA-OG 3.3Å; F364-S367 WeakPolarHBondContact CA-OG 3.25Å; F364-S367 PolarHBondContact O-N 3.15Å; F364-S367 VanDerWaalsContact O-N 3.15Å; F364-S367 PolarHBondContact O-OG 3.5Å; F364-I368 WeakPolarHBondContact O-CG1 3.39Å; F364-I368 PolarHBondContact O-N 3.23Å; F364-I368 VanDerWaalsContact O-N 3.13Å; F364-P374 HydrophobicContact CD1-CG 3.76Å; F364-P374 HydrophobicContact CE1-CG 3.76Å
365	S	78.9	Confident	79.9	Confident	73 Å²	73	81 Å²	81	51%	0.51	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-34.9	177.9	-174.3	0	0	0	0	113.7	R361 K362 L363	R361-S365 WeakPolarHBondContact O-CB 3.07Å; R361-S365 PolarHBondContact O-N 3.34Å; K362-S365 WeakPolarHBondContact O-CB 2.99Å; K362-S365 PolarHBondContact O-N 3.48Å; L363-S365 VanDerWaalsContact C-N 3.33Å; L363-S365 PolarHBondContact O-N 3.05Å
366	L	75.6	Confident	79.3	Confident	44 Å²	44	78.4 Å²	78.4	23%	0.23	38%	0.383	C	S	.	.	H	α-helix	trans	-72	-39.1	175.3	-70.3	169.2	0	0	0	110.9	P279 D282 I283 M286 K362 L363 F364 I368	P279-L366 HydrophobicContact CG-CB 4.28Å; P279-L366 HydrophobicContact CG-CD2 4.01Å; D282-L366 HydrophobicContact CB-CD1 4Å; I283-L366 HydrophobicContact CG1-CB 4.1Å; M286-L366 HydrophobicContact CG-CD1 4.14Å; K362-L366 WeakPolarHBondContact O-CG 3.24Å; K362-L366 PolarHBondContact O-N 2.91Å; L363-L366 PolarHBondContact O-N 3.39Å; F364-L366 VanDerWaalsContact C-N 3.3Å; F364-L366 PolarHBondContact O-N 3.31Å; L366-I368 VanDerWaalsContact C-N 3.32Å; L366-I368 PolarHBondContact O-N 2.89Å
367	S	75.6	Confident	78.9	Confident	11 Å²	11	85.5 Å²	85.5	8%	0.077	42%	0.416	C	S	.	.	H	α-helix	trans	-71.8	-18	-179.1	65.7	0	0	0	0	114.8	L363 F364 R369 C370 P374	L363-S367 PolarHBondContact O-N 3.41Å; L363-S367 PolarHBondContact O-OG 2.88Å; F364-S367 VanDerWaalsContact CA-OG 3.3Å; F364-S367 WeakPolarHBondContact CA-OG 3.25Å; F364-S367 PolarHBondContact O-N 3.15Å; F364-S367 VanDerWaalsContact O-N 3.15Å; F364-S367 PolarHBondContact O-OG 3.5Å; S367-R369 PolarHBondContact O-N 2.99Å; S367-C370 PolarHBondContact O-N 2.85Å; S367-C370 VanDerWaalsContact O-O 3.04Å; S367-P374 WeakPolarHBondContact OG-CG 3.46Å
368	I	71.3	Confident	78.5	Confident	140 Å²	140	86.7 Å²	86.7	72%	0.718	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-29	176.8	-72.1	167.4	0	0	0	112.1	F364 L366 C370	F364-I368 WeakPolarHBondContact O-CG1 3.39Å; F364-I368 PolarHBondContact O-N 3.23Å; F364-I368 VanDerWaalsContact O-N 3.13Å; L366-I368 VanDerWaalsContact C-N 3.32Å; L366-I368 PolarHBondContact O-N 2.89Å; I368-C370 VanDerWaalsContact C-N 3.35Å
369	R	66.5	Low	78.2	Confident	163 Å²	163	80.2 Å²	80.2	62%	0.615	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	0.9	-178.5	-61.6	-177.8	-174.3	-178.1	1.3	113.4	S367	S367-R369 PolarHBondContact O-N 2.99Å
370	C	68.7	Low	78	Confident	22 Å²	22	89 Å²	89	15%	0.149	43%	0.432	C	S	.	.	S	Bend	trans	-123	162.1	-175	-51.4	0	0	0	0	111.3	C278 S367 I368 H372	C278-C370 WeakPolarHBondContact CA-SG 2.99Å; C278-C370 HydrophobicContact CB-CB 3.85Å; C278-C370 WeakPolarHBondContact CB-SG 3.49Å; C278-C370 WeakPolarHBondContact SG-CB 3Å; C278-C370 CovalentContact SG-SG 2.04Å; C278-C370 PolarHBondContact SG-SG 2.91Å; S367-C370 PolarHBondContact O-N 2.85Å; S367-C370 VanDerWaalsContact O-O 3.04Å; I368-C370 VanDerWaalsContact C-N 3.35Å; C370-H372 HydrophobicContact CB-CB 3.87Å; C370-H372 PolarHBondContact O-N 2.95Å
371	L	66.3	Low	77.8	Confident	148 Å²	148	93 Å²	93	78%	0.775	45%	0.449	S	S	*	.	S	Bend	trans	-78.8	2.4	162.3	-66.1	164.8	0	0	0	112.5	N373	L371-N373 PolarHBondContact O-N 3.18Å
372	H	72.9	Confident	77.8	Confident	74 Å²	74	89 Å²	89	34%	0.343	43%	0.434	S	S	.	.			trans	-72.8	123.1	179.4	-170.9	65.3	0	0	0	110.4	I283 E287 C370 P374	I283-H372 VanDerWaalsContact CG2-CD2 3.49Å; I283-H372 WeakPolarHBondContact CG2-CD2 3.18Å; E287-H372 IonicContact OE1-CD2 3.41Å; E287-H372 IonicContact OE1-CE1 3.45Å; E287-H372 IonicContact OE1-NE2 3.48Å; E287-H372 PolarHBondContact OE1-NE2 2.9Å; C370-H372 HydrophobicContact CB-CB 3.87Å; C370-H372 PolarHBondContact O-N 2.95Å; H372-P374 WeakPolarHBondContact O-CD 3.2Å
373	N	72.7	Confident	78	Confident	143 Å²	143	85.8 Å²	85.8	77%	0.765	43%	0.427	S	S	*	.			trans	-104.3	95.1	178	-171.7	10.1	0	0	0	110	L371 S375	L371-N373 PolarHBondContact O-N 3.18Å; N373-S375 PolarHBondContact O-N 3.41Å
374	P	75.9	Confident	78.2	Confident	7 Å²	7	87.7 Å²	87.7	5%	0.045	44%	0.439	C	S	.	.			trans	-69.8	117.9	-177.7	26.3	-32.8	0	0	0	111.2	L363 F364 S367 H372	L363-P374 HydrophobicContact CD1-CB 4.25Å; L363-P374 HydrophobicContact CD2-CB 3.64Å; L363-P374 HydrophobicContact CD2-CG 4.47Å; L363-P374 HydrophobicContact CG-CB 3.76Å; L363-P374 HydrophobicContact CG-CG 4.15Å; F364-P374 HydrophobicContact CD1-CG 3.76Å; F364-P374 HydrophobicContact CE1-CG 3.76Å; S367-P374 WeakPolarHBondContact OG-CG 3.46Å; H372-P374 WeakPolarHBondContact O-CD 3.2Å
375	S	75.9	Confident	78.5	Confident	121 Å²	121	87.7 Å²	87.7	85%	0.846	44%	0.441	S	S	*	.			trans	-95.4	106.2	173	64.8	0	0	0	0	110.7	N373	N373-S375 PolarHBondContact O-N 3.41Å
376	H	78.9	Confident	79.1	Confident	56 Å²	56	89 Å²	89	26%	0.259	44%	0.439	S	S	.	.			trans	-129.8	126.2	173.4	-177.3	65.8	0	0	0	111.4
377	Q	82.1	Confident	79.9	Confident	151 Å²	151	86.9 Å²	86.9	71%	0.706	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-97	124.7	174.2	-170	175.5	22.1	0	0	110
378	M	80.9	Confident	80.7	Confident	72 Å²	72	86.6 Å²	86.6	36%	0.355	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-61.9	133.3	175.1	-77.5	-68.7	-74.5	0	0	110.7	R353 I356 Q357 R380	R353-M378 HydrophobicContact CG-CE 4.21Å; I356-M378 HydrophobicContact CG2-CE 4.34Å; I356-M378 HydrophobicContact CG2-SD 3.65Å; Q357-M378 HydrophobicContact CG-CE 3.42Å; Q357-M378 VanDerWaalsContact CG-CE 3.42Å; Q357-M378 HydrophobicContact CG-SD 4.28Å; M378-R380 PolarHBondContact O-N 3.21Å
379	P	83.3	Confident	81.7	Confident	29 Å²	29	82.4 Å²	82.4	19%	0.188	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-57.3	134.7	173.1	-22.8	32.5	0	0	0	110.9	W297 I356	W297-P379 HydrophobicContact CD2-CB 3.86Å; W297-P379 HydrophobicContact CD2-CG 4.4Å; W297-P379 HydrophobicContact CG-CB 3.91Å; W297-P379 HydrophobicContact CG-CG 4.37Å; W297-P379 HydrophobicContact CZ2-CB 4.38Å; I356-P379 HydrophobicContact CD1-CG 3.95Å
380	R	84.1	Confident	82.8	Confident	206 Å²	206	77.7 Å²	77.7	78%	0.777	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-85	130.1	176.2	-70.4	-175.8	178.5	179.4	-0.4	110.1	M378	M378-R380 PolarHBondContact O-N 3.21Å
381	E	84.5	Confident	84	Confident	95 Å²	95	76.6 Å²	76.6	44%	0.444	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-72.4	136.3	173	-166.7	-178.8	169.4	0	0	110.4	W297 Y301 S383	W297-E381 HydrophobicContact CZ2-CB 4.33Å; Y301-E381 WeakPolarHBondContact OH-CA 3.32Å; Y301-E381 WeakPolarHBondContact OH-CG 3.23Å; E381-S383 PolarHBondContact O-N 3.4Å
382	R	86.8	Confident	85.2	Confident	92 Å²	92	69.6 Å²	69.6	35%	0.347	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-78.1	118.7	172.5	-72.2	-174.8	179.8	175.6	2	110.2	Y301 E305	Y301-R382 HydrophobicContact CE1-CB 4.12Å; Y301-R382 HydrophobicContact CE1-CG 4.47Å; Y301-R382 HydrophobicContact CE2-CB 4.49Å; Y301-R382 HydrophobicContact CE2-CG 4.15Å; Y301-R382 PolarHBondContact OH-N 2.83Å; E305-R382 IonicContact OE2-NH1 2.68Å
383	S	89.2	Confident	86.1	Confident	55 Å²	55	66.4 Å²	66.4	39%	0.385	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-67.7	159.4	171.3	64.1	0	0	0	0	111.8	E381 M385 Q386 W387	E381-S383 PolarHBondContact O-N 3.4Å; S383-M385 PolarHBondContact O-N 3.03Å; S383-Q386 WeakPolarHBondContact O-CB 3.47Å; S383-Q386 PolarHBondContact O-N 2.04Å; S383-Q386 PolarHBondContact OG-N 3.41Å; S383-Q386 PolarHBondContact OG-OE1 2.79Å; S383-W387 PolarHBondContact O-N 3.38Å
384	V	88.9	Confident	86.9	Confident	44 Å²	44	62.3 Å²	62.3	27%	0.267	31%	0.305	S	S	.	.	H	α-helix	trans	-54.2	-40.9	172.1	178.4	0	0	0	0	110.7	Y342 Q386 W387 L388	Y342-V384 HydrophobicContact CE1-CG2 4.01Å; Y342-V384 WeakPolarHBondContact OH-CG2 3.09Å; V384-Q386 VanDerWaalsContact C-N 3.29Å; V384-Q386 PolarHBondContact O-N 2.68Å; V384-W387 CarbonylContact O-C 3.54Å; V384-W387 WeakPolarHBondContact O-CA 3.39Å; V384-W387 WeakPolarHBondContact O-CB 3.45Å; V384-W387 PolarHBondContact O-N 3.44Å; V384-L388 HydrophobicContact CG1-CD1 4.29Å; V384-L388 HydrophobicContact CG1-CG 4.23Å; V384-L388 WeakPolarHBondContact O-CG 3.4Å; V384-L388 PolarHBondContact O-N 3.04Å
385	M	90.4	Very high	87.6	Confident	95 Å²	95	63.7 Å²	63.7	47%	0.468	31%	0.311	S	S	.	.	H	α-helix	trans	-57.7	-39.8	178	-171.5	63.4	177.2	0	0	112.9	I325 S383 W387 L388 N389	I325-M385 HydrophobicContact CD1-CE 3.57Å; I325-M385 HydrophobicContact CD1-SD 4.47Å; I325-M385 HydrophobicContact CG2-CE 3.94Å; I325-M385 HydrophobicContact CG2-SD 3.8Å; S383-M385 PolarHBondContact O-N 3.03Å; M385-W387 VanDerWaalsContact C-N 3.33Å; M385-L388 PolarHBondContact O-N 3.06Å; M385-L388 HydrophobicContact SD-CD1 4.41Å; M385-N389 VanDerWaalsContact O-CG 3.29Å; M385-N389 PolarHBondContact O-N 3.39Å; M385-N389 PolarHBondContact O-ND2 2.98Å
386	Q	90.7	Very high	88.3	Confident	100 Å²	100	58.4 Å²	58.4	47%	0.467	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-33.4	175.8	-72.5	165	-37.6	0	0	112	S383 V384 R390	S383-Q386 WeakPolarHBondContact O-CB 3.47Å; S383-Q386 PolarHBondContact O-N 2.04Å; S383-Q386 PolarHBondContact OG-N 3.41Å; S383-Q386 PolarHBondContact OG-OE1 2.79Å; V384-Q386 VanDerWaalsContact C-N 3.29Å; V384-Q386 PolarHBondContact O-N 2.68Å; Q386-R390 WeakPolarHBondContact O-CB 3.42Å; Q386-R390 PolarHBondContact O-N 2.79Å
387	W	92.6	Very high	88.8	Confident	1 Å²	1	55.8 Å²	55.8	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-66.8	-41.4	170.9	-77.7	109.8	0	0	0	112.5	Y301 F304 E305 F310 W332 Y342 S383 V384 M385 N389 R390 V391	Y301-W387 AromaticContact CD1-CZ2 3.64Å; Y301-W387 HydrophobicContact CD1-CZ2 3.64Å; Y301-W387 HydrophobicContact CE1-CZ2 4.23Å; Y301-W387 HydrophobicContact CG-CZ2 4.37Å; F304-W387 HydrophobicContact CD1-CD2 4.5Å; F304-W387 HydrophobicContact CD1-CE3 4.33Å; F304-W387 AromaticContact CD1-CH2 3.57Å; F304-W387 HydrophobicContact CD1-CH2 3.57Å; F304-W387 AromaticContact CD1-CZ2 3.73Å; F304-W387 HydrophobicContact CD1-CZ2 3.73Å; F304-W387 AromaticContact CD1-CZ3 3.88Å; F304-W387 HydrophobicContact CD1-CZ3 3.88Å; F304-W387 HydrophobicContact CE1-CD2 4.22Å; F304-W387 HydrophobicContact CE1-CE3 4.14Å; F304-W387 HydrophobicContact CE1-CH2 4.18Å; F304-W387 HydrophobicContact CE1-CZ2 4.24Å; F304-W387 HydrophobicContact CE1-CZ3 4.12Å; E305-W387 HydrophobicContact CB-CH2 4.18Å; E305-W387 HydrophobicContact CB-CZ3 4.18Å; E305-W387 HydrophobicContact CG-CZ3 4.41Å; F310-W387 HydrophobicContact CE2-CE3 4.04Å; F310-W387 HydrophobicContact CE2-CZ3 4.25Å; F310-W387 HydrophobicContact CZ-CE3 4.31Å; F310-W387 HydrophobicContact CZ-CZ3 4.32Å; W332-W387 HydrophobicContact CH2-CB 4.09Å; W332-W387 HydrophobicContact CH2-CG 4.42Å; W332-W387 HydrophobicContact CZ3-CB 4.4Å; Y342-W387 AromaticContact CE2-CD1 3.93Å; Y342-W387 AromaticContact CE2-NE1 3.96Å; S383-W387 PolarHBondContact O-N 3.38Å; V384-W387 CarbonylContact O-C 3.54Å; V384-W387 WeakPolarHBondContact O-CA 3.39Å; V384-W387 WeakPolarHBondContact O-CB 3.45Å; V384-W387 PolarHBondContact O-N 3.44Å; M385-W387 VanDerWaalsContact C-N 3.33Å; W387-N389 PolarHBondContact O-N 2.77Å; W387-R390 CarbonylContact O-C 3.55Å; W387-R390 WeakPolarHBondContact O-CA 3.3Å; W387-R390 WeakPolarHBondContact O-CB 3.11Å; W387-R390 PolarHBondContact O-N 2.93Å; W387-R390 VanDerWaalsContact O-N 3.12Å; W387-V391 WeakPolarHBondContact O-CG2 3.46Å; W387-V391 PolarHBondContact O-N 2.97Å
388	L	93	Very high	89.1	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-43.1	176.1	-61.3	174.2	0	0	0	111.7	I325 V328 H329 W332 V384 M385 R390 V391 Q392	I325-L388 HydrophobicContact CG2-CD1 3.99Å; V328-L388 HydrophobicContact CB-CD2 4.37Å; V328-L388 HydrophobicContact CG1-CD2 3.84Å; H329-L388 HydrophobicContact CB-CD1 3.72Å; H329-L388 HydrophobicContact CB-CD2 4.3Å; W332-L388 HydrophobicContact CB-CD2 4.25Å; W332-L388 HydrophobicContact CD2-CD2 4.44Å; W332-L388 HydrophobicContact CE3-CD2 4.3Å; W332-L388 HydrophobicContact CG-CD2 4.4Å; V384-L388 HydrophobicContact CG1-CD1 4.29Å; V384-L388 HydrophobicContact CG1-CG 4.23Å; V384-L388 WeakPolarHBondContact O-CG 3.4Å; V384-L388 PolarHBondContact O-N 3.04Å; M385-L388 PolarHBondContact O-N 3.06Å; M385-L388 HydrophobicContact SD-CD1 4.41Å; L388-R390 VanDerWaalsContact C-N 3.26Å; L388-R390 PolarHBondContact O-N 3.32Å; L388-V391 WeakPolarHBondContact O-CB 3.49Å; L388-V391 PolarHBondContact O-N 2.72Å; L388-V391 VanDerWaalsContact O-N 3.17Å; L388-Q392 PolarHBondContact O-N 2.91Å
389	N	90.9	Very high	89.2	Confident	53 Å²	53	50.3 Å²	50.3	28%	0.283	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-37.8	173.3	-69.3	-17.7	0	0	0	111.5	I325 M385 W387 Q392 S393	I325-N389 WeakPolarHBondContact CD1-OD1 3.49Å; M385-N389 VanDerWaalsContact O-CG 3.29Å; M385-N389 PolarHBondContact O-N 3.39Å; M385-N389 PolarHBondContact O-ND2 2.98Å; W387-N389 PolarHBondContact O-N 2.77Å; N389-Q392 PolarHBondContact O-N 2.76Å; N389-S393 WeakPolarHBondContact O-CB 3.42Å; N389-S393 PolarHBondContact O-N 2.84Å; N389-S393 PolarHBondContact O-OG 2.8Å
390	R	91	Very high	88.8	Confident	63 Å²	63	55.7 Å²	55.7	24%	0.238	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-41.8	174.6	-171.4	65	171.6	176.2	1.6	111.3	E305 Q386 W387 L388 S393 F394 W403	E305-R390 IonicContact OE1-CZ 2.71Å; E305-R390 VanDerWaalsContact OE1-CZ 3.31Å; E305-R390 IonicContact OE1-NE 3.48Å; E305-R390 PolarHBondContact OE1-NE 3.13Å; E305-R390 IonicContact OE1-NH2 3.3Å; E305-R390 PolarHBondContact OE1-NH2 2.03Å; Q386-R390 WeakPolarHBondContact O-CB 3.42Å; Q386-R390 PolarHBondContact O-N 2.79Å; W387-R390 CarbonylContact O-C 3.55Å; W387-R390 WeakPolarHBondContact O-CA 3.3Å; W387-R390 WeakPolarHBondContact O-CB 3.11Å; W387-R390 PolarHBondContact O-N 2.93Å; W387-R390 VanDerWaalsContact O-N 3.12Å; L388-R390 VanDerWaalsContact C-N 3.26Å; L388-R390 PolarHBondContact O-N 3.32Å; R390-S393 WeakPolarHBondContact O-CB 3.37Å; R390-S393 PolarHBondContact O-N 2.95Å; R390-F394 HydrophobicContact CG-CD2 4.14Å; R390-F394 HydrophobicContact CG-CE2 3.84Å; R390-F394 WeakPolarHBondContact O-CD2 3.34Å; R390-F394 PolarHBondContact O-N 3.3Å; R390-W403 VanDerWaalsContact NH1-CZ3 3.33Å
391	V	92.9	Very high	88.4	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.6	-48.2	174.4	168.8	0	0	0	0	111.3	F310 F313 L314 L317 V328 W332 W387 L388 S393 F394 L395	F310-V391 HydrophobicContact CE2-CG2 4.02Å; F310-V391 HydrophobicContact CZ-CG2 3.94Å; F313-V391 HydrophobicContact CE1-CG1 4.21Å; F313-V391 HydrophobicContact CE1-CG2 4.22Å; L314-V391 HydrophobicContact CD2-CB 4.29Å; L314-V391 HydrophobicContact CD2-CG1 3.75Å; L314-V391 HydrophobicContact CD2-CG2 4.13Å; L317-V391 HydrophobicContact CD1-CG1 3.58Å; V328-V391 HydrophobicContact CG1-CB 4.22Å; V328-V391 HydrophobicContact CG1-CG1 3.64Å; W332-V391 HydrophobicContact CE3-CG2 4.38Å; W332-V391 HydrophobicContact CZ3-CG2 3.99Å; W387-V391 WeakPolarHBondContact O-CG2 3.46Å; W387-V391 PolarHBondContact O-N 2.97Å; L388-V391 WeakPolarHBondContact O-CB 3.49Å; L388-V391 PolarHBondContact O-N 2.72Å; L388-V391 VanDerWaalsContact O-N 3.17Å; V391-S393 VanDerWaalsContact C-N 3.26Å; V391-S393 PolarHBondContact O-N 2.04Å; V391-F394 WeakPolarHBondContact O-CB 3.33Å; V391-F394 PolarHBondContact O-N 2.86Å; V391-L395 HydrophobicContact CG1-CD1 4.37Å; V391-L395 WeakPolarHBondContact O-CG 3.34Å; V391-L395 PolarHBondContact O-N 2.72Å
392	Q	91.4	Very high	88.3	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-38.4	175	-79.7	-172.2	-35	0	0	112.4	L323 I325 V328 L388 N389 F394 L395 Y396 F406 E408	L323-Q392 PolarHBondContact O-NE2 3.29Å; I325-Q392 VanDerWaalsContact CG1-CD 3.48Å; I325-Q392 HydrophobicContact CG1-CG 4.47Å; I325-Q392 VanDerWaalsContact CG1-OE1 3.26Å; V328-Q392 HydrophobicContact CG2-CG 4.47Å; L388-Q392 PolarHBondContact O-N 2.91Å; N389-Q392 PolarHBondContact O-N 2.76Å; Q392-F394 VanDerWaalsContact C-N 3.31Å; Q392-F394 PolarHBondContact O-N 2.61Å; Q392-L395 PolarHBondContact O-N 2.96Å; Q392-Y396 HydrophobicContact CB-CD2 4.38Å; Q392-Y396 HydrophobicContact CG-CE2 4.43Å; Q392-Y396 WeakPolarHBondContact O-CD2 3.46Å; Q392-Y396 PolarHBondContact O-N 3.35Å; Q392-F406 HydrophobicContact CB-CB 4.21Å; Q392-F406 HydrophobicContact CB-CD1 3.92Å; Q392-F406 HydrophobicContact CB-CG 4.38Å; Q392-F406 HydrophobicContact CG-CD1 4.42Å; Q392-E408 PolarHBondContact NE2-OE2 3.04Å
393	S	91.7	Very high	88.2	Confident	6 Å²	6	49.7 Å²	49.7	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-63.3	-37.2	175	-58.5	0	0	0	0	112	N389 R390 V391 C397 G404 F406	N389-S393 WeakPolarHBondContact O-CB 3.42Å; N389-S393 PolarHBondContact O-N 2.84Å; N389-S393 PolarHBondContact O-OG 2.8Å; R390-S393 WeakPolarHBondContact O-CB 3.37Å; R390-S393 PolarHBondContact O-N 2.95Å; V391-S393 VanDerWaalsContact C-N 3.26Å; V391-S393 PolarHBondContact O-N 2.04Å; S393-C397 CarbonylContact O-C 3.5Å; S393-C397 VanDerWaalsContact O-C 3.27Å; S393-C397 VanDerWaalsContact O-CA 3.26Å; S393-C397 WeakPolarHBondContact O-CA 3.35Å; S393-C397 WeakPolarHBondContact O-CB 3.45Å; S393-C397 PolarHBondContact O-N 2.03Å; S393-G404 WeakPolarHBondContact CB-O 3.04Å; S393-F406 PolarHBondContact OG-N 3.4Å
394	F	90.4	Very high	88.1	Confident	58 Å²	58	47.1 Å²	47.1	25%	0.254	24%	0.243	S	C	.	.	H	α-helix	trans	-66.2	-36.1	172.4	-84.6	-65.8	0	0	0	113.3	E305 F310 L314 R390 V391 Q392	E305-F394 HydrophobicContact CG-CE2 4.18Å; E305-F394 HydrophobicContact CG-CZ 4.19Å; E305-F394 VanDerWaalsContact OE1-CE2 3.3Å; E305-F394 WeakPolarHBondContact OE1-CE2 3.35Å; E305-F394 WeakPolarHBondContact OE1-CZ 3.26Å; F310-F394 HydrophobicContact CE1-CD2 4.33Å; F310-F394 HydrophobicContact CE1-CE2 4.08Å; F310-F394 HydrophobicContact CZ-CD2 4.49Å; F310-F394 HydrophobicContact CZ-CE2 4.42Å; L314-F394 HydrophobicContact CD1-CB 4.28Å; L314-F394 HydrophobicContact CD1-CD2 4.24Å; L314-F394 HydrophobicContact CD1-CG 4.16Å; L314-F394 HydrophobicContact CD2-CB 4.28Å; R390-F394 HydrophobicContact CG-CD2 4.14Å; R390-F394 HydrophobicContact CG-CE2 3.84Å; R390-F394 WeakPolarHBondContact O-CD2 3.34Å; R390-F394 PolarHBondContact O-N 3.3Å; V391-F394 WeakPolarHBondContact O-CB 3.33Å; V391-F394 PolarHBondContact O-N 2.86Å; Q392-F394 VanDerWaalsContact C-N 3.31Å; Q392-F394 PolarHBondContact O-N 2.61Å
395	L	89.8	Confident	88.2	Confident	35 Å²	35	47.8 Å²	47.8	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-71.8	-44.6	179.6	-68.1	174.6	0	0	0	112.2	L317 L323 V391 Q392 R424	L317-L395 HydrophobicContact CB-CD2 4.39Å; L317-L395 HydrophobicContact CD1-CD1 4.05Å; L317-L395 HydrophobicContact CD1-CD2 4.23Å; L317-L395 HydrophobicContact CD1-CG 4.46Å; L323-L395 HydrophobicContact CD1-CD1 4.2Å; V391-L395 HydrophobicContact CG1-CD1 4.37Å; V391-L395 WeakPolarHBondContact O-CG 3.34Å; V391-L395 PolarHBondContact O-N 2.72Å; Q392-L395 PolarHBondContact O-N 2.96Å; L395-R424 WeakPolarHBondContact O-CD 3.4Å
396	Y	90.7	Very high	88.2	Confident	11 Å²	11	43.7 Å²	43.7	4%	0.043	23%	0.227	C	C	.	.	H	α-helix	trans	-113.5	-22.9	-166.5	-54.1	-51.2	0	0	0	114.5	F322 L323 Q392 F406 C413 R424 P427	F322-Y396 HydrophobicContact CD2-CE1 4.36Å; F322-Y396 AromaticContact CD2-CE2 3.92Å; F322-Y396 HydrophobicContact CD2-CE2 3.92Å; F322-Y396 AromaticContact CD2-CZ 3.71Å; F322-Y396 HydrophobicContact CE2-CD2 4.26Å; F322-Y396 AromaticContact CE2-CE2 3.6Å; F322-Y396 HydrophobicContact CE2-CE2 3.6Å; F322-Y396 AromaticContact CE2-CZ 3.9Å; L323-Y396 PolarHBondContact N-OH 3.46Å; Q392-Y396 HydrophobicContact CB-CD2 4.38Å; Q392-Y396 HydrophobicContact CG-CE2 4.43Å; Q392-Y396 WeakPolarHBondContact O-CD2 3.46Å; Q392-Y396 PolarHBondContact O-N 3.35Å; Y396-F406 AromaticContact CD2-CD1 4Å; Y396-F406 HydrophobicContact CD2-CD1 4Å; Y396-F406 HydrophobicContact CD2-CD2 4.02Å; Y396-F406 AromaticContact CD2-CE1 3.89Å; Y396-F406 HydrophobicContact CD2-CE1 3.89Å; Y396-F406 AromaticContact CD2-CE2 3.93Å; Y396-F406 HydrophobicContact CD2-CE2 3.93Å; Y396-F406 HydrophobicContact CD2-CG 4.05Å; Y396-F406 AromaticContact CD2-CZ 3.87Å; Y396-F406 HydrophobicContact CD2-CZ 3.87Å; Y396-F406 HydrophobicContact CE2-CE1 4.32Å; Y396-F406 HydrophobicContact CE2-CZ 4.44Å; Y396-F406 HydrophobicContact CG-CD2 4.25Å; Y396-F406 HydrophobicContact CG-CE2 4.14Å; Y396-F406 HydrophobicContact CG-CZ 4.45Å; Y396-C413 PolarHBondContact O-SG 3.44Å; Y396-C413 VanDerWaalsContact O-SG 3.33Å; Y396-R424 PolarHBondContact O-N 3.09Å; Y396-P427 HydrophobicContact CE1-CG 4.4Å
397	C	90.1	Very high	88.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.007	22%	0.221	C	C	.	.	S	Bend	trans	-119.6	46.1	-172.9	-51.8	0	0	0	0	112.3	S393 W403 G404 F406 C413 C422	S393-C397 CarbonylContact O-C 3.5Å; S393-C397 VanDerWaalsContact O-C 3.27Å; S393-C397 VanDerWaalsContact O-CA 3.26Å; S393-C397 WeakPolarHBondContact O-CA 3.35Å; S393-C397 WeakPolarHBondContact O-CB 3.45Å; S393-C397 PolarHBondContact O-N 2.03Å; C397-W403 CarbonylContact O-C 3.39Å; C397-W403 WeakPolarHBondContact O-CA 3.22Å; C397-G404 PolarHBondContact O-N 2.96Å; C397-F406 WeakPolarHBondContact SG-CA 3.4Å; C397-F406 VanDerWaalsContact SG-CB 3.5Å; C397-F406 PolarHBondContact SG-N 3.31Å; C397-C413 WeakPolarHBondContact CA-SG 3.39Å; C397-C413 HydrophobicContact CB-CB 3.7Å; C397-C413 WeakPolarHBondContact CB-SG 3.26Å; C397-C413 VanDerWaalsContact SG-CA 3.56Å; C397-C413 WeakPolarHBondContact SG-CB 3.3Å; C397-C413 CovalentContact SG-SG 2.02Å; C397-C413 PolarHBondContact SG-SG 3.5Å; C397-C422 CarbonylContact C-O 3.58Å; C397-C422 VanDerWaalsContact CA-O 3.26Å; C397-C422 WeakPolarHBondContact CA-O 3.31Å
398	N	87.4	Confident	88	Confident	48 Å²	48	45.1 Å²	45.1	26%	0.257	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	61.5	-179.1	-173.7	13.5	0	0	0	111.6	F402 C422 R424	N398-F402 WeakPolarHBondContact CA-O 3.45Å; N398-C422 PolarHBondContact N-O 3.08Å; N398-R424 PolarHBondContact O-NE 3.28Å; N398-R424 PolarHBondContact O-NH2 2.85Å
399	E	83.9	Confident	87.6	Confident	59 Å²	59	50.2 Å²	50.2	28%	0.276	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137.6	178.6	-161.8	167.7	-144.9	0	0	111.5	G401 F402 C422 R424	E399-G401 PolarHBondContact O-N 2.73Å; E399-F402 PolarHBondContact N-O 2.83Å; E399-F402 PolarHBondContact O-N 3.04Å; E399-C422 PolarHBondContact N-O 3.45Å; E399-R424 HydrophobicContact CB-CG 3.96Å; E399-R424 HydrophobicContact CG-CG 4.37Å
400	N	75.3	Confident	87.3	Confident	143 Å²	143	54.3 Å²	54.3	77%	0.765	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	26.2	177.1	-59.3	-34.1	0	0	0	115.6	F402	N400-F402 VanDerWaalsContact C-N 3.3Å; N400-F402 HydrophobicContact CB-CD2 4.27Å
401	G	74.5	Confident	87.1	Confident	67 Å²	67	56 Å²	56	69%	0.691	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.9	0.5	-178.7	0	0	0	0	0	114.7	E399	E399-G401 PolarHBondContact O-N 2.73Å
402	F	81.9	Confident	86.9	Confident	87 Å²	87	57.4 Å²	57.4	38%	0.382	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.5	171.2	-60.7	-70.7	0	0	0	110.5	N398 E399 N400 T417 A419 C422	N398-F402 WeakPolarHBondContact CA-O 3.45Å; E399-F402 PolarHBondContact N-O 2.83Å; E399-F402 PolarHBondContact O-N 3.04Å; N400-F402 VanDerWaalsContact C-N 3.3Å; N400-F402 HydrophobicContact CB-CD2 4.27Å; F402-T417 VanDerWaalsContact CD1-OG1 3.31Å; F402-T417 WeakPolarHBondContact CD1-OG1 3.25Å; F402-A419 HydrophobicContact CD1-CB 4.08Å; F402-A419 HydrophobicContact CD2-CB 4.44Å; F402-A419 HydrophobicContact CE1-CB 4.16Å; F402-A419 HydrophobicContact CG-CB 4.2Å; F402-A419 HydrophobicContact CZ-CB 4.39Å; F402-C422 HydrophobicContact CB-CB 3.99Å
403	W	84.7	Confident	86.9	Confident	112 Å²	112	58.3 Å²	58.3	42%	0.424	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	143	-178.7	69.6	-81.8	0	0	0	112.1	R390 C397 H416	R390-W403 VanDerWaalsContact NH1-CZ3 3.33Å; C397-W403 CarbonylContact O-C 3.39Å; C397-W403 WeakPolarHBondContact O-CA 3.22Å; W403-H416 AromaticContact CE3-CE1 3.8Å; W403-H416 AromaticContact CE3-ND1 3.49Å; W403-H416 HydrophobicContact CH2-CB 4.19Å; W403-H416 AromaticContact CH2-CD2 3.59Å; W403-H416 AromaticContact CH2-CE1 3.82Å; W403-H416 AromaticContact CH2-CG 3.58Å; W403-H416 AromaticContact CH2-ND1 3.72Å; W403-H416 AromaticContact CH2-NE2 3.74Å; W403-H416 HydrophobicContact CZ2-CB 4.06Å; W403-H416 AromaticContact CZ2-CG 3.96Å; W403-H416 AromaticContact CZ3-CD2 3.85Å; W403-H416 AromaticContact CZ3-CE1 3.24Å; W403-H416 WeakPolarHBondContact CZ3-CE1 2.96Å; W403-H416 AromaticContact CZ3-CG 3.67Å; W403-H416 AromaticContact CZ3-ND1 3.27Å; W403-H416 VanDerWaalsContact CZ3-ND1 3.27Å; W403-H416 WeakPolarHBondContact CZ3-ND1 3.37Å; W403-H416 AromaticContact CZ3-NE2 3.58Å; W403-H416 PolarHBondContact O-N 3.25Å
404	G	88.6	Confident	86.8	Confident	2 Å²	2	61.7 Å²	61.7	2%	0.021	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	-179.7	179	0	0	0	0	0	112.8	S393 C397 V414	S393-G404 WeakPolarHBondContact CB-O 3.04Å; C397-G404 PolarHBondContact O-N 2.96Å; G404-V414 CarbonylContact C-O 3.55Å; G404-V414 WeakPolarHBondContact CA-O 3.15Å
405	T	89.8	Confident	86.7	Confident	58 Å²	58	60.5 Å²	60.5	36%	0.356	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.7	168.7	6.4	0	0	0	0	109.3	C413 V414 H416	T405-C413 WeakPolarHBondContact O-CA 3.07Å; T405-V414 PolarHBondContact N-O 2.82Å; T405-V414 PolarHBondContact O-N 3.02Å; T405-H416 PolarHBondContact OG1-CE1 3.19Å
406	F	91.6	Very high	86.3	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.039	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.1	177.1	-171.8	-110.3	0	0	0	111.5	F322 Q392 S393 Y396 C397 E408 I426	F322-F406 AromaticContact CE2-CE1 3.85Å; F322-F406 HydrophobicContact CE2-CE1 3.85Å; F322-F406 AromaticContact CE2-CZ 3.69Å; F322-F406 HydrophobicContact CE2-CZ 3.69Å; F322-F406 AromaticContact CZ-CE1 4Å; F322-F406 HydrophobicContact CZ-CE1 4Å; F322-F406 HydrophobicContact CZ-CZ 4.16Å; Q392-F406 HydrophobicContact CB-CB 4.21Å; Q392-F406 HydrophobicContact CB-CD1 3.92Å; Q392-F406 HydrophobicContact CB-CG 4.38Å; Q392-F406 HydrophobicContact CG-CD1 4.42Å; S393-F406 PolarHBondContact OG-N 3.4Å; Y396-F406 AromaticContact CD2-CD1 4Å; Y396-F406 HydrophobicContact CD2-CD1 4Å; Y396-F406 HydrophobicContact CD2-CD2 4.02Å; Y396-F406 AromaticContact CD2-CE1 3.89Å; Y396-F406 HydrophobicContact CD2-CE1 3.89Å; Y396-F406 AromaticContact CD2-CE2 3.93Å; Y396-F406 HydrophobicContact CD2-CE2 3.93Å; Y396-F406 HydrophobicContact CD2-CG 4.05Å; Y396-F406 AromaticContact CD2-CZ 3.87Å; Y396-F406 HydrophobicContact CD2-CZ 3.87Å; Y396-F406 HydrophobicContact CE2-CE1 4.32Å; Y396-F406 HydrophobicContact CE2-CZ 4.44Å; Y396-F406 HydrophobicContact CG-CD2 4.25Å; Y396-F406 HydrophobicContact CG-CE2 4.14Å; Y396-F406 HydrophobicContact CG-CZ 4.45Å; C397-F406 WeakPolarHBondContact SG-CA 3.4Å; C397-F406 VanDerWaalsContact SG-CB 3.5Å; C397-F406 PolarHBondContact SG-N 3.31Å; F406-E408 HydrophobicContact CE1-CB 4.1Å; F406-I426 HydrophobicContact CE2-CD1 3.77Å; F406-I426 HydrophobicContact CE2-CG1 4.41Å; F406-I426 HydrophobicContact CZ-CD1 4.36Å
407	L	90	Very high	85.4	Confident	66 Å²	66	66.6 Å²	66.6	35%	0.346	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	106.1	172.2	-68.2	172.7	0	0	0	109.5	S409 Q410 K411 A412 V414	L407-S409 VanDerWaalsContact C-N 3.32Å; L407-S409 PolarHBondContact O-N 3.22Å; L407-Q410 HydrophobicContact CB-CB 4.47Å; L407-Q410 PolarHBondContact O-N 3.48Å; L407-K411 WeakPolarHBondContact O-CA 3.44Å; L407-K411 PolarHBondContact O-N 3.16Å; L407-A412 PolarHBondContact N-O 3.14Å; L407-A412 PolarHBondContact O-N 3.33Å; L407-V414 HydrophobicContact CD1-CG2 3.63Å; L407-V414 HydrophobicContact CG-CG2 4.27Å
408	E	87.4	Confident	84.1	Confident	64 Å²	64	70.1 Å²	70.1	30%	0.299	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-35.7	-177.7	-176	166.7	162.7	0	0	112.9	F322 P324 I325 Q392 F406 Q410 K411	F322-E408 HydrophobicContact CZ-CG 4.21Å; P324-E408 WeakPolarHBondContact CB-OE1 3.08Å; I325-E408 WeakPolarHBondContact CD1-OE2 3.43Å; I325-E408 VanDerWaalsContact CG1-OE2 3.24Å; I325-E408 WeakPolarHBondContact CG1-OE2 3.37Å; I325-E408 PolarHBondContact N-OE2 2.93Å; Q392-E408 PolarHBondContact NE2-OE2 3.04Å; F406-E408 HydrophobicContact CE1-CB 4.1Å; E408-Q410 VanDerWaalsContact C-N 3.3Å; E408-Q410 PolarHBondContact O-N 3.42Å; E408-K411 WeakPolarHBondContact O-CG 3.12Å; E408-K411 PolarHBondContact O-N 2.92Å
409	S	86.4	Confident	83	Confident	112 Å²	112	69.2 Å²	69.2	78%	0.783	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-35	179.8	56.2	0	0	0	0	113.5	L407	L407-S409 VanDerWaalsContact C-N 3.32Å; L407-S409 PolarHBondContact O-N 3.22Å
410	Q	84.8	Confident	82.1	Confident	139 Å²	139	73 Å²	73	65%	0.65	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-10	179.9	-63.8	178.4	4.1	0	0	112.3	L407 E408 A412	L407-Q410 HydrophobicContact CB-CB 4.47Å; L407-Q410 PolarHBondContact O-N 3.48Å; E408-Q410 VanDerWaalsContact C-N 3.3Å; E408-Q410 PolarHBondContact O-N 3.42Å; Q410-A412 VanDerWaalsContact C-N 3.25Å; Q410-A412 HydrophobicContact CB-CB 4.22Å; Q410-A412 PolarHBondContact O-N 3.1Å
411	K	86.8	Confident	82	Confident	99 Å²	99	72 Å²	72	43%	0.43	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.3	51.5	-169.2	-61	-174.7	179.6	-176.9	0	111.3	L407 E408 I426	L407-K411 WeakPolarHBondContact O-CA 3.44Å; L407-K411 PolarHBondContact O-N 3.16Å; E408-K411 WeakPolarHBondContact O-CG 3.12Å; E408-K411 PolarHBondContact O-N 2.92Å; K411-I426 HydrophobicContact CB-CD1 4.15Å; K411-I426 WeakPolarHBondContact O-CD1 3.47Å
412	A	88.7	Confident	82.6	Confident	28 Å²	28	68.8 Å²	68.8	23%	0.231	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	156.9	-175.9	0	0	0	0	0	111.3	L407 Q410	L407-A412 PolarHBondContact N-O 3.14Å; L407-A412 PolarHBondContact O-N 3.33Å; Q410-A412 VanDerWaalsContact C-N 3.25Å; Q410-A412 HydrophobicContact CB-CB 4.22Å; Q410-A412 PolarHBondContact O-N 3.1Å
413	C	89.8	Confident	82.9	Confident	21 Å²	21	67.6 Å²	67.6	14%	0.142	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.5	177.3	-65.4	0	0	0	0	111.9	Y396 C397 T405 Q423	Y396-C413 PolarHBondContact O-SG 3.44Å; Y396-C413 VanDerWaalsContact O-SG 3.33Å; C397-C413 WeakPolarHBondContact CA-SG 3.39Å; C397-C413 HydrophobicContact CB-CB 3.7Å; C397-C413 WeakPolarHBondContact CB-SG 3.26Å; C397-C413 VanDerWaalsContact SG-CA 3.56Å; C397-C413 WeakPolarHBondContact SG-CB 3.3Å; C397-C413 CovalentContact SG-SG 2.02Å; C397-C413 PolarHBondContact SG-SG 3.5Å; T405-C413 WeakPolarHBondContact O-CA 3.07Å; C413-Q423 HydrophobicContact CB-CB 3.97Å; C413-Q423 HydrophobicContact CB-CG 4.45Å
414	V	89.6	Confident	83	Confident	76 Å²	76	67.3 Å²	67.3	46%	0.461	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	112.2	167.6	-178	0	0	0	0	108.6	G404 T405 L407	G404-V414 CarbonylContact C-O 3.55Å; G404-V414 WeakPolarHBondContact CA-O 3.15Å; T405-V414 PolarHBondContact N-O 2.82Å; T405-V414 PolarHBondContact O-N 3.02Å; L407-V414 HydrophobicContact CD1-CG2 3.63Å; L407-V414 HydrophobicContact CG-CG2 4.27Å
415	C	88.1	Confident	82.9	Confident	33 Å²	33	71.3 Å²	71.3	22%	0.223	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132.8	-174.3	-49.8	0	0	0	0	111.6	C422	C415-C422 WeakPolarHBondContact CA-SG 3.31Å; C415-C422 HydrophobicContact CB-CB 3.89Å; C415-C422 WeakPolarHBondContact CB-SG 3.09Å; C415-C422 WeakPolarHBondContact SG-CB 3.49Å; C415-C422 PolarHBondContact SG-N 3.21Å; C415-C422 CovalentContact SG-SG 2.04Å; C415-C422 PolarHBondContact SG-SG 2.92Å
416	H	82.2	Confident	82.9	Confident	97 Å²	97	69.7 Å²	69.7	45%	0.449	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-22.8	-175	-69.3	78.2	0	0	0	113.6	W403 T405	W403-H416 AromaticContact CE3-CE1 3.8Å; W403-H416 AromaticContact CE3-ND1 3.49Å; W403-H416 HydrophobicContact CH2-CB 4.19Å; W403-H416 AromaticContact CH2-CD2 3.59Å; W403-H416 AromaticContact CH2-CE1 3.82Å; W403-H416 AromaticContact CH2-CG 3.58Å; W403-H416 AromaticContact CH2-ND1 3.72Å; W403-H416 AromaticContact CH2-NE2 3.74Å; W403-H416 HydrophobicContact CZ2-CB 4.06Å; W403-H416 AromaticContact CZ2-CG 3.96Å; W403-H416 AromaticContact CZ3-CD2 3.85Å; W403-H416 AromaticContact CZ3-CE1 3.24Å; W403-H416 WeakPolarHBondContact CZ3-CE1 2.96Å; W403-H416 AromaticContact CZ3-CG 3.67Å; W403-H416 AromaticContact CZ3-ND1 3.27Å; W403-H416 VanDerWaalsContact CZ3-ND1 3.27Å; W403-H416 WeakPolarHBondContact CZ3-ND1 3.37Å; W403-H416 AromaticContact CZ3-NE2 3.58Å; W403-H416 PolarHBondContact O-N 3.25Å; T405-H416 PolarHBondContact OG1-CE1 3.19Å
417	T	71.9	Confident	82.8	Confident	78 Å²	78	69.9 Å²	69.9	48%	0.479	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	16.9	-170.2	50.4	0	0	0	0	114.3	F402 A419	F402-T417 VanDerWaalsContact CD1-OG1 3.31Å; F402-T417 WeakPolarHBondContact CD1-OG1 3.25Å; T417-A419 PolarHBondContact O-N 2.96Å
418	G	63.8	Low	82.8	Confident	74 Å²	74	67.1 Å²	67.1	76%	0.763	39%	0.388	S	S	*	.	S	Bend	trans	66	1.7	179.6	0	0	0	0	0	115.4
419	A	63.3	Low	82.8	Confident	30 Å²	30	66.3 Å²	66.3	25%	0.248	39%	0.388	C	S	.	.			trans	-70.7	144.2	171.9	0	0	0	0	0	110.5	F402 T417 L421	F402-A419 HydrophobicContact CD1-CB 4.08Å; F402-A419 HydrophobicContact CD2-CB 4.44Å; F402-A419 HydrophobicContact CE1-CB 4.16Å; F402-A419 HydrophobicContact CG-CB 4.2Å; F402-A419 HydrophobicContact CZ-CB 4.39Å; T417-A419 PolarHBondContact O-N 2.96Å; A419-L421 PolarHBondContact O-N 3.39Å
420	T	64.7	Low	82.8	Confident	139 Å²	139	64.3 Å²	64.3	85%	0.853	37%	0.367	S	S	*	.	S	Bend	trans	-73.7	-22.4	-170.1	41.8	0	0	0	0	114.4
421	L	73.9	Confident	82.6	Confident	120 Å²	120	59.3 Å²	59.3	63%	0.628	35%	0.353	S	S	*	.			trans	-147.1	104.9	-179.6	-77.1	151.6	0	0	0	111.9	A419	A419-L421 PolarHBondContact O-N 3.39Å
422	C	87.1	Confident	81.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	34%	0.342	C	S	.	.			trans	-103.8	6.4	165.5	61.4	0	0	0	0	112.1	C397 N398 E399 F402 C415	C397-C422 CarbonylContact C-O 3.58Å; C397-C422 VanDerWaalsContact CA-O 3.26Å; C397-C422 WeakPolarHBondContact CA-O 3.31Å; N398-C422 PolarHBondContact N-O 3.08Å; E399-C422 PolarHBondContact N-O 3.45Å; F402-C422 HydrophobicContact CB-CB 3.99Å; C415-C422 WeakPolarHBondContact CA-SG 3.31Å; C415-C422 HydrophobicContact CB-CB 3.89Å; C415-C422 WeakPolarHBondContact CB-SG 3.09Å; C415-C422 WeakPolarHBondContact SG-CB 3.49Å; C415-C422 PolarHBondContact SG-N 3.21Å; C415-C422 CovalentContact SG-SG 2.04Å; C415-C422 PolarHBondContact SG-SG 2.92Å
423	Q	87.9	Confident	81	Confident	63 Å²	63	57.4 Å²	57.4	29%	0.294	35%	0.348	S	S	.	.			trans	-93.4	115	-168.7	178.4	169.2	-32.4	0	0	111.8	C413 I426	C413-Q423 HydrophobicContact CB-CB 3.97Å; C413-Q423 HydrophobicContact CB-CG 4.45Å; Q423-I426 HydrophobicContact CG-CD1 4.47Å
424	R	87.3	Confident	80.1	Confident	106 Å²	106	60.7 Å²	60.7	40%	0.4	36%	0.364	S	S	.	.			trans	-70.4	158.9	170	-67	-174.5	175.8	-169.8	-1	111.7	L395 Y396 N398 E399 I426	L395-R424 WeakPolarHBondContact O-CD 3.4Å; Y396-R424 PolarHBondContact O-N 3.09Å; N398-R424 PolarHBondContact O-NE 3.28Å; N398-R424 PolarHBondContact O-NH2 2.85Å; E399-R424 HydrophobicContact CB-CG 3.96Å; E399-R424 HydrophobicContact CG-CG 4.37Å; R424-I426 PolarHBondContact O-N 3.41Å
425	P	86.5	Confident	79.7	Confident	85 Å²	85	58.7 Å²	58.7	55%	0.552	35%	0.354	S	S	*	.			trans	-55.5	115.6	171.4	-22.5	32.4	0	0	0	110.6	P427 I444	P425-P427 WeakPolarHBondContact O-CD 3.39Å; P425-I444 HydrophobicContact CB-CG2 4.4Å
426	I	89.3	Confident	79.6	Confident	24 Å²	24	57.4 Å²	57.4	12%	0.123	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-79.6	122.2	-179.7	-59.1	171.1	0	0	0	107.8	F322 F406 K411 Q423 R424 S445	F322-I426 HydrophobicContact CD2-CG2 3.66Å; F322-I426 HydrophobicContact CE2-CG2 4.11Å; F406-I426 HydrophobicContact CE2-CD1 3.77Å; F406-I426 HydrophobicContact CE2-CG1 4.41Å; F406-I426 HydrophobicContact CZ-CD1 4.36Å; K411-I426 HydrophobicContact CB-CD1 4.15Å; K411-I426 WeakPolarHBondContact O-CD1 3.47Å; Q423-I426 HydrophobicContact CG-CD1 4.47Å; R424-I426 PolarHBondContact O-N 3.41Å; I426-S445 VanDerWaalsContact O-CA 3.26Å; I426-S445 WeakPolarHBondContact O-CA 3.47Å; I426-S445 VanDerWaalsContact O-CB 3.23Å; I426-S445 WeakPolarHBondContact O-CB 3.4Å
427	P	90.4	Very high	79.7	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.091	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-62.8	164.7	179.1	-25.4	36.7	0	0	0	114	H321 F322 Y396 P425 I444	H321-P427 VanDerWaalsContact C-CB 3.4Å; F322-P427 HydrophobicContact CB-CB 4.46Å; F322-P427 WeakPolarHBondContact CB-O 3.45Å; Y396-P427 HydrophobicContact CE1-CG 4.4Å; P425-P427 WeakPolarHBondContact O-CD 3.39Å; P427-I444 CarbonylContact C-O 3.36Å; P427-I444 VanDerWaalsContact CA-O 3.3Å; P427-I444 WeakPolarHBondContact CA-O 3.47Å; P427-I444 HydrophobicContact CB-CD1 4.38Å; P427-I444 HydrophobicContact CB-CG1 4.02Å; P427-I444 HydrophobicContact CB-CG2 4.37Å; P427-I444 HydrophobicContact CG-CD1 4.3Å; P427-I444 HydrophobicContact CG-CG1 4.38Å; P427-I444 HydrophobicContact CG-CG2 4.25Å
428	C	88.6	Confident	80.5	Confident	7 Å²	7	55.8 Å²	55.8	5%	0.047	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-68.6	158	174.3	93.7	0	0	0	0	111.4	F322 C436 C439 I444	F322-C428 WeakPolarHBondContact CB-O 3.24Å; F322-C428 PolarHBondContact N-O 3.41Å; C428-C436 VanDerWaalsContact CB-SG 3.54Å; C428-C436 VanDerWaalsContact SG-CB 3.54Å; C428-C436 PolarHBondContact SG-SG 2.94Å; C428-C439 VanDerWaalsContact CA-SG 3.56Å; C428-C439 HydrophobicContact CB-CB 3.92Å; C428-C439 WeakPolarHBondContact CB-SG 3.36Å; C428-C439 PolarHBondContact N-SG 2.89Å; C428-C439 PolarHBondContact O-SG 2.72Å; C428-C439 VanDerWaalsContact O-SG 3.39Å; C428-C439 WeakPolarHBondContact SG-CA 3.39Å; C428-C439 WeakPolarHBondContact SG-CB 3.49Å; C428-C439 CovalentContact SG-SG 2.02Å; C428-C439 PolarHBondContact SG-SG 3.24Å; C428-I444 PolarHBondContact N-O 3.01Å
429	V	87.9	Confident	81.8	Confident	48 Å²	48	52.6 Å²	52.6	29%	0.291	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-91.8	122.8	177.1	-175.2	0	0	0	0	109.2	F322 C436	F322-V429 HydrophobicContact CB-CG2 4.13Å; F322-V429 HydrophobicContact CD1-CG2 3.93Å; F322-V429 HydrophobicContact CG-CG2 4.29Å; V429-C436 PolarHBondContact O-N 3.11Å
430	I	85.8	Confident	83	Confident	70 Å²	70	52.5 Å²	52.5	36%	0.359	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-95.2	133.2	172.4	-62.3	179.7	0	0	0	109.1	H321 C436	H321-I430 HydrophobicContact CB-CB 4.38Å; H321-I430 HydrophobicContact CB-CD1 3.51Å; H321-I430 HydrophobicContact CB-CG1 3.74Å; I430-C436 VanDerWaalsContact CA-O 3.31Å; I430-C436 WeakPolarHBondContact CA-O 2.97Å
431	G	80.9	Confident	83.9	Confident	34 Å²	34	54.1 Å²	54.1	35%	0.351	31%	0.306	S	S	.	.	S	Bend	trans	175	-164.6	-175.9	0	0	0	0	0	112.6	C436 N451	G431-C436 PolarHBondContact N-O 3.42Å; G431-N451 PolarHBondContact O-ND2 2.99Å
432	G	71.5	Confident	84.4	Confident	19 Å²	19	53.3 Å²	53.3	20%	0.196	32%	0.317	C	S	.	.	S	Bend	trans	-79.7	170.6	171.6	0	0	0	0	0	113.9	S435	G432-S435 VanDerWaalsContact O-CB 3.22Å; G432-S435 WeakPolarHBondContact O-CB 3.36Å; G432-S435 PolarHBondContact O-N 3.33Å; G432-S435 PolarHBondContact O-OG 3.16Å
433	N	70.3	Confident	84.4	Confident	68 Å²	68	56.3 Å²	56.3	36%	0.364	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	-135.1	171.5	-46.2	19.6	0	0	0	111	S435 N451 Y454 K751	N433-S435 PolarHBondContact O-N 2.76Å; N433-N451 PolarHBondContact O-ND2 3.15Å; N433-Y454 VanDerWaalsContact C-CZ 3.45Å; N433-K751 WeakPolarHBondContact OD1-CB 3.05Å; N433-K751 VanDerWaalsContact OD1-CD 3.29Å; N433-K751 WeakPolarHBondContact OD1-CD 3.45Å
434	N	72.1	Confident	84.3	Confident	90 Å²	90	55.9 Å²	55.9	48%	0.481	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	3.3	176.8	-55	36.4	0	0	0	114	Y454 C461	N434-Y454 HydrophobicContact CB-CE1 4.32Å; N434-Y454 WeakPolarHBondContact OD1-CE1 3.5Å; N434-C461 WeakPolarHBondContact O-CB 3.21Å
435	S	79.6	Confident	84.3	Confident	34 Å²	34	53.7 Å²	53.7	24%	0.238	33%	0.333	C	S	.	.	S	Bend	trans	-73.4	157.9	174.3	-51	0	0	0	0	110.5	G432 N433 N451	G432-S435 VanDerWaalsContact O-CB 3.22Å; G432-S435 WeakPolarHBondContact O-CB 3.36Å; G432-S435 PolarHBondContact O-N 3.33Å; G432-S435 PolarHBondContact O-OG 3.16Å; N433-S435 PolarHBondContact O-N 2.76Å; S435-N451 PolarHBondContact O-ND2 3.44Å
436	C	86.1	Confident	84.4	Confident	6 Å²	6	53.7 Å²	53.7	4%	0.041	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	147.5	178.5	-42.4	0	0	0	0	110.3	C428 V429 I430 G431 C447	C428-C436 VanDerWaalsContact CB-SG 3.54Å; C428-C436 VanDerWaalsContact SG-CB 3.54Å; C428-C436 PolarHBondContact SG-SG 2.94Å; V429-C436 PolarHBondContact O-N 3.11Å; I430-C436 VanDerWaalsContact CA-O 3.31Å; I430-C436 WeakPolarHBondContact CA-O 2.97Å; G431-C436 PolarHBondContact N-O 3.42Å; C436-C447 HydrophobicContact CB-CB 3.66Å; C436-C447 WeakPolarHBondContact CB-SG 3.33Å; C436-C447 WeakPolarHBondContact SG-CA 3.42Å; C436-C447 WeakPolarHBondContact SG-CB 3.32Å; C436-C447 CovalentContact SG-SG 2.01Å; C436-C447 PolarHBondContact SG-SG 3.33Å
437	A	85.6	Confident	84.4	Confident	39 Å²	39	53.1 Å²	53.1	32%	0.322	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-36.8	164.7	0	0	0	0	0	110.4	S449	A437-S449 PolarHBondContact N-O 3.26Å
438	M	88.3	Confident	84.2	Confident	102 Å²	102	54 Å²	54	50%	0.502	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	143.3	175.6	-165.1	175.3	71.3	0	0	110.2	G448 S449	M438-G448 PolarHBondContact O-N 2.93Å; M438-S449 VanDerWaalsContact CB-OG 3.29Å; M438-S449 WeakPolarHBondContact CB-OG 3.36Å; M438-S449 PolarHBondContact N-O 3.33Å; M438-S449 PolarHBondContact N-OG 3.17Å; M438-S449 PolarHBondContact O-N 3.11Å; M438-S449 VanDerWaalsContact O-N 3.17Å
439	C	90.3	Very high	84.1	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.041	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	151.4	171.2	-55.6	0	0	0	0	111.3	T320 C428 I444	T320-C439 WeakPolarHBondContact O-CB 3.34Å; T320-C439 PolarHBondContact O-SG 3.43Å; C428-C439 VanDerWaalsContact CA-SG 3.56Å; C428-C439 HydrophobicContact CB-CB 3.92Å; C428-C439 WeakPolarHBondContact CB-SG 3.36Å; C428-C439 PolarHBondContact N-SG 2.89Å; C428-C439 PolarHBondContact O-SG 2.72Å; C428-C439 VanDerWaalsContact O-SG 3.39Å; C428-C439 WeakPolarHBondContact SG-CA 3.39Å; C428-C439 WeakPolarHBondContact SG-CB 3.49Å; C428-C439 CovalentContact SG-SG 2.02Å; C428-C439 PolarHBondContact SG-SG 3.24Å; C439-I444 HydrophobicContact CB-CG1 4.14Å
440	S	88.9	Confident	83.9	Confident	29 Å²	29	54.9 Å²	54.9	20%	0.203	34%	0.343	C	S	.	.			trans	-70.1	135.4	177.1	174.2	0	0	0	0	110.8	A442 N443 I444 Q446	S440-A442 VanDerWaalsContact C-N 3.27Å; S440-A442 PolarHBondContact O-N 3.05Å; S440-A442 PolarHBondContact OG-N 3.14Å; S440-N443 WeakPolarHBondContact CB-O 3.34Å; S440-N443 CarbonylContact O-C 3.6Å; S440-N443 PolarHBondContact OG-N 3.18Å; S440-I444 WeakPolarHBondContact O-CA 3.48Å; S440-I444 PolarHBondContact O-N 2.95Å; S440-Q446 PolarHBondContact N-O 3.36Å
441	L	84.6	Confident	83.6	Confident	173 Å²	173	53.7 Å²	53.7	91%	0.906	34%	0.337	S	S	*	.	S	Bend	trans	-68.8	-27.3	175.6	-65.2	172.5	0	0	0	112.3
442	A	83.8	Confident	83.2	Confident	103 Å²	103	58.3 Å²	58.3	85%	0.851	35%	0.348	S	S	*	.	S	Bend	trans	-82.7	-35.9	-179.6	0	0	0	0	0	112.6	S440	S440-A442 VanDerWaalsContact C-N 3.27Å; S440-A442 PolarHBondContact O-N 3.05Å; S440-A442 PolarHBondContact OG-N 3.14Å
443	N	87	Confident	82.9	Confident	62 Å²	62	57.9 Å²	57.9	33%	0.332	34%	0.344	S	S	.	.			trans	-142	100.7	174.3	-174.6	-9.3	0	0	0	109.3	S440 S445 Q446	S440-N443 WeakPolarHBondContact CB-O 3.34Å; S440-N443 CarbonylContact O-C 3.6Å; S440-N443 PolarHBondContact OG-N 3.18Å; N443-S445 VanDerWaalsContact CG-OG 3.31Å; N443-S445 PolarHBondContact ND2-OG 3.41Å; N443-S445 PolarHBondContact O-N 3.45Å; N443-S445 PolarHBondContact OD1-N 3.36Å; N443-S445 PolarHBondContact OD1-OG 3.49Å; N443-Q446 HydrophobicContact CB-CG 4.48Å; N443-Q446 PolarHBondContact O-N 3.26Å
444	I	86.6	Confident	83.1	Confident	55 Å²	55	55.7 Å²	55.7	28%	0.282	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.1	-172.4	-152.1	167.2	0	0	0	113.4	S319 P425 P427 C428 C439 S440 Q446	S319-I444 WeakPolarHBondContact O-CD1 3.32Å; P425-I444 HydrophobicContact CB-CG2 4.4Å; P427-I444 CarbonylContact C-O 3.36Å; P427-I444 VanDerWaalsContact CA-O 3.3Å; P427-I444 WeakPolarHBondContact CA-O 3.47Å; P427-I444 HydrophobicContact CB-CD1 4.38Å; P427-I444 HydrophobicContact CB-CG1 4.02Å; P427-I444 HydrophobicContact CB-CG2 4.37Å; P427-I444 HydrophobicContact CG-CD1 4.3Å; P427-I444 HydrophobicContact CG-CG1 4.38Å; P427-I444 HydrophobicContact CG-CG2 4.25Å; C428-I444 PolarHBondContact N-O 3.01Å; C439-I444 HydrophobicContact CB-CG1 4.14Å; S440-I444 WeakPolarHBondContact O-CA 3.48Å; S440-I444 PolarHBondContact O-N 2.95Å; I444-Q446 VanDerWaalsContact C-N 3.27Å; I444-Q446 PolarHBondContact O-N 3.13Å
445	S	86.7	Confident	83.4	Confident	59 Å²	59	58.5 Å²	58.5	41%	0.413	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-14.4	175.5	69.8	0	0	0	0	114.3	I426 N443	I426-S445 VanDerWaalsContact O-CA 3.26Å; I426-S445 WeakPolarHBondContact O-CA 3.47Å; I426-S445 VanDerWaalsContact O-CB 3.23Å; I426-S445 WeakPolarHBondContact O-CB 3.4Å; N443-S445 VanDerWaalsContact CG-OG 3.31Å; N443-S445 PolarHBondContact ND2-OG 3.41Å; N443-S445 PolarHBondContact O-N 3.45Å; N443-S445 PolarHBondContact OD1-N 3.36Å; N443-S445 PolarHBondContact OD1-OG 3.49Å
446	Q	88.2	Confident	83.5	Confident	86 Å²	86	60.5 Å²	60.5	40%	0.402	35%	0.346	S	S	.	.	S	Bend	trans	-107.9	152.1	-178.6	-64.3	-179.9	-7.4	0	0	111.3	S440 N443 I444	S440-Q446 PolarHBondContact N-O 3.36Å; N443-Q446 HydrophobicContact CB-CG 4.48Å; N443-Q446 PolarHBondContact O-N 3.26Å; I444-Q446 VanDerWaalsContact C-N 3.27Å; I444-Q446 PolarHBondContact O-N 3.13Å
447	C	88.6	Confident	83.1	Confident	11 Å²	11	65.9 Å²	65.9	7%	0.074	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.7	169.5	-60.8	0	0	0	0	110.1	C436 L456 G459 C461	C436-C447 HydrophobicContact CB-CB 3.66Å; C436-C447 WeakPolarHBondContact CB-SG 3.33Å; C436-C447 WeakPolarHBondContact SG-CA 3.42Å; C436-C447 WeakPolarHBondContact SG-CB 3.32Å; C436-C447 CovalentContact SG-SG 2.01Å; C436-C447 PolarHBondContact SG-SG 3.33Å; C447-L456 HydrophobicContact CB-CD1 3.54Å; C447-L456 WeakPolarHBondContact O-CD1 3.48Å; C447-G459 PolarHBondContact N-O 3.38Å; C447-C461 PolarHBondContact SG-SG 2.94Å
448	G	86.3	Confident	82.9	Confident	34 Å²	34	74 Å²	74	35%	0.351	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-32.6	168.8	0	0	0	0	0	112.3	M438	M438-G448 PolarHBondContact O-N 2.93Å
449	S	86.3	Confident	82.4	Confident	45 Å²	45	69.7 Å²	69.7	32%	0.315	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.1	173.9	65.2	0	0	0	0	111.4	A437 M438	A437-S449 PolarHBondContact N-O 3.26Å; M438-S449 VanDerWaalsContact CB-OG 3.29Å; M438-S449 WeakPolarHBondContact CB-OG 3.36Å; M438-S449 PolarHBondContact N-O 3.33Å; M438-S449 PolarHBondContact N-OG 3.17Å; M438-S449 PolarHBondContact O-N 3.11Å; M438-S449 VanDerWaalsContact O-N 3.17Å
450	C	85.1	Confident	82	Confident	28 Å²	28	78.4 Å²	78.4	19%	0.189	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	155.8	-177.4	-64.9	0	0	0	0	112.3	Y454 C461	C450-Y454 WeakPolarHBondContact CB-O 3.33Å; C450-C461 WeakPolarHBondContact CA-SG 3.26Å; C450-C461 HydrophobicContact CB-CB 3.75Å; C450-C461 WeakPolarHBondContact CB-SG 3.45Å; C450-C461 WeakPolarHBondContact SG-CA 3.22Å; C450-C461 WeakPolarHBondContact SG-CB 3.45Å; C450-C461 CovalentContact SG-SG 2.03Å; C450-C461 PolarHBondContact SG-SG 3.42Å
451	N	79.8	Confident	81.7	Confident	44 Å²	44	77.3 Å²	77.3	24%	0.235	40%	0.395	C	S	.	.			trans	-62.1	156.1	171.4	-66.2	-48.3	0	0	0	110.9	G431 N433 S435 G453 Y454	G431-N451 PolarHBondContact O-ND2 2.99Å; N433-N451 PolarHBondContact O-ND2 3.15Å; S435-N451 PolarHBondContact O-ND2 3.44Å; N451-G453 PolarHBondContact O-N 3.43Å; N451-Y454 HydrophobicContact CB-CD2 4.26Å; N451-Y454 WeakPolarHBondContact O-CB 3.48Å; N451-Y454 PolarHBondContact O-N 3.03Å
452	K	71.2	Confident	81.2	Confident	132 Å²	132	73.4 Å²	73.4	57%	0.574	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	136.9	176.9	-66.5	-178.2	-179.9	176.1	0	110.3	Y454 Y687 I749	K452-Y454 VanDerWaalsContact C-N 3.33Å; K452-Y687 HydrophobicContact CD-CD1 4.34Å; K452-I749 HydrophobicContact CB-CG2 4.28Å
453	G	65.7	Low	80.4	Confident	10 Å²	10	71.4 Å²	71.4	10%	0.103	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	0.6	-174.2	0	0	0	0	0	114.6	N451 Q464	N451-G453 PolarHBondContact O-N 3.43Å; G453-Q464 VanDerWaalsContact O-CB 3.32Å; G453-Q464 WeakPolarHBondContact O-CB 3.39Å; G453-Q464 PolarHBondContact O-N 3.47Å
454	Y	73.7	Confident	79.5	Confident	22 Å²	22	73 Å²	73	9%	0.086	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	139.4	175.6	-63.6	-97.6	0	0	0	110.6	N433 N434 C450 N451 K452 E462 P463 L750	N433-Y454 VanDerWaalsContact C-CZ 3.45Å; N434-Y454 HydrophobicContact CB-CE1 4.32Å; N434-Y454 WeakPolarHBondContact OD1-CE1 3.5Å; C450-Y454 WeakPolarHBondContact CB-O 3.33Å; N451-Y454 HydrophobicContact CB-CD2 4.26Å; N451-Y454 WeakPolarHBondContact O-CB 3.48Å; N451-Y454 PolarHBondContact O-N 3.03Å; K452-Y454 VanDerWaalsContact C-N 3.33Å; Y454-E462 CarbonylContact C-O 3.56Å; Y454-E462 WeakPolarHBondContact CA-O 3.38Å; Y454-E462 WeakPolarHBondContact CB-O 3.45Å; Y454-P463 HydrophobicContact CD1-CB 4.42Å; Y454-P463 HydrophobicContact CD1-CG 4.31Å; Y454-P463 HydrophobicContact CE1-CB 4.22Å; Y454-P463 HydrophobicContact CE1-CG 3.91Å; Y454-L750 PolarHBondContact OH-O 3.34Å
455	K	78.8	Confident	78.2	Confident	148 Å²	148	77 Å²	77	64%	0.643	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	144.3	177.1	-167.7	175.2	179.8	-178.6	0	110.1	Y457 E462	K455-Y457 PolarHBondContact O-N 3.37Å; K455-E462 PolarHBondContact N-O 2.89Å; K455-E462 PolarHBondContact O-N 3.17Å
456	L	81.8	Confident	76.8	Confident	77 Å²	77	75.9 Å²	75.9	40%	0.403	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	118.4	175.1	-170.5	73.7	0	0	0	109.6	C447	C447-L456 HydrophobicContact CB-CD1 3.54Å; C447-L456 WeakPolarHBondContact O-CD1 3.48Å
457	Y	78.8	Confident	75.5	Confident	119 Å²	119	77.5 Å²	77.5	47%	0.467	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.1	173.9	-170.8	-102.1	0	0	0	109.3	K455 G459 R460	K455-Y457 PolarHBondContact O-N 3.37Å; Y457-G459 PolarHBondContact O-N 3.35Å; Y457-G459 VanDerWaalsContact O-N 3.1Å; Y457-R460 PolarHBondContact N-O 3.03Å; Y457-R460 PolarHBondContact O-N 2.99Å; Y457-R460 VanDerWaalsContact O-O 3.13Å
458	R	80.8	Confident	74	Confident	208 Å²	208	79.5 Å²	79.5	79%	0.785	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	41	179.8	-61.1	-177.8	176.9	-174	-1.4	114.3	R460	R458-R460 VanDerWaalsContact C-N 3.33Å; R458-R460 PolarHBondContact O-N 3.3Å
459	G	78.5	Confident	72.9	Confident	13 Å²	13	85.4 Å²	85.4	13%	0.134	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	13	178.6	0	0	0	0	0	115.1	C447 Y457	C447-G459 PolarHBondContact N-O 3.38Å; Y457-G459 PolarHBondContact O-N 3.35Å; Y457-G459 VanDerWaalsContact O-N 3.1Å
460	R	81.3	Confident	71.9	Confident	189 Å²	189	90 Å²	90	71%	0.713	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.2	154.6	173.3	-63.9	-177.5	178.8	-179.1	-0.5	110.6	Y457 R458	Y457-R460 PolarHBondContact N-O 3.03Å; Y457-R460 PolarHBondContact O-N 2.99Å; Y457-R460 VanDerWaalsContact O-O 3.13Å; R458-R460 VanDerWaalsContact C-N 3.33Å; R458-R460 PolarHBondContact O-N 3.3Å
461	C	81.5	Confident	71	Confident	5 Å²	5	88.6 Å²	88.6	3%	0.034	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.6	176	-63.1	0	0	0	0	110.3	N434 C447 C450	N434-C461 WeakPolarHBondContact O-CB 3.21Å; C447-C461 PolarHBondContact SG-SG 2.94Å; C450-C461 WeakPolarHBondContact CA-SG 3.26Å; C450-C461 HydrophobicContact CB-CB 3.75Å; C450-C461 WeakPolarHBondContact CB-SG 3.45Å; C450-C461 WeakPolarHBondContact SG-CA 3.22Å; C450-C461 WeakPolarHBondContact SG-CB 3.45Å; C450-C461 CovalentContact SG-SG 2.03Å; C450-C461 PolarHBondContact SG-SG 3.42Å
462	E	75.3	Confident	70.5	Confident	91 Å²	91	89.6 Å²	89.6	43%	0.425	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	147.8	177.2	-68.6	-178.2	179	0	0	109.9	Y454 K455 Q464	Y454-E462 CarbonylContact C-O 3.56Å; Y454-E462 WeakPolarHBondContact CA-O 3.38Å; Y454-E462 WeakPolarHBondContact CB-O 3.45Å; K455-E462 PolarHBondContact N-O 2.89Å; K455-E462 PolarHBondContact O-N 3.17Å; E462-Q464 PolarHBondContact O-N 3.38Å
463	P	67.4	Low	70.6	Confident	61 Å²	61	89.1 Å²	89.1	40%	0.396	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54	136	175.3	-19.9	29.3	0	0	0	110.1	Y454 N465	Y454-P463 HydrophobicContact CD1-CB 4.42Å; Y454-P463 HydrophobicContact CD1-CG 4.31Å; Y454-P463 HydrophobicContact CE1-CB 4.22Å; Y454-P463 HydrophobicContact CE1-CG 3.91Å; P463-N465 VanDerWaalsContact C-N 3.32Å; P463-N465 PolarHBondContact O-N 2.94Å
464	Q	67.3	Low	71.2	Confident	97 Å²	97	89.6 Å²	89.6	45%	0.453	42%	0.416	S	S	.	.			trans	-70.8	93.6	173.1	-174.2	171.1	9	0	0	108.4	G453 E462 V466 L694	G453-Q464 VanDerWaalsContact O-CB 3.32Å; G453-Q464 WeakPolarHBondContact O-CB 3.39Å; G453-Q464 PolarHBondContact O-N 3.47Å; E462-Q464 PolarHBondContact O-N 3.38Å; Q464-V466 PolarHBondContact O-N 3.35Å; Q464-L694 HydrophobicContact CB-CD1 4.5Å
465	N	58.8	Low	71.5	Confident	138 Å²	138	88.5 Å²	88.5	74%	0.738	41%	0.412	S	S	*	.			trans	-62.4	135.1	174.1	-67.8	-23.3	0	0	0	109.4	P463	P463-N465 VanDerWaalsContact C-N 3.32Å; P463-N465 PolarHBondContact O-N 2.94Å
466	V	58.7	Low	71.3	Confident	36 Å²	36	83.3 Å²	83.3	22%	0.218	39%	0.394	C	S	.	.			trans	-71.5	130.4	169	-175.1	0	0	0	0	107.1	Q464 S468 L694 L695	Q464-V466 PolarHBondContact O-N 3.35Å; V466-S468 PolarHBondContact O-N 2.96Å; V466-L694 HydrophobicContact CG2-CB 3.6Å; V466-L695 HydrophobicContact CG1-CB 4.24Å; V466-L695 HydrophobicContact CG1-CD1 3.76Å
467	D	59.2	Low	70.7	Confident	120 Å²	120	81 Å²	81	64%	0.642	38%	0.38	S	S	*	.			trans	-54.2	115.8	172.1	-69.7	-38.6	0	0	0	108.6	E469 R470	D467-E469 PolarHBondContact O-N 3.15Å; D467-R470 WeakPolarHBondContact O-CB 3.32Å; D467-R470 PolarHBondContact O-N 3.41Å
468	S	58.3	Low	69.8	Low	53 Å²	53	80.7 Å²	80.7	37%	0.371	38%	0.383	S	S	.	.	H	α-helix	trans	-59.2	-31.6	-174.9	-70.6	0	0	0	0	111.7	V466 R470 S471 E472 R702	V466-S468 PolarHBondContact O-N 2.96Å; S468-R470 PolarHBondContact O-N 3.49Å; S468-R470 VanDerWaalsContact O-N 3.15Å; S468-S471 WeakPolarHBondContact O-CB 3.22Å; S468-S471 PolarHBondContact O-N 3.36Å; S468-S471 PolarHBondContact O-OG 3.31Å; S468-E472 PolarHBondContact O-N 2.91Å; S468-R702 PolarHBondContact OG-NH2 3.05Å
469	E	62.2	Low	68.6	Low	157 Å²	157	72.3 Å²	72.3	73%	0.734	36%	0.355	S	S	*	.	H	α-helix	trans	-55.3	-31.2	172.6	-62.8	-176.5	175.6	0	0	113.5	D467	D467-E469 PolarHBondContact O-N 3.15Å
470	R	66.4	Low	67.2	Low	141 Å²	141	79.9 Å²	79.9	53%	0.532	39%	0.393	S	S	.	.	H	α-helix	trans	-75.7	-31.9	177.1	-118.3	-176.8	-172.1	175.9	4.2	112.4	D467 S468 F474	D467-R470 WeakPolarHBondContact O-CB 3.32Å; D467-R470 PolarHBondContact O-N 3.41Å; S468-R470 PolarHBondContact O-N 3.49Å; S468-R470 VanDerWaalsContact O-N 3.15Å; R470-F474 VanDerWaalsContact O-CD2 3.27Å; R470-F474 WeakPolarHBondContact O-CD2 3.38Å; R470-F474 VanDerWaalsContact O-CE2 3.32Å; R470-F474 WeakPolarHBondContact O-CE2 3.47Å
471	S	65.1	Low	65.8	Low	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-71.2	-32.7	177.1	72.8	0	0	0	0	112.2	S468 Q473 F474 I475	S468-S471 WeakPolarHBondContact O-CB 3.22Å; S468-S471 PolarHBondContact O-N 3.36Å; S468-S471 PolarHBondContact O-OG 3.31Å; S471-Q473 VanDerWaalsContact C-N 3.25Å; S471-Q473 PolarHBondContact O-N 2.95Å; S471-F474 PolarHBondContact O-N 2.98Å; S471-F474 VanDerWaalsContact O-N 3.13Å; S471-I475 PolarHBondContact O-N 3.39Å
472	E	69.2	Low	64.8	Low	65 Å²	65	77.6 Å²	77.6	30%	0.304	39%	0.394	S	S	.	.	H	α-helix	trans	-66.8	-22.9	179	-69.1	-176.2	168	0	0	114.1	S468 F474 I475	S468-E472 PolarHBondContact O-N 2.91Å; E472-F474 PolarHBondContact O-N 3.06Å; E472-I475 WeakPolarHBondContact CA-O 3.34Å; E472-I475 CarbonylContact O-C 3.59Å
473	Q	74.9	Confident	64.2	Low	122 Å²	122	74.6 Å²	74.6	57%	0.57	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-22.1	174.5	-63.2	-178.7	-2.3	0	0	112.7	S471	S471-Q473 VanDerWaalsContact C-N 3.25Å; S471-Q473 PolarHBondContact O-N 2.95Å
474	F	78.2	Confident	64.3	Low	19 Å²	19	78.7 Å²	78.7	8%	0.083	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-53.3	179.6	-62.3	-96.6	0	0	0	111.1	R470 S471 E472 N665 L668 L669 A672 L695 I699	R470-F474 VanDerWaalsContact O-CD2 3.27Å; R470-F474 WeakPolarHBondContact O-CD2 3.38Å; R470-F474 VanDerWaalsContact O-CE2 3.32Å; R470-F474 WeakPolarHBondContact O-CE2 3.47Å; S471-F474 PolarHBondContact O-N 2.98Å; S471-F474 VanDerWaalsContact O-N 3.13Å; E472-F474 PolarHBondContact O-N 3.06Å; F474-N665 PolarHBondContact O-N 2.96Å; F474-L668 HydrophobicContact CD1-CB 4.1Å; F474-L668 HydrophobicContact CE1-CB 3.93Å; F474-L669 HydrophobicContact CD1-CB 3.92Å; F474-L669 HydrophobicContact CD1-CD1 3.83Å; F474-L669 HydrophobicContact CD1-CG 4.47Å; F474-L669 HydrophobicContact CE1-CD1 4.4Å; F474-A672 HydrophobicContact CE1-CB 4.09Å; F474-L695 HydrophobicContact CD2-CD2 4.38Å; F474-L695 HydrophobicContact CE2-CD1 4.38Å; F474-L695 HydrophobicContact CE2-CD2 3.55Å; F474-L695 HydrophobicContact CE2-CG 4.34Å; F474-L695 HydrophobicContact CZ-CD2 3.71Å; F474-I699 HydrophobicContact CB-CD1 3.94Å; F474-I699 HydrophobicContact CD1-CD1 4.35Å; F474-I699 HydrophobicContact CD2-CD1 4.17Å; F474-I699 HydrophobicContact CG-CD1 3.88Å
475	I	79.5	Confident	64.3	Low	0 Å²	0	78.2 Å²	78.2	0%	0	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-140	120.4	176.7	-62.4	162.1	0	0	0	107.1	S471 E472 F477 L662 F664 I699 I703 M723	S471-I475 PolarHBondContact O-N 3.39Å; E472-I475 WeakPolarHBondContact CA-O 3.34Å; E472-I475 CarbonylContact O-C 3.59Å; I475-F477 HydrophobicContact CB-CD2 4.09Å; I475-F477 HydrophobicContact CB-CE1 4.28Å; I475-F477 HydrophobicContact CB-CE2 3.61Å; I475-F477 HydrophobicContact CB-CZ 3.71Å; I475-F477 HydrophobicContact CD1-CE1 4.47Å; I475-F477 HydrophobicContact CD1-CE2 4.27Å; I475-F477 HydrophobicContact CD1-CZ 3.72Å; I475-F477 HydrophobicContact CG1-CZ 4.32Å; I475-F477 HydrophobicContact CG2-CD1 3.88Å; I475-F477 HydrophobicContact CG2-CD2 4.06Å; I475-F477 HydrophobicContact CG2-CE1 3.63Å; I475-F477 HydrophobicContact CG2-CE2 3.82Å; I475-F477 HydrophobicContact CG2-CG 4.09Å; I475-F477 HydrophobicContact CG2-CZ 3.59Å; I475-F477 VanDerWaalsContact O-CD2 3.25Å; I475-F477 WeakPolarHBondContact O-CD2 3.15Å; I475-F477 PolarHBondContact O-N 3.31Å; I475-L662 HydrophobicContact CG2-CD1 4.33Å; I475-F664 HydrophobicContact CD1-CD2 4.27Å; I475-F664 HydrophobicContact CD1-CE2 4.41Å; I475-F664 HydrophobicContact CG1-CD2 3.72Å; I475-F664 HydrophobicContact CG1-CE2 4.26Å; I475-I699 HydrophobicContact CD1-CG2 4.31Å; I475-I703 HydrophobicContact CD1-CD1 3.64Å; I475-I703 HydrophobicContact CD1-CG1 4.28Å; I475-M723 HydrophobicContact CD1-CE 4.45Å; I475-M723 HydrophobicContact CD1-SD 4.02Å
476	S	74.7	Confident	65	Low	38 Å²	38	78.5 Å²	78.5	27%	0.266	40%	0.395	S	S	.	.			trans	-74	89.7	173.8	165.9	0	0	0	0	108.7	E478 L662	S476-E478 PolarHBondContact OG-O 3.39Å; S476-L662 WeakPolarHBondContact O-CD2 3.36Å
477	F	69.5	Low	66	Low	28 Å²	28	81.3 Å²	81.3	12%	0.123	41%	0.406	C	S	.	.			trans	-76.4	-31.9	177.8	-68.8	-74.8	0	0	0	112.2	I475 R702 I703	I475-F477 HydrophobicContact CB-CD2 4.09Å; I475-F477 HydrophobicContact CB-CE1 4.28Å; I475-F477 HydrophobicContact CB-CE2 3.61Å; I475-F477 HydrophobicContact CB-CZ 3.71Å; I475-F477 HydrophobicContact CD1-CE1 4.47Å; I475-F477 HydrophobicContact CD1-CE2 4.27Å; I475-F477 HydrophobicContact CD1-CZ 3.72Å; I475-F477 HydrophobicContact CG1-CZ 4.32Å; I475-F477 HydrophobicContact CG2-CD1 3.88Å; I475-F477 HydrophobicContact CG2-CD2 4.06Å; I475-F477 HydrophobicContact CG2-CE1 3.63Å; I475-F477 HydrophobicContact CG2-CE2 3.82Å; I475-F477 HydrophobicContact CG2-CG 4.09Å; I475-F477 HydrophobicContact CG2-CZ 3.59Å; I475-F477 VanDerWaalsContact O-CD2 3.25Å; I475-F477 WeakPolarHBondContact O-CD2 3.15Å; I475-F477 PolarHBondContact O-N 3.31Å; F477-R702 HydrophobicContact CE1-CB 4.19Å; F477-R702 HydrophobicContact CE2-CB 4.1Å; F477-R702 HydrophobicContact CZ-CB 3.94Å; F477-I703 HydrophobicContact CE1-CG1 4.11Å; F477-I703 HydrophobicContact CZ-CD1 4.45Å; F477-I703 HydrophobicContact CZ-CG1 3.8Å
478	E	59.3	Low	66.9	Low	113 Å²	113	75.8 Å²	75.8	53%	0.528	38%	0.376	S	S	.	.			trans	-89.7	120	172.9	-60.3	-174.4	-171.9	0	0	107.9	S476	S476-E478 PolarHBondContact OG-O 3.39Å
479	T	55.6	Low	67.8	Low	32 Å²	32	78 Å²	78	20%	0.196	38%	0.379	C	S	.	.			trans	-128.6	152.8	174.9	58.1	0	0	0	0	108.4	L481 D482 L662	T479-L481 PolarHBondContact O-N 3.26Å; T479-D482 PolarHBondContact O-N 3.1Å; T479-D482 VanDerWaalsContact O-N 3.08Å; T479-L662 HydrophobicContact CG2-CD2 3.5Å; T479-L662 VanDerWaalsContact CG2-CD2 3.5Å
480	D	49.5	Very low	68.7	Low	173 Å²	173	77 Å²	77	93%	0.925	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	1	173.2	-59	-39.7	0	0	0	114.2
481	L	52	Low	69.5	Low	73 Å²	73	70.9 Å²	70.9	38%	0.382	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	11.8	-178	-61	168.8	0	0	0	113.2	T479 F483	T479-L481 PolarHBondContact O-N 3.26Å; L481-F483 HydrophobicContact CB-CD2 4.45Å; L481-F483 HydrophobicContact CB-CE2 4.05Å; L481-F483 HydrophobicContact CD2-CE2 3.5Å; L481-F483 VanDerWaalsContact CD2-CE2 3.5Å; L481-F483 HydrophobicContact CD2-CZ 3.56Å; L481-F483 HydrophobicContact CG-CE2 4.4Å; L481-F483 WeakPolarHBondContact O-CD2 3.39Å; L481-F483 PolarHBondContact O-N 3.38Å
482	D	59.5	Low	70	Confident	72 Å²	72	71 Å²	71	39%	0.385	35%	0.348	S	S	.	.			trans	-71.7	63.2	165.5	-82.3	-36.5	0	0	0	110.4	T479 K609	T479-D482 PolarHBondContact O-N 3.1Å; T479-D482 VanDerWaalsContact O-N 3.08Å; D482-K609 IonicContact OD1-NZ 3.67Å; D482-K609 PolarHBondContact OD1-NZ 3.33Å
483	F	63.4	Low	70.4	Confident	28 Å²	28	73.1 Å²	73.1	12%	0.123	36%	0.357	C	S	.	.			trans	-57.2	144.3	173.4	-63.7	-66.1	0	0	0	110.1	L481 D485 E487 L488 L491 L499 N606	L481-F483 HydrophobicContact CB-CD2 4.45Å; L481-F483 HydrophobicContact CB-CE2 4.05Å; L481-F483 HydrophobicContact CD2-CE2 3.5Å; L481-F483 VanDerWaalsContact CD2-CE2 3.5Å; L481-F483 HydrophobicContact CD2-CZ 3.56Å; L481-F483 HydrophobicContact CG-CE2 4.4Å; L481-F483 WeakPolarHBondContact O-CD2 3.39Å; L481-F483 PolarHBondContact O-N 3.38Å; F483-D485 PolarHBondContact O-N 2.88Å; F483-E487 HydrophobicContact CB-CB 4.27Å; F483-E487 HydrophobicContact CB-CG 4.35Å; F483-E487 HydrophobicContact CD1-CG 3.98Å; F483-E487 WeakPolarHBondContact CD1-OE1 3.47Å; F483-E487 WeakPolarHBondContact CD1-OE2 3.36Å; F483-E487 HydrophobicContact CG-CG 4.39Å; F483-L488 HydrophobicContact CB-CB 4.12Å; F483-L488 HydrophobicContact CD2-CD1 4.2Å; F483-L491 HydrophobicContact CD2-CD1 4.25Å; F483-L491 HydrophobicContact CE1-CD1 4.35Å; F483-L491 HydrophobicContact CE2-CD1 4.06Å; F483-L491 HydrophobicContact CG-CD1 4.47Å; F483-L491 HydrophobicContact CZ-CD1 4.11Å; F483-L499 HydrophobicContact CE2-CD2 4.3Å; F483-N606 PolarHBondContact O-ND2 3.4Å
484	Q	68.4	Low	70.7	Confident	148 Å²	148	73.8 Å²	73.8	69%	0.692	36%	0.358	S	S	*	.			trans	-58.8	143.6	168.1	-64.5	-176.6	5.4	0	0	109	L486 E487 L488	Q484-L486 PolarHBondContact O-N 3.35Å; Q484-E487 PolarHBondContact O-N 3.29Å; Q484-L488 PolarHBondContact O-N 2.82Å
485	D	68.3	Low	70.6	Confident	87 Å²	87	76.8 Å²	76.8	47%	0.465	37%	0.374	S	S	.	.	H	α-helix	trans	-52.5	-29	-174.3	-83.8	-30.9	0	0	0	113.4	F483 K489 N606	F483-D485 PolarHBondContact O-N 2.88Å; D485-K489 VanDerWaalsContact O-CB 3.22Å; D485-K489 WeakPolarHBondContact O-CB 3.46Å; D485-K489 PolarHBondContact O-N 3.02Å; D485-N606 WeakPolarHBondContact OD1-CB 3.3Å; D485-N606 PolarHBondContact OD1-N 3.35Å
486	L	74.2	Confident	70.7	Confident	143 Å²	143	78.5 Å²	78.5	75%	0.749	38%	0.383	S	S	*	.	H	α-helix	trans	-67	-44.8	174.6	-79.3	153.9	0	0	0	113.2	Q484 K489 Y490	Q484-L486 PolarHBondContact O-N 3.35Å; L486-K489 PolarHBondContact O-N 3.49Å; L486-Y490 PolarHBondContact O-N 3.49Å; L486-Y490 VanDerWaalsContact O-N 3.09Å
487	E	79.1	Confident	71	Confident	96 Å²	96	81.6 Å²	81.6	45%	0.449	40%	0.404	S	S	.	.	H	α-helix	trans	-68.9	-43	178	-177.9	175.2	-170.7	0	0	110.4	F483 Q484 K489 Y490 L491	F483-E487 HydrophobicContact CB-CB 4.27Å; F483-E487 HydrophobicContact CB-CG 4.35Å; F483-E487 HydrophobicContact CD1-CG 3.98Å; F483-E487 WeakPolarHBondContact CD1-OE1 3.47Å; F483-E487 WeakPolarHBondContact CD1-OE2 3.36Å; F483-E487 HydrophobicContact CG-CG 4.39Å; Q484-E487 PolarHBondContact O-N 3.29Å; E487-K489 VanDerWaalsContact C-N 3.33Å; E487-K489 PolarHBondContact O-N 3.35Å; E487-Y490 WeakPolarHBondContact O-CB 3.38Å; E487-Y490 PolarHBondContact O-N 3.17Å; E487-Y490 VanDerWaalsContact O-N 3.13Å; E487-L491 HydrophobicContact CG-CD1 4.3Å; E487-L491 WeakPolarHBondContact O-CG 3.49Å; E487-L491 PolarHBondContact O-N 3.09Å
488	L	76.9	Confident	71.5	Confident	3 Å²	3	88.2 Å²	88.2	2%	0.016	43%	0.429	C	S	.	.	H	α-helix	trans	-62.5	-40.9	176.6	-171.3	63.2	0	0	0	111.9	F483 Q484 Y490 L491 L492 L499 I542	F483-L488 HydrophobicContact CB-CB 4.12Å; F483-L488 HydrophobicContact CD2-CD1 4.2Å; Q484-L488 PolarHBondContact O-N 2.82Å; L488-Y490 VanDerWaalsContact C-N 3.33Å; L488-Y490 PolarHBondContact O-N 3.41Å; L488-L491 PolarHBondContact O-N 2.94Å; L488-L492 HydrophobicContact CD1-CD1 4.4Å; L488-L492 HydrophobicContact CD1-CG 4.44Å; L488-L492 HydrophobicContact CG-CD1 3.98Å; L488-L492 HydrophobicContact CG-CG 4.44Å; L488-L492 WeakPolarHBondContact O-CB 3.43Å; L488-L492 VanDerWaalsContact O-CG 3.23Å; L488-L492 WeakPolarHBondContact O-CG 3.43Å; L488-L492 PolarHBondContact O-N 3.27Å; L488-L499 HydrophobicContact CD1-CD1 3.93Å; L488-L499 HydrophobicContact CD1-CD2 4.22Å; L488-I542 HydrophobicContact CD1-CD1 3.48Å; L488-I542 VanDerWaalsContact CD1-CD1 3.48Å; L488-I542 HydrophobicContact CD1-CG1 4.46Å; L488-I542 HydrophobicContact CD2-CB 4.41Å; L488-I542 HydrophobicContact CD2-CD1 4.26Å; L488-I542 HydrophobicContact CG-CD1 4.32Å
489	K	77.1	Confident	72.7	Confident	100 Å²	100	83.1 Å²	83.1	44%	0.435	41%	0.405	S	S	.	.	H	α-helix	trans	-59.4	-43.5	173.3	-177	173.7	-175.3	176.3	0	111.7	D485 L486 E487 Q493 L603	D485-K489 VanDerWaalsContact O-CB 3.22Å; D485-K489 WeakPolarHBondContact O-CB 3.46Å; D485-K489 PolarHBondContact O-N 3.02Å; L486-K489 PolarHBondContact O-N 3.49Å; E487-K489 VanDerWaalsContact C-N 3.33Å; E487-K489 PolarHBondContact O-N 3.35Å; K489-Q493 WeakPolarHBondContact O-CB 3.43Å; K489-Q493 VanDerWaalsContact O-CG 3.27Å; K489-Q493 WeakPolarHBondContact O-CG 3.48Å; K489-Q493 PolarHBondContact O-N 3.13Å; K489-L603 HydrophobicContact CG-CD1 4.24Å
490	Y	82.2	Confident	74.1	Confident	137 Å²	137	86.2 Å²	86.2	54%	0.537	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-47.4	177.5	178	-98.7	0	0	0	112	L486 E487 L488 Q493 K494	L486-Y490 PolarHBondContact O-N 3.49Å; L486-Y490 VanDerWaalsContact O-N 3.09Å; E487-Y490 WeakPolarHBondContact O-CB 3.38Å; E487-Y490 PolarHBondContact O-N 3.17Å; E487-Y490 VanDerWaalsContact O-N 3.13Å; L488-Y490 VanDerWaalsContact C-N 3.33Å; L488-Y490 PolarHBondContact O-N 3.41Å; Y490-Q493 PolarHBondContact O-N 3.01Å; Y490-K494 HydrophobicContact CE1-CG 4.2Å; Y490-K494 HydrophobicContact CE2-CG 4.29Å; Y490-K494 WeakPolarHBondContact O-CG 3.3Å; Y490-K494 PolarHBondContact O-N 3.15Å
491	L	82	Confident	75.9	Confident	11 Å²	11	78.5 Å²	78.5	6%	0.058	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-41.1	179.4	-66.5	176.3	0	0	0	112.5	F483 E487 L488 K494 M495 D496 L499	F483-L491 HydrophobicContact CD2-CD1 4.25Å; F483-L491 HydrophobicContact CE1-CD1 4.35Å; F483-L491 HydrophobicContact CE2-CD1 4.06Å; F483-L491 HydrophobicContact CG-CD1 4.47Å; F483-L491 HydrophobicContact CZ-CD1 4.11Å; E487-L491 HydrophobicContact CG-CD1 4.3Å; E487-L491 WeakPolarHBondContact O-CG 3.49Å; E487-L491 PolarHBondContact O-N 3.09Å; L488-L491 PolarHBondContact O-N 2.94Å; L491-K494 CarbonylContact O-C 3.34Å; L491-K494 PolarHBondContact O-N 3.24Å; L491-M495 PolarHBondContact O-N 2.68Å; L491-D496 HydrophobicContact CB-CB 4.36Å; L491-D496 HydrophobicContact CD2-CB 4.23Å; L491-D496 PolarHBondContact O-N 3.38Å; L491-D496 VanDerWaalsContact O-N 3.15Å; L491-L499 HydrophobicContact CB-CD1 3.54Å; L491-L499 HydrophobicContact CD1-CD1 4.38Å
492	L	76.7	Confident	77.5	Confident	3 Å²	3	80.6 Å²	80.6	2%	0.016	38%	0.38	C	S	.	.	H	α-helix	trans	-66.9	-39.3	176.3	-71.4	171.2	0	0	0	112.2	L488 K494 M495 L499 I542 L603 F658	L488-L492 HydrophobicContact CD1-CD1 4.4Å; L488-L492 HydrophobicContact CD1-CG 4.44Å; L488-L492 HydrophobicContact CG-CD1 3.98Å; L488-L492 HydrophobicContact CG-CG 4.44Å; L488-L492 WeakPolarHBondContact O-CB 3.43Å; L488-L492 VanDerWaalsContact O-CG 3.23Å; L488-L492 WeakPolarHBondContact O-CG 3.43Å; L488-L492 PolarHBondContact O-N 3.27Å; L492-K494 VanDerWaalsContact C-N 3.28Å; L492-K494 PolarHBondContact O-N 3.45Å; L492-M495 PolarHBondContact O-N 3.2Å; L492-M495 VanDerWaalsContact O-N 3.16Å; L492-L499 HydrophobicContact CD2-CD1 3.86Å; L492-L499 HydrophobicContact CG-CD1 4.02Å; L492-I542 HydrophobicContact CD1-CG1 4.36Å; L492-I542 HydrophobicContact CD2-CD1 4.45Å; L492-I542 HydrophobicContact CD2-CG1 4.16Å; L492-L603 HydrophobicContact CB-CD2 3.41Å; L492-L603 VanDerWaalsContact CB-CD2 3.41Å; L492-L603 HydrophobicContact CD1-CD2 3.73Å; L492-L603 HydrophobicContact CG-CD2 4.14Å; L492-F658 HydrophobicContact CD2-CB 3.32Å; L492-F658 HydrophobicContact CD2-CD1 4.27Å; L492-F658 HydrophobicContact CD2-CD2 3.92Å; L492-F658 HydrophobicContact CD2-CG 3.59Å
493	Q	77.4	Confident	78.8	Confident	109 Å²	109	77.7 Å²	77.7	51%	0.509	37%	0.365	S	S	.	.	H	α-helix	trans	-65.1	-31.8	174.2	-77.3	-179	-13.5	0	0	112.6	K489 Y490 M495 L603	K489-Q493 WeakPolarHBondContact O-CB 3.43Å; K489-Q493 VanDerWaalsContact O-CG 3.27Å; K489-Q493 WeakPolarHBondContact O-CG 3.48Å; K489-Q493 PolarHBondContact O-N 3.13Å; Y490-Q493 PolarHBondContact O-N 3.01Å; Q493-M495 VanDerWaalsContact C-N 3.31Å; Q493-L603 HydrophobicContact CG-CD1 4.36Å
494	K	81.1	Confident	79.9	Confident	136 Å²	136	79.9 Å²	79.9	59%	0.591	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-5.5	175.1	-68.4	-67.1	-176.8	178.6	0	113.9	Y490 L491 L492 D496	Y490-K494 HydrophobicContact CE1-CG 4.2Å; Y490-K494 HydrophobicContact CE2-CG 4.29Å; Y490-K494 WeakPolarHBondContact O-CG 3.3Å; Y490-K494 PolarHBondContact O-N 3.15Å; L491-K494 CarbonylContact O-C 3.34Å; L491-K494 PolarHBondContact O-N 3.24Å; L492-K494 VanDerWaalsContact C-N 3.28Å; L492-K494 PolarHBondContact O-N 3.45Å; K494-D496 VanDerWaalsContact C-N 3.28Å; K494-D496 PolarHBondContact O-N 3.34Å
495	M	75.8	Confident	80.8	Confident	82 Å²	82	75.4 Å²	75.4	40%	0.404	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	48.1	-176	-57.5	-177.5	-65.1	0	0	111.5	L491 L492 Q493 S497 F658	L491-M495 PolarHBondContact O-N 2.68Å; L492-M495 PolarHBondContact O-N 3.2Å; L492-M495 VanDerWaalsContact O-N 3.16Å; Q493-M495 VanDerWaalsContact C-N 3.31Å; M495-S497 PolarHBondContact O-N 3.31Å; M495-F658 HydrophobicContact CB-CZ 4.03Å; M495-F658 HydrophobicContact CG-CZ 4.06Å
496	D	82.1	Confident	81.7	Confident	37 Å²	37	75 Å²	75	20%	0.198	36%	0.356	C	S	.	.			trans	-60.9	131.3	179.9	-167.6	-54.4	0	0	0	110.8	L491 K494 R498 L499	L491-D496 HydrophobicContact CB-CB 4.36Å; L491-D496 HydrophobicContact CD2-CB 4.23Å; L491-D496 PolarHBondContact O-N 3.38Å; L491-D496 VanDerWaalsContact O-N 3.15Å; K494-D496 VanDerWaalsContact C-N 3.28Å; K494-D496 PolarHBondContact O-N 3.34Å; D496-R498 PolarHBondContact O-N 3.05Å; D496-R498 VanDerWaalsContact OD1-CB 3.26Å; D496-R498 WeakPolarHBondContact OD1-CB 3.27Å; D496-R498 VanDerWaalsContact OD1-CG 3.28Å; D496-R498 WeakPolarHBondContact OD1-CG 3.4Å; D496-R498 IonicContact OD1-CZ 2.71Å; D496-R498 PolarHBondContact OD1-N 3.18Å; D496-R498 IonicContact OD1-NE 3.24Å; D496-R498 PolarHBondContact OD1-NE 3.38Å; D496-R498 IonicContact OD1-NH2 2.77Å; D496-R498 IonicContact OD2-CZ 3.67Å; D496-R498 IonicContact OD2-NE 3.96Å; D496-R498 PolarHBondContact OD2-NE 2.89Å; D496-R498 IonicContact OD2-NH2 2.86Å; D496-R498 PolarHBondContact OD2-NH2 3.46Å; D496-L499 PolarHBondContact O-N 2.96Å
497	S	81	Confident	82.1	Confident	102 Å²	102	69.5 Å²	69.5	71%	0.713	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-65.8	-19.5	-176.4	56.8	0	0	0	0	113.4	M495 L499 Y500	M495-S497 PolarHBondContact O-N 3.31Å; S497-L499 PolarHBondContact O-N 3.33Å; S497-Y500 WeakPolarHBondContact O-CB 3.44Å; S497-Y500 PolarHBondContact O-N 2.96Å
498	R	80.8	Confident	82.1	Confident	168 Å²	168	72.9 Å²	72.9	63%	0.634	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-67.4	-25.3	176.5	-64.6	177	-68.4	162.6	0.1	113.1	D496 Y500	D496-R498 PolarHBondContact O-N 3.05Å; D496-R498 VanDerWaalsContact OD1-CB 3.26Å; D496-R498 WeakPolarHBondContact OD1-CB 3.27Å; D496-R498 VanDerWaalsContact OD1-CG 3.28Å; D496-R498 WeakPolarHBondContact OD1-CG 3.4Å; D496-R498 IonicContact OD1-CZ 2.71Å; D496-R498 PolarHBondContact OD1-N 3.18Å; D496-R498 IonicContact OD1-NE 3.24Å; D496-R498 PolarHBondContact OD1-NE 3.38Å; D496-R498 IonicContact OD1-NH2 2.77Å; D496-R498 IonicContact OD2-CZ 3.67Å; D496-R498 IonicContact OD2-NE 3.96Å; D496-R498 PolarHBondContact OD2-NE 2.89Å; D496-R498 IonicContact OD2-NH2 2.86Å; D496-R498 PolarHBondContact OD2-NH2 3.46Å; R498-Y500 VanDerWaalsContact C-N 3.34Å
499	L	84.1	Confident	81.9	Confident	6 Å²	6	76 Å²	76	3%	0.031	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-90.9	1.5	178.3	-61.1	179.3	0	0	0	112.4	F483 L488 L491 L492 D496 S497 I542 F658 G659	F483-L499 HydrophobicContact CE2-CD2 4.3Å; L488-L499 HydrophobicContact CD1-CD1 3.93Å; L488-L499 HydrophobicContact CD1-CD2 4.22Å; L491-L499 HydrophobicContact CB-CD1 3.54Å; L491-L499 HydrophobicContact CD1-CD1 4.38Å; L492-L499 HydrophobicContact CD2-CD1 3.86Å; L492-L499 HydrophobicContact CG-CD1 4.02Å; D496-L499 PolarHBondContact O-N 2.96Å; S497-L499 PolarHBondContact O-N 3.33Å; L499-I542 HydrophobicContact CD1-CD1 4.48Å; L499-I542 HydrophobicContact CD2-CD1 4.08Å; L499-F658 HydrophobicContact CB-CB 4.41Å; L499-F658 HydrophobicContact CB-CD1 4.04Å; L499-F658 CarbonylContact O-C 3.27Å; L499-F658 WeakPolarHBondContact O-CA 3.35Å; L499-G659 CarbonylContact C-O 3.58Å; L499-G659 PolarHBondContact O-N 2.87Å; L499-G659 VanDerWaalsContact O-O 3.07Å
500	Y	84.6	Confident	81.9	Confident	97 Å²	97	71.6 Å²	71.6	38%	0.38	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	122.4	-175.6	179	-107	0	0	0	111.8	S497 R498 H502 Q656	S497-Y500 WeakPolarHBondContact O-CB 3.44Å; S497-Y500 PolarHBondContact O-N 2.96Å; R498-Y500 VanDerWaalsContact C-N 3.34Å; Y500-H502 HydrophobicContact CE1-CB 4.42Å; Y500-Q656 HydrophobicContact CD2-CB 4.4Å; Y500-Q656 HydrophobicContact CE2-CB 4.2Å; Y500-Q656 HydrophobicContact CE2-CG 4.12Å
501	I	86.9	Confident	81.8	Confident	10 Å²	10	74.7 Å²	74.7	5%	0.051	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.3	167.6	-62.3	173.2	0	0	0	108.8	T503 H539 M540 F612 V657 G659	I501-T503 HydrophobicContact CG2-CG2 4.45Å; I501-T503 PolarHBondContact O-N 2.92Å; I501-T503 VanDerWaalsContact O-N 3.12Å; I501-H539 HydrophobicContact CD1-CB 4.25Å; I501-M540 WeakPolarHBondContact CD1-O 3.32Å; I501-F612 HydrophobicContact CB-CZ 4.23Å; I501-F612 HydrophobicContact CD1-CE1 3.5Å; I501-F612 VanDerWaalsContact CD1-CE1 3.5Å; I501-F612 HydrophobicContact CD1-CZ 3.66Å; I501-F612 HydrophobicContact CG2-CZ 3.95Å; I501-V657 PolarHBondContact N-O 2.96Å; I501-G659 VanDerWaalsContact CD1-C 3.46Å
502	H	85.4	Confident	81.9	Confident	117 Å²	117	76.8 Å²	76.8	54%	0.542	37%	0.368	S	S	.	.			trans	-65.5	113.4	174.3	-174.9	82.4	0	0	0	111.1	Y500	Y500-H502 HydrophobicContact CE1-CB 4.42Å
503	T	87.9	Confident	82.2	Confident	12 Å²	12	81.4 Å²	81.4	7%	0.074	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.6	174.5	59.7	0	0	0	0	111.3	I501 L528 K529 F612 V657	I501-T503 HydrophobicContact CG2-CG2 4.45Å; I501-T503 PolarHBondContact O-N 2.92Å; I501-T503 VanDerWaalsContact O-N 3.12Å; T503-L528 HydrophobicContact CG2-CB 4.49Å; T503-K529 CarbonylContact C-O 3.6Å; T503-K529 WeakPolarHBondContact CA-O 3.48Å; T503-F612 HydrophobicContact CG2-CE2 3.94Å; T503-F612 HydrophobicContact CG2-CZ 4.37Å; T503-V657 HydrophobicContact CG2-CB 4.08Å; T503-V657 HydrophobicContact CG2-CG2 3.93Å
504	T	87.1	Confident	82.5	Confident	74 Å²	74	79.2 Å²	79.2	45%	0.454	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.2	171.7	-52.5	0	0	0	0	109.9	I506 K529	T504-I506 HydrophobicContact CG2-CG1 4.23Å; T504-K529 PolarHBondContact N-O 3.44Å; T504-K529 PolarHBondContact O-N 3Å
505	F	87.2	Confident	82.5	Confident	53 Å²	53	77.4 Å²	77.4	23%	0.232	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	126.6	172.7	176	-95.3	0	0	0	110.6	L512 L526 L528 I655	F505-L512 HydrophobicContact CB-CD1 4.19Å; F505-L512 HydrophobicContact CD1-CD1 3.94Å; F505-L512 HydrophobicContact CD1-CG 3.89Å; F505-L512 HydrophobicContact CD2-CD1 4.23Å; F505-L512 HydrophobicContact CD2-CD2 4.23Å; F505-L512 HydrophobicContact CD2-CG 4.33Å; F505-L512 HydrophobicContact CE1-CD1 4.37Å; F505-L512 HydrophobicContact CE1-CD2 4.27Å; F505-L512 HydrophobicContact CE1-CG 3.81Å; F505-L512 HydrophobicContact CE2-CD2 3.89Å; F505-L512 HydrophobicContact CE2-CG 4.23Å; F505-L512 HydrophobicContact CG-CD1 3.85Å; F505-L512 HydrophobicContact CG-CG 4.15Å; F505-L512 HydrophobicContact CZ-CD2 3.9Å; F505-L512 HydrophobicContact CZ-CG 3.96Å; F505-L526 HydrophobicContact CE2-CB 4.1Å; F505-L526 HydrophobicContact CE2-CD2 3.63Å; F505-L526 HydrophobicContact CE2-CG 4.36Å; F505-L526 HydrophobicContact CZ-CD2 3.54Å; F505-L528 HydrophobicContact CB-CD2 4.32Å; F505-L528 HydrophobicContact CD2-CD2 4.02Å; F505-I655 HydrophobicContact CD2-CD1 4.01Å; F505-I655 HydrophobicContact CE2-CD1 3.69Å
506	I	86	Confident	82.6	Confident	78 Å²	78	74.4 Å²	74.4	40%	0.4	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118	179.6	-54.9	172.3	0	0	0	108	T504 T527 K529	T504-I506 HydrophobicContact CG2-CG1 4.23Å; I506-T527 PolarHBondContact N-O 2.93Å; I506-T527 WeakPolarHBondContact O-CB 3.49Å; I506-T527 PolarHBondContact O-N 3.35Å; I506-K529 HydrophobicContact CD1-CB 4.12Å; I506-K529 HydrophobicContact CD1-CD 4.35Å
507	S	83.7	Confident	82.2	Confident	29 Å²	29	73.9 Å²	73.9	20%	0.203	36%	0.358	C	S	.	.			trans	-148.8	136.2	169.7	-173.8	0	0	0	0	110.3	E509 I510 S525	S507-E509 PolarHBondContact OG-N 2.97Å; S507-I510 WeakPolarHBondContact CB-O 3.28Å; S507-I510 PolarHBondContact OG-N 2.91Å; S507-S525 PolarHBondContact OG-O 2.69Å
508	N	77.6	Confident	81.6	Confident	166 Å²	166	69.7 Å²	69.7	89%	0.888	33%	0.329	S	S	*	.	S	Bend	trans	-84.9	-15.3	174.1	-66.9	-15.1	0	0	0	112.1
509	E	74.4	Confident	80.9	Confident	70 Å²	70	67 Å²	67	33%	0.327	32%	0.318	S	S	.	.	S	Bend	trans	-114.8	-31.7	-166.5	-61.4	-175.3	140.9	0	0	113	S507 R521 M524 S525	S507-E509 PolarHBondContact OG-N 2.97Å; E509-R521 IonicContact OE1-CZ 2.67Å; E509-R521 IonicContact OE1-NH1 3.83Å; E509-R521 PolarHBondContact OE1-NH1 3.08Å; E509-M524 HydrophobicContact CB-CE 4.27Å; E509-M524 HydrophobicContact CB-CG 4.23Å; E509-M524 VanDerWaalsContact OE2-CA 3.25Å; E509-M524 WeakPolarHBondContact OE2-CA 3.33Å; E509-M524 WeakPolarHBondContact OE2-CG 3.43Å; E509-S525 PolarHBondContact OE2-N 2.95Å
510	I	75.1	Confident	79.8	Confident	6 Å²	6	75 Å²	75	3%	0.031	35%	0.348	C	S	.	.			trans	-122.1	136.5	-179.9	-55.5	167.3	0	0	0	110	S507 F516 M524 L526 I652	S507-I510 WeakPolarHBondContact CB-O 3.28Å; S507-I510 PolarHBondContact OG-N 2.91Å; I510-F516 HydrophobicContact CD1-CD1 4.47Å; I510-F516 HydrophobicContact CD1-CE1 3.83Å; I510-F516 HydrophobicContact CD1-CE2 4.04Å; I510-F516 HydrophobicContact CD1-CZ 3.58Å; I510-F516 HydrophobicContact CG1-CD1 4.34Å; I510-F516 HydrophobicContact CG1-CE1 4.17Å; I510-F516 HydrophobicContact CG1-CZ 4.27Å; I510-F516 HydrophobicContact CG2-CD1 3.94Å; I510-F516 HydrophobicContact CG2-CE1 3.81Å; I510-M524 HydrophobicContact CD1-CE 4.03Å; I510-M524 HydrophobicContact CD1-CG 3.54Å; I510-M524 HydrophobicContact CD1-SD 3.06Å; I510-M524 WeakPolarHBondContact CD1-SD 3.29Å; I510-M524 HydrophobicContact CG1-CE 3.49Å; I510-M524 VanDerWaalsContact CG1-CE 3.49Å; I510-M524 HydrophobicContact CG1-CG 3.77Å; I510-M524 HydrophobicContact CG1-SD 3.27Å; I510-M524 WeakPolarHBondContact CG1-SD 3.35Å; I510-L526 HydrophobicContact CB-CD2 3.98Å; I510-L526 HydrophobicContact CD1-CD1 4.3Å; I510-L526 HydrophobicContact CD1-CD2 3.4Å; I510-L526 VanDerWaalsContact CD1-CD2 3.4Å; I510-L526 HydrophobicContact CD1-CG 4.1Å; I510-L526 HydrophobicContact CG1-CD2 4.17Å; I510-I652 HydrophobicContact CD1-CD1 4.36Å
511	R	80.9	Confident	78.6	Confident	202 Å²	202	77.9 Å²	77.9	76%	0.762	36%	0.358	S	S	*	.			trans	-99.8	136.5	161.2	-65	-178.2	178.8	-178.2	-0.8	109	T514	R511-T514 HydrophobicContact CB-CG2 3.99Å; R511-T514 PolarHBondContact O-N 3.02Å; R511-T514 PolarHBondContact O-OG1 3.43Å
512	L	83.9	Confident	77.1	Confident	55 Å²	55	86.8 Å²	86.8	29%	0.288	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	152.4	173	-64.9	174.5	0	0	0	110.1	F505 T514 I652 I655	F505-L512 HydrophobicContact CB-CD1 4.19Å; F505-L512 HydrophobicContact CD1-CD1 3.94Å; F505-L512 HydrophobicContact CD1-CG 3.89Å; F505-L512 HydrophobicContact CD2-CD1 4.23Å; F505-L512 HydrophobicContact CD2-CD2 4.23Å; F505-L512 HydrophobicContact CD2-CG 4.33Å; F505-L512 HydrophobicContact CE1-CD1 4.37Å; F505-L512 HydrophobicContact CE1-CD2 4.27Å; F505-L512 HydrophobicContact CE1-CG 3.81Å; F505-L512 HydrophobicContact CE2-CD2 3.89Å; F505-L512 HydrophobicContact CE2-CG 4.23Å; F505-L512 HydrophobicContact CG-CD1 3.85Å; F505-L512 HydrophobicContact CG-CG 4.15Å; F505-L512 HydrophobicContact CZ-CD2 3.9Å; F505-L512 HydrophobicContact CZ-CG 3.96Å; L512-T514 PolarHBondContact O-N 3.04Å; L512-I652 HydrophobicContact CD2-CB 4.48Å; L512-I652 HydrophobicContact CD2-CG2 3.97Å; L512-I655 HydrophobicContact CD2-CD1 4.17Å; L512-I655 HydrophobicContact CD2-CG1 4.24Å
513	E	83.9	Confident	76.1	Confident	101 Å²	101	87.3 Å²	87.3	47%	0.472	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	11.4	-177.1	-67.4	-65.8	159.3	0	0	115.8	K651 I652 S653	E513-K651 WeakPolarHBondContact O-CD 3.35Å; E513-K651 WeakPolarHBondContact OE2-CE 3.16Å; E513-K651 IonicContact OE2-NZ 3.95Å; E513-K651 PolarHBondContact OE2-NZ 3.37Å; E513-I652 PolarHBondContact N-O 2.92Å; E513-S653 VanDerWaalsContact CD-OG 3.24Å; E513-S653 WeakPolarHBondContact OE1-CA 3.48Å; E513-S653 WeakPolarHBondContact OE1-CB 3.21Å; E513-S653 PolarHBondContact OE1-OG 3.02Å; E513-S653 PolarHBondContact OE2-OG 3.42Å
514	T	83.4	Confident	75.3	Confident	63 Å²	63	87.5 Å²	87.5	39%	0.387	39%	0.394	S	S	.	.			trans	-108.3	139.9	173.6	67.5	0	0	0	0	112.4	R511 L512	R511-T514 HydrophobicContact CB-CG2 3.99Å; R511-T514 PolarHBondContact O-N 3.02Å; R511-T514 PolarHBondContact O-OG1 3.43Å; L512-T514 PolarHBondContact O-N 3.04Å
515	F	79.9	Confident	74.9	Confident	98 Å²	98	85.9 Å²	85.9	43%	0.43	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	135.5	174.3	-80	-83.1	0	0	0	110.6	M551 I650 K651	F515-M551 HydrophobicContact CD1-CG 4.31Å; F515-M551 HydrophobicContact CE1-CG 3.98Å; F515-M551 HydrophobicContact CE1-SD 4.47Å; F515-I650 WeakPolarHBondContact CA-O 3.44Å; F515-K651 HydrophobicContact CD1-CB 3.55Å; F515-K651 HydrophobicContact CD2-CB 4.07Å; F515-K651 HydrophobicContact CD2-CD 4.1Å; F515-K651 HydrophobicContact CE1-CB 3.57Å; F515-K651 HydrophobicContact CE2-CB 4.09Å; F515-K651 HydrophobicContact CE2-CD 3.86Å; F515-K651 HydrophobicContact CG-CB 3.81Å; F515-K651 HydrophobicContact CZ-CB 3.85Å; F515-K651 HydrophobicContact CZ-CD 4.22Å
516	F	77.7	Confident	74.9	Confident	19 Å²	19	83.4 Å²	83.4	8%	0.083	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.9	176.3	64.8	-88.1	0	0	0	111.5	I510 P518 M524 L619 Y649 I650 I652	I510-F516 HydrophobicContact CD1-CD1 4.47Å; I510-F516 HydrophobicContact CD1-CE1 3.83Å; I510-F516 HydrophobicContact CD1-CE2 4.04Å; I510-F516 HydrophobicContact CD1-CZ 3.58Å; I510-F516 HydrophobicContact CG1-CD1 4.34Å; I510-F516 HydrophobicContact CG1-CE1 4.17Å; I510-F516 HydrophobicContact CG1-CZ 4.27Å; I510-F516 HydrophobicContact CG2-CD1 3.94Å; I510-F516 HydrophobicContact CG2-CE1 3.81Å; F516-P518 HydrophobicContact CE2-CB 4.4Å; F516-M524 HydrophobicContact CD2-CE 3.9Å; F516-M524 HydrophobicContact CD2-SD 3.84Å; F516-M524 HydrophobicContact CE2-CE 4.2Å; F516-M524 HydrophobicContact CE2-SD 3.5Å; F516-M524 VanDerWaalsContact CE2-SD 3.5Å; F516-M524 HydrophobicContact CG-CE 4.5Å; F516-M524 HydrophobicContact CZ-SD 4.14Å; F516-L619 HydrophobicContact CE2-CD2 4.03Å; F516-L619 HydrophobicContact CZ-CD2 4.27Å; F516-Y649 WeakPolarHBondContact O-CA 3.46Å; F516-I650 WeakPolarHBondContact CD1-O 3.36Å; F516-I650 HydrophobicContact CD2-CG1 4.23Å; F516-I650 HydrophobicContact CE1-CD1 4.4Å; F516-I650 HydrophobicContact CE1-CG1 4.01Å; F516-I650 HydrophobicContact CE2-CD1 3.7Å; F516-I650 HydrophobicContact CE2-CG1 3.67Å; F516-I650 HydrophobicContact CZ-CD1 3.53Å; F516-I650 HydrophobicContact CZ-CG1 3.55Å; F516-I650 PolarHBondContact N-O 2.82Å; F516-I650 PolarHBondContact O-N 2.91Å; F516-I652 HydrophobicContact CE1-CD1 4.16Å; F516-I652 HydrophobicContact CE1-CG1 4.05Å; F516-I652 HydrophobicContact CZ-CD1 3.97Å; F516-I652 HydrophobicContact CZ-CG1 4.19Å
517	D	74.1	Confident	75	Confident	26 Å²	26	80.7 Å²	80.7	14%	0.139	36%	0.362	C	S	.	.			trans	-88.6	117.8	172.6	-172.3	-28.6	0	0	0	109.3	R519 W520 Y649	D517-R519 PolarHBondContact O-N 3.33Å; D517-R519 VanDerWaalsContact O-N 3.11Å; D517-R519 WeakPolarHBondContact OD1-CB 3.35Å; D517-R519 WeakPolarHBondContact OD1-CG 3.19Å; D517-R519 PolarHBondContact OD1-N 3.15Å; D517-R519 IonicContact OD1-NE 3.13Å; D517-R519 PolarHBondContact OD1-NE 3.08Å; D517-R519 VanDerWaalsContact OD1-NE 3.16Å; D517-R519 IonicContact OD2-CZ 2.7Å; D517-R519 IonicContact OD2-NE 2.76Å; D517-R519 PolarHBondContact OD2-NE 3.49Å; D517-R519 VanDerWaalsContact OD2-NE 3.13Å; D517-R519 IonicContact OD2-NH2 3.37Å; D517-R519 PolarHBondContact OD2-NH2 3.39Å; D517-W520 WeakPolarHBondContact O-CB 3.21Å; D517-W520 PolarHBondContact O-N 2.78Å; D517-Y649 HydrophobicContact CB-CD1 4.47Å; D517-Y649 HydrophobicContact CB-CE1 4.2Å
518	P	68.7	Low	75.3	Confident	14 Å²	14	79.4 Å²	79.4	9%	0.091	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-6.2	-178.7	31.7	-36	0	0	0	113.4	F516 L619 S621 I648 I650	F516-P518 HydrophobicContact CE2-CB 4.4Å; P518-L619 HydrophobicContact CB-CD2 3.92Å; P518-S621 WeakPolarHBondContact O-CB 3.48Å; P518-I648 VanDerWaalsContact CD-O 3.3Å; P518-I648 WeakPolarHBondContact CD-O 3.44Å; P518-I648 HydrophobicContact CG-CG2 3.91Å; P518-I650 HydrophobicContact CB-CD1 4.11Å; P518-I650 HydrophobicContact CB-CG1 4.5Å; P518-I650 HydrophobicContact CG-CD1 4.34Å; P518-I650 HydrophobicContact CG-CG1 4.41Å
519	R	66.6	Low	75.8	Confident	112 Å²	112	73.9 Å²	73.9	42%	0.423	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-18.8	174.4	-60.3	176.3	-69.6	-179.7	1.1	113.7	D517 R521	D517-R519 PolarHBondContact O-N 3.33Å; D517-R519 VanDerWaalsContact O-N 3.11Å; D517-R519 WeakPolarHBondContact OD1-CB 3.35Å; D517-R519 WeakPolarHBondContact OD1-CG 3.19Å; D517-R519 PolarHBondContact OD1-N 3.15Å; D517-R519 IonicContact OD1-NE 3.13Å; D517-R519 PolarHBondContact OD1-NE 3.08Å; D517-R519 VanDerWaalsContact OD1-NE 3.16Å; D517-R519 IonicContact OD2-CZ 2.7Å; D517-R519 IonicContact OD2-NE 2.76Å; D517-R519 PolarHBondContact OD2-NE 3.49Å; D517-R519 VanDerWaalsContact OD2-NE 3.13Å; D517-R519 IonicContact OD2-NH2 3.37Å; D517-R519 PolarHBondContact OD2-NH2 3.39Å; R519-R521 PolarHBondContact O-N 3.3Å; R519-R521 VanDerWaalsContact O-N 3.1Å
520	W	61.4	Low	76.3	Confident	172 Å²	172	70.6 Å²	70.6	65%	0.652	31%	0.306	S	S	*	.	S	Bend	trans	-61.5	-24.4	-171.6	-165.5	14.9	0	0	0	112.9	D517	D517-W520 WeakPolarHBondContact O-CB 3.21Å; D517-W520 PolarHBondContact O-N 2.78Å
521	R	58.8	Low	76.1	Confident	159 Å²	159	73.3 Å²	73.3	60%	0.6	32%	0.321	S	S	*	.	S	Bend	trans	-142.7	147.1	170.5	-72.9	-167.6	172.3	-167.1	-3.4	112.5	E509 R519 R523	E509-R521 IonicContact OE1-CZ 2.67Å; E509-R521 IonicContact OE1-NH1 3.83Å; E509-R521 PolarHBondContact OE1-NH1 3.08Å; R519-R521 PolarHBondContact O-N 3.3Å; R519-R521 VanDerWaalsContact O-N 3.1Å; R521-R523 VanDerWaalsContact C-N 3.26Å; R521-R523 PolarHBondContact O-N 3.48Å
522	K	55.7	Low	75.2	Confident	196 Å²	196	70.1 Å²	70.1	85%	0.852	31%	0.312	S	S	*	.	S	Bend	trans	-66.1	-21.8	-177.9	-76.5	-178.7	178.5	173.5	0	114.4
523	R	63.4	Low	74.1	Confident	128 Å²	128	74.3 Å²	74.3	48%	0.483	34%	0.335	S	S	.	.			trans	-152.9	125.4	-179.4	-173.3	176.8	-173.1	179.4	1.5	108.5	R521 H571 Y618	R521-R523 VanDerWaalsContact C-N 3.26Å; R521-R523 PolarHBondContact O-N 3.48Å; R523-H571 PolarHBondContact NH2-NE2 3.05Å; R523-Y618 HydrophobicContact CG-CD1 3.57Å; R523-Y618 HydrophobicContact CG-CE1 4.2Å; R523-Y618 HydrophobicContact CG-CG 4.3Å; R523-Y618 PolarHBondContact NH2-OH 3.4Å
524	M	71.3	Confident	73.2	Confident	16 Å²	16	76.6 Å²	76.6	8%	0.079	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.1	179.9	-170.6	174.6	-116.4	0	0	109.1	E509 I510 F516 Y618 L619	E509-M524 HydrophobicContact CB-CE 4.27Å; E509-M524 HydrophobicContact CB-CG 4.23Å; E509-M524 VanDerWaalsContact OE2-CA 3.25Å; E509-M524 WeakPolarHBondContact OE2-CA 3.33Å; E509-M524 WeakPolarHBondContact OE2-CG 3.43Å; I510-M524 HydrophobicContact CD1-CE 4.03Å; I510-M524 HydrophobicContact CD1-CG 3.54Å; I510-M524 HydrophobicContact CD1-SD 3.06Å; I510-M524 WeakPolarHBondContact CD1-SD 3.29Å; I510-M524 HydrophobicContact CG1-CE 3.49Å; I510-M524 VanDerWaalsContact CG1-CE 3.49Å; I510-M524 HydrophobicContact CG1-CG 3.77Å; I510-M524 HydrophobicContact CG1-SD 3.27Å; I510-M524 WeakPolarHBondContact CG1-SD 3.35Å; F516-M524 HydrophobicContact CD2-CE 3.9Å; F516-M524 HydrophobicContact CD2-SD 3.84Å; F516-M524 HydrophobicContact CE2-CE 4.2Å; F516-M524 HydrophobicContact CE2-SD 3.5Å; F516-M524 VanDerWaalsContact CE2-SD 3.5Å; F516-M524 HydrophobicContact CG-CE 4.5Å; F516-M524 HydrophobicContact CZ-SD 4.14Å; M524-Y618 VanDerWaalsContact O-CA 3.28Å; M524-Y618 WeakPolarHBondContact O-CA 3.48Å; M524-L619 HydrophobicContact CB-CB 4.21Å; M524-L619 PolarHBondContact N-O 3.03Å; M524-L619 PolarHBondContact O-N 3.11Å
525	S	80.1	Confident	72.5	Confident	41 Å²	41	77.9 Å²	77.9	29%	0.287	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.9	-172.5	67.2	0	0	0	0	113	S507 E509	S507-S525 PolarHBondContact OG-O 2.69Å; E509-S525 PolarHBondContact OE2-N 2.95Å
526	L	86.4	Confident	72.5	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.7	172.1	-56.4	170	0	0	0	107.7	F505 I510 M546 H616 I617 I652 I655	F505-L526 HydrophobicContact CE2-CB 4.1Å; F505-L526 HydrophobicContact CE2-CD2 3.63Å; F505-L526 HydrophobicContact CE2-CG 4.36Å; F505-L526 HydrophobicContact CZ-CD2 3.54Å; I510-L526 HydrophobicContact CB-CD2 3.98Å; I510-L526 HydrophobicContact CD1-CD1 4.3Å; I510-L526 HydrophobicContact CD1-CD2 3.4Å; I510-L526 VanDerWaalsContact CD1-CD2 3.4Å; I510-L526 HydrophobicContact CD1-CG 4.1Å; I510-L526 HydrophobicContact CG1-CD2 4.17Å; L526-M546 HydrophobicContact CD1-CE 4.16Å; L526-H616 CarbonylContact O-C 3.2Å; L526-H616 WeakPolarHBondContact O-CA 3.36Å; L526-I617 HydrophobicContact CB-CB 4.19Å; L526-I617 PolarHBondContact N-O 2.93Å; L526-I617 PolarHBondContact O-N 3.1Å; L526-I652 HydrophobicContact CD1-CD1 3.57Å; L526-I655 HydrophobicContact CD1-CD1 3.96Å
527	T	88.1	Confident	72.8	Confident	22 Å²	22	80.8 Å²	80.8	14%	0.135	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127	179.9	-55.4	0	0	0	0	109.8	I506 T614 V615 H616	I506-T527 PolarHBondContact N-O 2.93Å; I506-T527 WeakPolarHBondContact O-CB 3.49Å; I506-T527 PolarHBondContact O-N 3.35Å; T527-T614 HydrophobicContact CG2-CG2 4.49Å; T527-V615 CarbonylContact C-O 3.52Å; T527-V615 WeakPolarHBondContact CA-O 3.44Å; T527-H616 WeakPolarHBondContact CG2-ND1 3.35Å; T527-H616 PolarHBondContact OG1-ND1 3.35Å
528	L	89.4	Confident	73.5	Confident	1 Å²	1	79.6 Å²	79.6	1%	0.005	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.3	168.4	-56.1	167.9	0	0	0	107.1	T503 F505 L544 T614 V615 I617 I655 V657	T503-L528 HydrophobicContact CG2-CB 4.49Å; F505-L528 HydrophobicContact CB-CD2 4.32Å; F505-L528 HydrophobicContact CD2-CD2 4.02Å; L528-L544 HydrophobicContact CD1-CD1 4.21Å; L528-T614 CarbonylContact O-C 3.57Å; L528-T614 VanDerWaalsContact O-CA 3.3Å; L528-T614 WeakPolarHBondContact O-CA 3.47Å; L528-V615 HydrophobicContact CB-CB 4.31Å; L528-V615 PolarHBondContact N-O 2.96Å; L528-V615 PolarHBondContact O-N 2.91Å; L528-I617 HydrophobicContact CD1-CD1 4.35Å; L528-I655 HydrophobicContact CD1-CG2 3.43Å; L528-I655 VanDerWaalsContact CD1-CG2 3.43Å; L528-I655 HydrophobicContact CD2-CB 4.28Å; L528-I655 HydrophobicContact CD2-CG2 3.99Å; L528-I655 HydrophobicContact CG-CG2 4.19Å; L528-V657 HydrophobicContact CB-CG2 4.37Å; L528-V657 HydrophobicContact CD1-CG2 3.42Å; L528-V657 VanDerWaalsContact CD1-CG2 3.42Å; L528-V657 HydrophobicContact CG-CG2 4.49Å
529	K	88.7	Confident	74.4	Confident	51 Å²	51	79.4 Å²	79.4	22%	0.222	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	127.5	179.9	-177.2	161.8	-176.4	176.7	0	110.1	T503 T504 I506 T614	T503-K529 CarbonylContact C-O 3.6Å; T503-K529 WeakPolarHBondContact CA-O 3.48Å; T504-K529 PolarHBondContact N-O 3.44Å; T504-K529 PolarHBondContact O-N 3Å; I506-K529 HydrophobicContact CD1-CB 4.12Å; I506-K529 HydrophobicContact CD1-CD 4.35Å; K529-T614 HydrophobicContact CB-CG2 4.01Å; K529-T614 HydrophobicContact CD-CG2 3.99Å; K529-T614 HydrophobicContact CG-CG2 3.77Å
530	S	84.5	Confident	75.5	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.007	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	155.9	168.4	64.2	0	0	0	0	109.8	K532 H539 E613	S530-K532 PolarHBondContact O-N 2.9Å; S530-H539 VanDerWaalsContact CB-CD2 3.41Å; S530-H539 WeakPolarHBondContact CB-CD2 3.48Å; S530-E613 PolarHBondContact N-O 3.48Å; S530-E613 WeakPolarHBondContact OG-CA 3.42Å; S530-E613 PolarHBondContact OG-O 3.19Å; S530-E613 PolarHBondContact OG-OE2 3.29Å
531	N	72.2	Confident	76.9	Confident	63 Å²	63	66 Å²	66	34%	0.337	30%	0.299	S	S	.	.			trans	-64.6	105.3	-174.8	-172.4	-12.7	0	0	0	111.8	N533 R534	N531-N533 PolarHBondContact O-N 2.92Å; N531-N533 PolarHBondContact OD1-N 3.31Å; N531-R534 PolarHBondContact O-N 3.41Å
532	K	61.1	Low	78.4	Confident	134 Å²	134	58.5 Å²	58.5	58%	0.583	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.2	-177.2	-160	-170.2	177.4	-173.7	0	114.1	S530	S530-K532 PolarHBondContact O-N 2.9Å
533	N	60.3	Low	80	Confident	143 Å²	143	49.2 Å²	49.2	77%	0.765	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-0.1	-171.8	-67.9	-5	0	0	0	114.1	N531	N531-N533 PolarHBondContact O-N 2.92Å; N531-N533 PolarHBondContact OD1-N 3.31Å
534	R	65.2	Low	81.3	Confident	150 Å²	150	43.3 Å²	43.3	57%	0.566	21%	0.208	S	C	*	.			trans	-112.5	77.7	177.1	-69.2	-166.5	179.3	-178.9	1.2	111.3	N531 D536 Y537	N531-R534 PolarHBondContact O-N 3.41Å; R534-D536 PolarHBondContact O-N 2.8Å; R534-Y537 HydrophobicContact CB-CD2 4.22Å; R534-Y537 PolarHBondContact O-N 3.37Å
535	M	68.9	Low	82.2	Confident	89 Å²	89	42.8 Å²	42.8	44%	0.438	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.9	-178.8	-66.8	-62.5	-123.1	0	0	114	Y537	M535-Y537 PolarHBondContact O-N 3.41Å
536	D	79.8	Confident	82.6	Confident	108 Å²	108	40.9 Å²	40.9	58%	0.578	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2.8	179.7	-50.5	-34.4	0	0	0	113.2	R534 F664	R534-D536 PolarHBondContact O-N 2.8Å; D536-F664 PolarHBondContact O-N 3.01Å
537	Y	84.8	Confident	82.8	Confident	71 Å²	71	44.6 Å²	44.6	28%	0.278	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.2	179.2	-69.1	-88.8	0	0	0	111.6	R534 M535 L662 R663	R534-Y537 HydrophobicContact CB-CD2 4.22Å; R534-Y537 PolarHBondContact O-N 3.37Å; M535-Y537 PolarHBondContact O-N 3.41Å; Y537-L662 CarbonylContact C-O 3.44Å; Y537-L662 WeakPolarHBondContact CA-O 3.5Å; Y537-L662 WeakPolarHBondContact CD1-O 3.39Å; Y537-R663 HydrophobicContact CD1-CG 4.34Å; Y537-R663 HydrophobicContact CE1-CG 3.68Å
538	L	87.9	Confident	82.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.1	167.5	-63.5	175.9	0	0	0	108.7	F567 F611 S661 L662 F664 M723 R727	L538-F567 HydrophobicContact CD1-CE1 4.43Å; L538-F567 HydrophobicContact CD2-CD1 4.04Å; L538-F567 HydrophobicContact CD2-CE1 3.9Å; L538-F611 HydrophobicContact CB-CD1 3.95Å; L538-F611 HydrophobicContact CB-CE1 3.7Å; L538-F611 HydrophobicContact CD1-CD1 4.5Å; L538-F611 HydrophobicContact CD1-CE1 3.85Å; L538-F611 HydrophobicContact CD1-CZ 4.21Å; L538-F611 HydrophobicContact CG-CE1 4.38Å; L538-S661 CarbonylContact O-C 3.56Å; L538-S661 WeakPolarHBondContact O-CA 3.5Å; L538-L662 HydrophobicContact CB-CB 4.46Å; L538-L662 PolarHBondContact N-O 3.36Å; L538-L662 PolarHBondContact O-N 2.94Å; L538-F664 HydrophobicContact CD1-CB 4.02Å; L538-F664 HydrophobicContact CD1-CD2 3.9Å; L538-F664 HydrophobicContact CD1-CG 3.94Å; L538-F664 HydrophobicContact CG-CB 3.8Å; L538-F664 HydrophobicContact CG-CD1 4.49Å; L538-F664 HydrophobicContact CG-CD2 4.47Å; L538-F664 HydrophobicContact CG-CG 4Å; L538-M723 HydrophobicContact CD1-SD 4.33Å; L538-R727 HydrophobicContact CD2-CG 4.09Å; L538-R727 VanDerWaalsContact CD2-NE 3.28Å
539	H	88.8	Confident	82.6	Confident	11 Å²	11	43.8 Å²	43.8	5%	0.051	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.2	-177.4	-59.8	-69.3	0	0	0	110.7	I501 S530 F611 F612 S661	I501-H539 HydrophobicContact CD1-CB 4.25Å; S530-H539 VanDerWaalsContact CB-CD2 3.41Å; S530-H539 WeakPolarHBondContact CB-CD2 3.48Å; H539-F611 WeakPolarHBondContact O-CA 3.28Å; H539-F612 HydrophobicContact CB-CD1 3.96Å; H539-F612 HydrophobicContact CB-CE1 3.57Å; H539-F612 HydrophobicContact CB-CZ 3.95Å; H539-F612 WeakPolarHBondContact O-CD1 3.39Å; H539-F612 PolarHBondContact O-N 3.21Å; H539-S661 PolarHBondContact CE1-OG 3.49Å; H539-S661 VanDerWaalsContact CE1-OG 3.26Å; H539-S661 PolarHBondContact ND1-OG 3.11Å
540	M	89.1	Confident	82.2	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.5	176.5	-70.8	-62.3	-66.4	0	0	109.4	I501 K609 T610 F611 G659 Y660 L662 L706	I501-M540 WeakPolarHBondContact CD1-O 3.32Å; M540-K609 HydrophobicContact CE-CB 3.85Å; M540-K609 HydrophobicContact CE-CD 3.99Å; M540-K609 HydrophobicContact CE-CG 3.63Å; M540-T610 CarbonylContact C-O 3.57Å; M540-T610 WeakPolarHBondContact CA-O 3.47Å; M540-F611 HydrophobicContact CG-CD1 4.38Å; M540-F611 HydrophobicContact CG-CE1 4.32Å; M540-F611 HydrophobicContact SD-CD1 3.35Å; M540-F611 WeakPolarHBondContact SD-CD1 3.22Å; M540-F611 HydrophobicContact SD-CD2 4.34Å; M540-F611 HydrophobicContact SD-CE1 3.44Å; M540-F611 WeakPolarHBondContact SD-CE1 3.2Å; M540-F611 HydrophobicContact SD-CE2 4.42Å; M540-F611 HydrophobicContact SD-CG 3.83Å; M540-F611 HydrophobicContact SD-CZ 4Å; M540-G659 WeakPolarHBondContact O-CA 3.42Å; M540-Y660 HydrophobicContact CB-CD1 4.36Å; M540-Y660 HydrophobicContact CB-CD2 4.2Å; M540-Y660 HydrophobicContact CB-CE1 4.11Å; M540-Y660 HydrophobicContact CB-CE2 3.95Å; M540-Y660 HydrophobicContact CB-CG 4.41Å; M540-Y660 HydrophobicContact CG-CD2 4.34Å; M540-Y660 HydrophobicContact CG-CE2 3.79Å; M540-Y660 PolarHBondContact N-O 2.63Å; M540-Y660 PolarHBondContact O-N 2.96Å; M540-L662 HydrophobicContact CG-CD1 3.72Å; M540-L662 HydrophobicContact CG-CG 4.08Å; M540-L662 HydrophobicContact SD-CD1 4.31Å; M540-L706 HydrophobicContact CE-CD1 3.88Å; M540-L706 HydrophobicContact CE-CD2 3.98Å; M540-L706 HydrophobicContact CE-CG 4.46Å; M540-L706 HydrophobicContact SD-CD1 4.2Å
541	I	90.1	Very high	81.7	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.9	172.6	-177.3	170.2	0	0	0	109.5	L544 L604 K609 T610 F612 V615 V657	I541-L544 HydrophobicContact CD1-CD1 4.2Å; I541-L604 HydrophobicContact CG1-CD1 4.18Å; I541-L604 HydrophobicContact CG2-CD1 4.26Å; I541-K609 WeakPolarHBondContact O-CA 3.49Å; I541-T610 HydrophobicContact CG2-CG2 3.64Å; I541-T610 WeakPolarHBondContact CG2-O 3.36Å; I541-T610 PolarHBondContact N-O 3.43Å; I541-T610 PolarHBondContact O-N 2.91Å; I541-F612 HydrophobicContact CB-CD1 3.52Å; I541-F612 HydrophobicContact CB-CE1 3.9Å; I541-F612 HydrophobicContact CB-CG 4.15Å; I541-F612 HydrophobicContact CG2-CB 4.18Å; I541-F612 HydrophobicContact CG2-CD1 3.99Å; I541-F612 HydrophobicContact CG2-CG 4.34Å; I541-V615 HydrophobicContact CD1-CG2 4.37Å; I541-V657 HydrophobicContact CB-CG1 4.25Å; I541-V657 HydrophobicContact CD1-CG1 3.63Å; I541-V657 HydrophobicContact CG1-CG1 3.72Å
542	I	89.8	Confident	81.2	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	-10.1	176.8	70.7	-169	0	0	0	112.1	L488 L492 L499 L604 G605 K609 F658 Y660	L488-I542 HydrophobicContact CD1-CD1 3.48Å; L488-I542 VanDerWaalsContact CD1-CD1 3.48Å; L488-I542 HydrophobicContact CD1-CG1 4.46Å; L488-I542 HydrophobicContact CD2-CB 4.41Å; L488-I542 HydrophobicContact CD2-CD1 4.26Å; L488-I542 HydrophobicContact CG-CD1 4.32Å; L492-I542 HydrophobicContact CD1-CG1 4.36Å; L492-I542 HydrophobicContact CD2-CD1 4.45Å; L492-I542 HydrophobicContact CD2-CG1 4.16Å; L499-I542 HydrophobicContact CD1-CD1 4.48Å; L499-I542 HydrophobicContact CD2-CD1 4.08Å; I542-L604 WeakPolarHBondContact O-CA 3.4Å; I542-L604 VanDerWaalsContact O-CB 3.25Å; I542-L604 WeakPolarHBondContact O-CB 3.25Å; I542-L604 PolarHBondContact O-N 3.44Å; I542-G605 PolarHBondContact O-N 2.98Å; I542-K609 HydrophobicContact CG2-CB 4Å; I542-F658 HydrophobicContact CG1-CB 4.29Å; I542-F658 PolarHBondContact N-O 2.95Å; I542-Y660 HydrophobicContact CG2-CD1 4.21Å; I542-Y660 HydrophobicContact CG2-CE1 3.88Å
543	G	89.8	Confident	81	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173	165	173.6	0	0	0	0	0	113.2	L602 F658	G543-L602 CarbonylContact C-O 3.55Å; G543-L602 WeakPolarHBondContact CA-O 3.02Å; G543-F658 PolarHBondContact N-O 3.05Å; G543-F658 PolarHBondContact O-N 2.78Å
544	L	90.9	Very high	80.9	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	139	177	-160.8	138.9	0	0	0	109.9	L528 I541 M546 W587 T601 L602 V615 I617 I655 V657	L528-L544 HydrophobicContact CD1-CD1 4.21Å; I541-L544 HydrophobicContact CD1-CD1 4.2Å; L544-M546 HydrophobicContact CD2-CG 3.67Å; L544-M546 HydrophobicContact CD2-SD 4.1Å; L544-W587 HydrophobicContact CB-CH2 4.48Å; L544-W587 HydrophobicContact CD2-CH2 3.56Å; L544-W587 HydrophobicContact CD2-CZ3 4.24Å; L544-T601 CarbonylContact O-C 3.42Å; L544-T601 WeakPolarHBondContact O-CA 3.35Å; L544-L602 PolarHBondContact N-O 3.34Å; L544-L602 PolarHBondContact O-N 3.36Å; L544-V615 HydrophobicContact CD1-CG1 3.91Å; L544-I617 HydrophobicContact CD1-CD1 4.28Å; L544-I617 HydrophobicContact CD2-CD1 3.92Å; L544-I655 HydrophobicContact CD2-CG2 4.37Å; L544-V657 HydrophobicContact CD1-CG2 4.13Å
545	S	90	Very high	80.5	Confident	6 Å²	6	45.7 Å²	45.7	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	138.6	177.3	179.6	0	0	0	0	111.3	W600 I655 Q656	S545-W600 CarbonylContact C-O 3.54Å; S545-W600 VanDerWaalsContact CA-O 3.29Å; S545-W600 WeakPolarHBondContact CA-O 3.08Å; S545-I655 WeakPolarHBondContact O-CA 3.07Å; S545-Q656 PolarHBondContact N-O 3.07Å; S545-Q656 PolarHBondContact O-N 2.9Å
546	M	89.5	Confident	80.2	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.6	176	-57.3	179.5	70.5	0	0	109.6	L526 L544 I548 F560 W587 W600 I617 I652 D654 I655	L526-M546 HydrophobicContact CD1-CE 4.16Å; L544-M546 HydrophobicContact CD2-CG 3.67Å; L544-M546 HydrophobicContact CD2-SD 4.1Å; M546-I548 HydrophobicContact CB-CD1 4.29Å; M546-I548 HydrophobicContact CB-CG1 4.23Å; M546-I548 HydrophobicContact CE-CD1 4.49Å; M546-F560 HydrophobicContact CE-CD1 4.38Å; M546-F560 HydrophobicContact CE-CE1 4.02Å; M546-F560 HydrophobicContact SD-CD1 4.18Å; M546-F560 HydrophobicContact SD-CE1 4.1Å; M546-W587 HydrophobicContact CG-CH2 4.38Å; M546-W587 HydrophobicContact SD-CH2 4.04Å; M546-W600 HydrophobicContact CB-CB 4.34Å; M546-W600 PolarHBondContact N-O 2.83Å; M546-W600 PolarHBondContact O-N 3.44Å; M546-I617 HydrophobicContact CE-CD1 4.18Å; M546-I617 HydrophobicContact CE-CG2 4.33Å; M546-I617 HydrophobicContact SD-CD1 3.86Å; M546-I617 HydrophobicContact SD-CG2 4.29Å; M546-I652 HydrophobicContact CE-CD1 4.22Å; M546-I652 HydrophobicContact CE-CG2 4.48Å; M546-D654 WeakPolarHBondContact CA-O 3.37Å; M546-I655 HydrophobicContact CE-CD1 3.98Å; M546-I655 HydrophobicContact CE-CG1 4.12Å; M546-I655 HydrophobicContact CG-CG1 4.34Å; M546-I655 HydrophobicContact CG-CG2 4.06Å
547	K	89.7	Confident	79.6	Confident	79 Å²	79	42.1 Å²	42.1	34%	0.343	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	113.9	173.4	-175.1	176.6	173.2	-179.7	0	109.4	L592 S653 D654	K547-L592 HydrophobicContact CD-CD1 4.04Å; K547-L592 HydrophobicContact CG-CD1 4.08Å; K547-S653 PolarHBondContact O-N 3.43Å; K547-D654 HydrophobicContact CB-CB 4.31Å; K547-D654 PolarHBondContact N-O 2.65Å
548	I	87.7	Confident	78.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	120.8	-173.9	-54.9	-179.4	0	0	0	109.7	M546 P558 F560 C597 F598 W600 I650 K651 I652	M546-I548 HydrophobicContact CB-CD1 4.29Å; M546-I548 HydrophobicContact CB-CG1 4.23Å; M546-I548 HydrophobicContact CE-CD1 4.49Å; I548-P558 HydrophobicContact CD1-CG 4.42Å; I548-F560 HydrophobicContact CD1-CE1 3.76Å; I548-F560 HydrophobicContact CD1-CE2 4.42Å; I548-F560 HydrophobicContact CD1-CZ 3.32Å; I548-C597 CarbonylContact O-C 3.42Å; I548-C597 WeakPolarHBondContact O-CA 3.34Å; I548-F598 PolarHBondContact N-O 2.84Å; I548-F598 PolarHBondContact O-N 2.71Å; I548-W600 HydrophobicContact CD1-CG 4.28Å; I548-I650 HydrophobicContact CG2-CB 4.3Å; I548-K651 CarbonylContact C-O 3.42Å; I548-K651 WeakPolarHBondContact CA-O 3.33Å; I548-I652 HydrophobicContact CG1-CG1 4.34Å
549	C	86.1	Confident	78.3	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.034	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.1	175.7	-54.2	0	0	0	0	110.7	Q596 C597 I650 K651	C549-Q596 WeakPolarHBondContact CA-O 3.48Å; C549-C597 HydrophobicContact CB-CB 4.04Å; C549-C597 WeakPolarHBondContact CB-SG 3.49Å; C549-C597 WeakPolarHBondContact SG-CB 3.44Å; C549-C597 CovalentContact SG-SG 2.04Å; C549-C597 PolarHBondContact SG-SG 3.02Å; C549-I650 CarbonylContact O-C 3.4Å; C549-I650 WeakPolarHBondContact O-CA 3.33Å; C549-K651 HydrophobicContact CB-CB 4.25Å; C549-K651 PolarHBondContact N-O 3.49Å; C549-K651 PolarHBondContact O-N 3.24Å
550	Q	80.3	Confident	77.8	Confident	18 Å²	18	43 Å²	43	8%	0.084	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	150.5	177.9	-72.1	176.9	-6.4	0	0	109.4	S554 D557 Q596 I650	Q550-S554 WeakPolarHBondContact CB-OG 3.5Å; Q550-D557 PolarHBondContact NE2-OD1 2.8Å; Q550-Q596 PolarHBondContact N-O 3.25Å; Q550-Q596 WeakPolarHBondContact O-CB 3.33Å; Q550-Q596 PolarHBondContact O-OE1 3.42Å; Q550-Q596 VanDerWaalsContact O-OE1 3.04Å; Q550-I650 HydrophobicContact CG-CG2 4.11Å
551	M	74.1	Confident	77.7	Confident	73 Å²	73	46.9 Å²	46.9	36%	0.36	23%	0.234	S	C	.	.			trans	-81.3	158.8	172.4	-80.6	-74.4	-110.8	0	0	111.5	F515 N553 S554 Y649	F515-M551 HydrophobicContact CD1-CG 4.31Å; F515-M551 HydrophobicContact CE1-CG 3.98Å; F515-M551 HydrophobicContact CE1-SD 4.47Å; M551-N553 PolarHBondContact O-N 2.93Å; M551-S554 PolarHBondContact O-N 3.35Å; M551-S554 VanDerWaalsContact O-N 3.16Å; M551-S554 PolarHBondContact O-OG 3Å; M551-Y649 PolarHBondContact N-O 2.94Å
552	R	60.9	Low	77.6	Confident	215 Å²	215	46.9 Å²	46.9	81%	0.811	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-11.9	-162.2	-52.3	-150	153.6	158.5	-7.4	116.7	Q596	R552-Q596 VanDerWaalsContact CA-NE2 3.29Å; R552-Q596 VanDerWaalsContact CB-NE2 3.33Å; R552-Q596 VanDerWaalsContact CG-OE1 3.32Å
553	N	56.9	Low	77.6	Confident	143 Å²	143	49.7 Å²	49.7	77%	0.765	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.7	11.7	-175.1	-72.9	-5	0	0	0	115.2	M551	M551-N553 PolarHBondContact O-N 2.93Å
554	S	59.2	Low	77.7	Confident	13 Å²	13	49.7 Å²	49.7	9%	0.091	25%	0.245	C	C	.	.			trans	-90.7	113.3	178.4	66.8	0	0	0	0	112	Q550 M551	Q550-S554 WeakPolarHBondContact CB-OG 3.5Å; M551-S554 PolarHBondContact O-N 3.35Å; M551-S554 VanDerWaalsContact O-N 3.16Å; M551-S554 PolarHBondContact O-OG 3Å
555	S	56.3	Low	77.6	Confident	120 Å²	120	49.6 Å²	49.6	84%	0.839	24%	0.244	S	C	*	.			trans	-93.4	3.7	179.2	62.7	0	0	0	0	114.8
556	I	61.8	Low	77.6	Confident	49 Å²	49	49.4 Å²	49.4	25%	0.251	24%	0.243	S	C	.	.			trans	-103.6	115.9	-173.4	-64.5	163.8	0	0	0	109.5	I648	I556-I648 HydrophobicContact CD1-CD1 3.67Å
557	D	67.5	Low	77.5	Confident	74 Å²	74	49.8 Å²	49.8	40%	0.396	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-75.2	132.8	170.9	-82.3	-24.4	0	0	0	110.9	Q550 K589 W600	Q550-D557 PolarHBondContact NE2-OD1 2.8Å; D557-K589 IonicContact OD1-NZ 3.01Å; D557-K589 PolarHBondContact OD1-NZ 3.01Å; D557-K589 IonicContact OD2-NZ 3.16Å; D557-K589 PolarHBondContact OD2-NZ 3.13Å; D557-W600 HydrophobicContact CB-CH2 4Å; D557-W600 HydrophobicContact CB-CZ2 4.25Å
558	P	70.9	Confident	77.1	Confident	11 Å²	11	46.5 Å²	46.5	7%	0.071	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-65.2	137.7	175.5	26.5	-34	0	0	0	110.8	I548 F560 L619 I650	I548-P558 HydrophobicContact CD1-CG 4.42Å; P558-F560 HydrophobicContact CB-CE1 4.24Å; P558-F560 HydrophobicContact CB-CE2 4.34Å; P558-F560 HydrophobicContact CB-CZ 3.85Å; P558-F560 HydrophobicContact CG-CE1 4.22Å; P558-F560 HydrophobicContact CG-CE2 3.93Å; P558-F560 HydrophobicContact CG-CZ 3.42Å; P558-F560 VanDerWaalsContact CG-CZ 3.42Å; P558-F560 VanDerWaalsContact O-CE2 3.29Å; P558-F560 WeakPolarHBondContact O-CE2 3.25Å; P558-L619 HydrophobicContact CB-CD1 4.06Å; P558-L619 HydrophobicContact CB-CD2 4.23Å; P558-L619 HydrophobicContact CB-CG 4.2Å; P558-I650 HydrophobicContact CB-CD1 4.47Å
559	M	75.1	Confident	76.5	Confident	75 Å²	75	48.7 Å²	48.7	37%	0.369	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.9	169.3	-64.8	-152.3	-50.5	0	0	110.5	R620 R622	M559-R620 PolarHBondContact O-N 3.23Å; M559-R620 VanDerWaalsContact O-N 3.08Å; M559-R622 HydrophobicContact CE-CG 4.22Å
560	F	78.9	Confident	76.1	Confident	14 Å²	14	50.7 Å²	50.7	6%	0.061	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.9	-179.4	-50.4	-82.5	0	0	0	110.7	M546 I548 P558 W587 W600 I617 Y618 L619	M546-F560 HydrophobicContact CE-CD1 4.38Å; M546-F560 HydrophobicContact CE-CE1 4.02Å; M546-F560 HydrophobicContact SD-CD1 4.18Å; M546-F560 HydrophobicContact SD-CE1 4.1Å; I548-F560 HydrophobicContact CD1-CE1 3.76Å; I548-F560 HydrophobicContact CD1-CE2 4.42Å; I548-F560 HydrophobicContact CD1-CZ 3.32Å; P558-F560 HydrophobicContact CB-CE1 4.24Å; P558-F560 HydrophobicContact CB-CE2 4.34Å; P558-F560 HydrophobicContact CB-CZ 3.85Å; P558-F560 HydrophobicContact CG-CE1 4.22Å; P558-F560 HydrophobicContact CG-CE2 3.93Å; P558-F560 HydrophobicContact CG-CZ 3.42Å; P558-F560 VanDerWaalsContact CG-CZ 3.42Å; P558-F560 VanDerWaalsContact O-CE2 3.29Å; P558-F560 WeakPolarHBondContact O-CE2 3.25Å; F560-W587 HydrophobicContact CB-CZ2 4.48Å; F560-W600 HydrophobicContact CD2-CE3 4.33Å; F560-W600 HydrophobicContact CD2-CZ3 4.46Å; F560-W600 AromaticContact CE2-CD2 3.96Å; F560-W600 HydrophobicContact CE2-CD2 3.96Å; F560-W600 AromaticContact CE2-CE3 3.63Å; F560-W600 HydrophobicContact CE2-CE3 3.63Å; F560-W600 HydrophobicContact CE2-CH2 4.31Å; F560-W600 AromaticContact CE2-CZ3 3.84Å; F560-W600 HydrophobicContact CE2-CZ3 3.84Å; F560-W600 HydrophobicContact CZ-CD2 4.45Å; F560-I617 HydrophobicContact CB-CG2 4.41Å; F560-I617 HydrophobicContact CD1-CG2 4.04Å; F560-Y618 WeakPolarHBondContact CA-O 3.25Å; F560-L619 HydrophobicContact CD1-CD1 3.47Å; F560-L619 VanDerWaalsContact CD1-CD1 3.47Å; F560-L619 HydrophobicContact CE1-CD1 3.25Å; F560-L619 HydrophobicContact CZ-CD1 4.26Å
561	F	86.1	Confident	75.7	Confident	82 Å²	82	52.8 Å²	52.8	36%	0.36	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.7	162.3	-62.5	-91.4	0	0	0	107.8	Y563 Y618 R620	F561-Y563 HydrophobicContact CB-CE2 4.27Å; F561-Y618 PolarHBondContact N-O 3.21Å; F561-Y618 PolarHBondContact O-N 3.06Å; F561-R620 HydrophobicContact CE2-CB 4.19Å
562	V	88.6	Confident	75.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.5	179.1	-177.3	0	0	0	0	108.6	V564 M577 F579 W587 V615 H616 I617	V562-V564 HydrophobicContact CG1-CG2 4.18Å; V562-M577 HydrophobicContact CB-CB 4.46Å; V562-M577 HydrophobicContact CB-CG 4.47Å; V562-M577 HydrophobicContact CB-SD 3.93Å; V562-M577 HydrophobicContact CG1-SD 3.73Å; V562-M577 PolarHBondContact O-N 3.38Å; V562-F579 HydrophobicContact CB-CE2 4.42Å; V562-F579 HydrophobicContact CB-CZ 3.7Å; V562-F579 HydrophobicContact CG2-CE2 4.29Å; V562-F579 HydrophobicContact CG2-CZ 3.62Å; V562-W587 HydrophobicContact CG2-CZ2 4.01Å; V562-V615 HydrophobicContact CG1-CG1 3.42Å; V562-V615 VanDerWaalsContact CG1-CG1 3.42Å; V562-H616 CarbonylContact C-O 3.52Å; V562-H616 WeakPolarHBondContact CA-O 3.46Å; V562-I617 HydrophobicContact CG1-CG1 4.49Å; V562-I617 HydrophobicContact CG2-CG1 4.15Å; V562-I617 HydrophobicContact CG2-CG2 4.19Å
563	Y	89.8	Confident	76.9	Confident	61 Å²	61	44.9 Å²	44.9	24%	0.239	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.2	170.2	-74.2	-103.2	0	0	0	108.6	F561 H571 W575 V615 H616 Y618	F561-Y563 HydrophobicContact CB-CE2 4.27Å; Y563-H571 AromaticContact CD1-NE2 3.77Å; Y563-H571 AromaticContact CD2-NE2 3.82Å; Y563-H571 AromaticContact CG-NE2 3.66Å; Y563-W575 CarbonylContact C-O 3.19Å; Y563-W575 VanDerWaalsContact CA-O 3.23Å; Y563-W575 WeakPolarHBondContact CA-O 3.36Å; Y563-V615 WeakPolarHBondContact O-CA 3.26Å; Y563-H616 PolarHBondContact N-O 2.78Å; Y563-H616 PolarHBondContact O-N 2.73Å; Y563-Y618 AromaticContact CD2-CD2 3.6Å; Y563-Y618 HydrophobicContact CD2-CD2 3.6Å; Y563-Y618 AromaticContact CD2-CE2 3.6Å; Y563-Y618 HydrophobicContact CD2-CE2 3.6Å; Y563-Y618 AromaticContact CE2-CD2 3.89Å; Y563-Y618 HydrophobicContact CE2-CD2 3.89Å; Y563-Y618 HydrophobicContact CE2-CE2 4.03Å; Y563-Y618 HydrophobicContact CG-CE2 4.31Å
564	V	90.5	Very high	78.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.1	175.7	179.7	0	0	0	0	108.8	V562 G574 W575 M577 T610 F611 F612 V615	V562-V564 HydrophobicContact CG1-CG2 4.18Å; V564-G574 CarbonylContact O-C 3.57Å; V564-G574 VanDerWaalsContact O-CA 3.25Å; V564-G574 WeakPolarHBondContact O-CA 3.36Å; V564-W575 HydrophobicContact CB-CZ2 4.29Å; V564-W575 PolarHBondContact N-O 3.24Å; V564-W575 PolarHBondContact O-N 3.37Å; V564-M577 HydrophobicContact CG2-CE 3.39Å; V564-M577 HydrophobicContact CG2-CG 4.2Å; V564-M577 HydrophobicContact CG2-SD 4.02Å; V564-T610 HydrophobicContact CG1-CG2 4.37Å; V564-F611 WeakPolarHBondContact CG1-O 3.42Å; V564-F612 HydrophobicContact CG1-CB 3.7Å; V564-V615 HydrophobicContact CG2-CG1 4.46Å; V564-V615 HydrophobicContact CG2-CG2 4.4Å
565	N	90.6	Very high	79.6	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.011	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.5	167.6	-175.2	-38.3	0	0	0	108.6	F567 S568 S570 E573 F612 E613 T614	N565-F567 PolarHBondContact OD1-N 3.49Å; N565-S568 PolarHBondContact ND2-O 3.48Å; N565-S568 PolarHBondContact ND2-OG 2.84Å; N565-S568 WeakPolarHBondContact OD1-CA 3.47Å; N565-S568 PolarHBondContact OD1-N 3.31Å; N565-S568 PolarHBondContact OD1-O 2.91Å; N565-S570 PolarHBondContact ND2-O 2.98Å; N565-E573 PolarHBondContact ND2-O 3.44Å; N565-F612 CarbonylContact O-C 3.58Å; N565-F612 WeakPolarHBondContact O-CA 3.44Å; N565-E613 PolarHBondContact O-N 3.32Å; N565-T614 WeakPolarHBondContact CB-OG1 3.45Å; N565-T614 PolarHBondContact N-O 3.41Å; N565-T614 PolarHBondContact O-N 2.62Å
566	P	88.8	Confident	81.1	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.013	20%	0.204	C	C	.	.	S	Bend	trans	-74.5	-31	-173.5	30	-36.8	0	0	0	114.7	F611 F612 E613 L719 L760	P566-F611 WeakPolarHBondContact CA-O 3.4Å; P566-F611 HydrophobicContact CB-CB 3.69Å; P566-F612 CarbonylContact O-C 3.59Å; P566-E613 PolarHBondContact O-N 2.82Å; P566-L719 HydrophobicContact CB-CD2 4.45Å; P566-L719 HydrophobicContact CG-CD2 3.95Å; P566-L760 HydrophobicContact CG-CD2 4.14Å
567	F	88	Confident	82.4	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.035	19%	0.194	C	C	.	.	S	Bend	trans	-141.6	-7.1	-168.4	-54.2	-66.3	0	0	0	115.3	L538 N565 F611 L719 C722 M723 H726 R727	L538-F567 HydrophobicContact CD1-CE1 4.43Å; L538-F567 HydrophobicContact CD2-CD1 4.04Å; L538-F567 HydrophobicContact CD2-CE1 3.9Å; N565-F567 PolarHBondContact OD1-N 3.49Å; F567-F611 HydrophobicContact CE1-CB 4.16Å; F567-F611 HydrophobicContact CE1-CD1 4.32Å; F567-F611 HydrophobicContact CE1-CD2 4.22Å; F567-F611 AromaticContact CE1-CG 3.98Å; F567-F611 HydrophobicContact CE1-CG 3.98Å; F567-F611 HydrophobicContact CZ-CB 4.11Å; F567-F611 AromaticContact CZ-CD2 3.71Å; F567-F611 HydrophobicContact CZ-CD2 3.71Å; F567-F611 HydrophobicContact CZ-CE2 4.27Å; F567-F611 AromaticContact CZ-CG 3.9Å; F567-F611 HydrophobicContact CZ-CG 3.9Å; F567-L719 HydrophobicContact CE2-CB 4.4Å; F567-L719 WeakPolarHBondContact CE2-O 3.48Å; F567-C722 HydrophobicContact CD2-CB 3.81Å; F567-C722 HydrophobicContact CE2-CB 4.32Å; F567-M723 HydrophobicContact CD1-CB 4.5Å; F567-M723 HydrophobicContact CD1-CG 4.39Å; F567-M723 HydrophobicContact CD2-CB 4.1Å; F567-M723 HydrophobicContact CE1-CB 4.14Å; F567-M723 HydrophobicContact CE1-CG 3.99Å; F567-M723 HydrophobicContact CE2-CB 3.7Å; F567-M723 HydrophobicContact CE2-CG 4.45Å; F567-M723 HydrophobicContact CG-CB 4.49Å; F567-M723 HydrophobicContact CZ-CB 3.72Å; F567-M723 HydrophobicContact CZ-CG 4.02Å; F567-H726 HydrophobicContact CB-CB 3.92Å; F567-R727 HydrophobicContact CD1-CG 4.09Å
568	S	81.6	Confident	83.3	Confident	10 Å²	10	30.8 Å²	30.8	7%	0.07	18%	0.181	C	C	.	.			trans	-129.6	172.5	-175.4	117.4	0	0	0	0	111.3	N565 S570 E573 T614 H726	N565-S568 PolarHBondContact ND2-O 3.48Å; N565-S568 PolarHBondContact ND2-OG 2.84Å; N565-S568 WeakPolarHBondContact OD1-CA 3.47Å; N565-S568 PolarHBondContact OD1-N 3.31Å; N565-S568 PolarHBondContact OD1-O 2.91Å; S568-S570 PolarHBondContact OG-N 3.41Å; S568-S570 VanDerWaalsContact OG-N 3.11Å; S568-E573 WeakPolarHBondContact CB-OE2 3.4Å; S568-E573 PolarHBondContact OG-OE2 3.34Å; S568-T614 PolarHBondContact O-OG1 3.07Å; S568-H726 VanDerWaalsContact CB-CE1 3.44Å; S568-H726 WeakPolarHBondContact CB-CE1 3.35Å
569	G	73.9	Confident	84	Confident	46 Å²	46	32.6 Å²	32.6	47%	0.474	19%	0.188	S	C	.	.	S	Bend	trans	-100.2	2.7	175	0	0	0	0	0	113.9
570	S	77.8	Confident	84.2	Confident	47 Å²	47	30.1 Å²	30.1	33%	0.329	18%	0.182	S	C	.	.			trans	-88.5	134.8	-174.8	-174.3	0	0	0	0	111.5	N565 S568 S572 E573	N565-S570 PolarHBondContact ND2-O 2.98Å; S568-S570 PolarHBondContact OG-N 3.41Å; S568-S570 VanDerWaalsContact OG-N 3.11Å; S570-S572 PolarHBondContact O-N 3.29Å; S570-S572 PolarHBondContact OG-N 3.43Å; S570-S572 PolarHBondContact OG-OG 3.12Å; S570-E573 PolarHBondContact O-N 3.39Å
571	H	71.5	Confident	84.4	Confident	63 Å²	63	34.9 Å²	34.9	29%	0.292	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-64.6	-26	172.8	-178.5	-90.7	0	0	0	113.1	R523 Y563 E573 Y618	R523-H571 PolarHBondContact NH2-NE2 3.05Å; Y563-H571 AromaticContact CD1-NE2 3.77Å; Y563-H571 AromaticContact CD2-NE2 3.82Å; Y563-H571 AromaticContact CG-NE2 3.66Å; H571-E573 VanDerWaalsContact C-N 3.31Å; H571-E573 PolarHBondContact O-N 2.84Å; H571-Y618 AromaticContact CD2-CE2 3.58Å; H571-Y618 AromaticContact CD2-CZ 3.6Å; H571-Y618 PolarHBondContact CD2-OH 3.08Å; H571-Y618 AromaticContact NE2-CE2 3.17Å; H571-Y618 WeakPolarHBondContact NE2-CE2 3.43Å; H571-Y618 AromaticContact NE2-CZ 3.45Å; H571-Y618 PolarHBondContact NE2-OH 3.47Å
572	S	78.6	Confident	84.1	Confident	93 Å²	93	35.7 Å²	35.7	65%	0.65	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-74	-20.9	-177.8	61.9	0	0	0	0	114	S570	S570-S572 PolarHBondContact O-N 3.29Å; S570-S572 PolarHBondContact OG-N 3.43Å; S570-S572 PolarHBondContact OG-OG 3.12Å
573	E	82.9	Confident	83.5	Confident	29 Å²	29	38.4 Å²	38.4	14%	0.136	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-105.7	19.8	-178	-64.9	174	149.2	0	0	111	N565 S568 S570 H571 K725 H726	N565-E573 PolarHBondContact ND2-O 3.44Å; S568-E573 WeakPolarHBondContact CB-OE2 3.4Å; S568-E573 PolarHBondContact OG-OE2 3.34Å; S570-E573 PolarHBondContact O-N 3.39Å; H571-E573 VanDerWaalsContact C-N 3.31Å; H571-E573 PolarHBondContact O-N 2.84Å; E573-K725 IonicContact OE1-NZ 3.48Å; E573-K725 PolarHBondContact OE1-NZ 3.37Å; E573-H726 IonicContact OE1-CE1 2.63Å; E573-H726 IonicContact OE1-NE2 2.67Å; E573-H726 PolarHBondContact OE1-NE2 2.91Å; E573-H726 IonicContact OE2-CE1 2.82Å; E573-H726 PolarHBondContact OE2-CE1 3.18Å; E573-H726 IonicContact OE2-NE2 3.32Å; E573-H726 PolarHBondContact OE2-NE2 3Å; E573-H726 VanDerWaalsContact OE2-NE2 3.09Å
574	G	83.6	Confident	83.3	Confident	13 Å²	13	35.8 Å²	35.8	13%	0.134	23%	0.227	C	C	.	.			trans	-114.1	161.9	176.8	0	0	0	0	0	112.2	V564	V564-G574 CarbonylContact O-C 3.57Å; V564-G574 VanDerWaalsContact O-CA 3.25Å; V564-G574 WeakPolarHBondContact O-CA 3.36Å
575	W	88.2	Confident	83.2	Confident	15 Å²	15	37 Å²	37	6%	0.057	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152.9	179.2	59.8	-90.3	0	0	0	111	Y563 V564 M577 T610 P708 L717 L760	Y563-W575 CarbonylContact C-O 3.19Å; Y563-W575 VanDerWaalsContact CA-O 3.23Å; Y563-W575 WeakPolarHBondContact CA-O 3.36Å; V564-W575 HydrophobicContact CB-CZ2 4.29Å; V564-W575 PolarHBondContact N-O 3.24Å; V564-W575 PolarHBondContact O-N 3.37Å; W575-M577 HydrophobicContact CH2-CE 4.48Å; W575-M577 HydrophobicContact CH2-CG 4Å; W575-M577 HydrophobicContact CZ3-CB 4.33Å; W575-M577 HydrophobicContact CZ3-CG 3.75Å; W575-T610 HydrophobicContact CH2-CG2 4.21Å; W575-T610 HydrophobicContact CZ2-CG2 3.57Å; W575-P708 HydrophobicContact CD2-CB 4.19Å; W575-P708 HydrophobicContact CD2-CG 3.59Å; W575-P708 HydrophobicContact CE3-CB 3.66Å; W575-P708 HydrophobicContact CE3-CG 3.51Å; W575-P708 HydrophobicContact CG-CG 4.11Å; W575-P708 HydrophobicContact CH2-CB 3.76Å; W575-P708 HydrophobicContact CH2-CG 4.16Å; W575-P708 HydrophobicContact CZ2-CB 4.25Å; W575-P708 HydrophobicContact CZ2-CG 4.2Å; W575-P708 HydrophobicContact CZ3-CB 3.42Å; W575-P708 VanDerWaalsContact CZ3-CB 3.42Å; W575-P708 HydrophobicContact CZ3-CG 3.81Å; W575-L717 HydrophobicContact CB-CD1 3.69Å; W575-L717 HydrophobicContact CG-CD1 3.92Å; W575-L760 HydrophobicContact CB-CD1 4.39Å
576	S	88.1	Confident	83	Confident	48 Å²	48	45.5 Å²	45.5	34%	0.336	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.3	-179.5	-176.9	0	0	0	0	111.2	P578	S576-P578 WeakPolarHBondContact O-CD 3.36Å
577	M	88.9	Confident	83	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.034	27%	0.274	C	S	.	.			trans	-64.6	122.9	174.8	-77	178.8	158.8	0	0	112	V562 V564 W575 F579 Y584 L602 L604	V562-M577 HydrophobicContact CB-CB 4.46Å; V562-M577 HydrophobicContact CB-CG 4.47Å; V562-M577 HydrophobicContact CB-SD 3.93Å; V562-M577 HydrophobicContact CG1-SD 3.73Å; V562-M577 PolarHBondContact O-N 3.38Å; V564-M577 HydrophobicContact CG2-CE 3.39Å; V564-M577 HydrophobicContact CG2-CG 4.2Å; V564-M577 HydrophobicContact CG2-SD 4.02Å; W575-M577 HydrophobicContact CH2-CE 4.48Å; W575-M577 HydrophobicContact CH2-CG 4Å; W575-M577 HydrophobicContact CZ3-CB 4.33Å; W575-M577 HydrophobicContact CZ3-CG 3.75Å; M577-F579 VanDerWaalsContact C-N 3.32Å; M577-F579 HydrophobicContact CB-CD1 4.06Å; M577-F579 HydrophobicContact CB-CE1 3.46Å; M577-F579 VanDerWaalsContact CB-CE1 3.46Å; M577-F579 HydrophobicContact CB-CE2 4.37Å; M577-F579 HydrophobicContact CB-CZ 3.67Å; M577-F579 HydrophobicContact CG-CE1 4.31Å; M577-F579 PolarHBondContact O-N 3.09Å; M577-F579 HydrophobicContact SD-CE1 3.96Å; M577-F579 HydrophobicContact SD-CZ 4.3Å; M577-Y584 HydrophobicContact CB-CE1 4.18Å; M577-Y584 HydrophobicContact CG-CE1 4.34Å; M577-L602 HydrophobicContact SD-CD2 3.98Å; M577-L604 HydrophobicContact CE-CD1 3.88Å; M577-L604 HydrophobicContact CE-CD2 4.49Å
578	P	87.5	Confident	83	Confident	20 Å²	20	50.9 Å²	50.9	13%	0.13	29%	0.29	C	S	.	.			trans	-86.6	66.5	-175.1	35.9	-36.5	0	0	0	111.4	S576 G580 E581 Y584 P709	S576-P578 WeakPolarHBondContact O-CD 3.36Å; P578-G580 PolarHBondContact O-N 2.61Å; P578-E581 HydrophobicContact CB-CB 4.2Å; P578-E581 PolarHBondContact O-N 3.16Å; P578-E581 VanDerWaalsContact O-N 3.1Å; P578-Y584 HydrophobicContact CG-CD1 4.33Å; P578-Y584 HydrophobicContact CG-CD2 4.08Å; P578-Y584 HydrophobicContact CG-CG 3.97Å; P578-Y584 VanDerWaalsContact O-CB 3.26Å; P578-Y584 WeakPolarHBondContact O-CB 3.33Å; P578-P709 HydrophobicContact CG-CG 4.44Å
579	F	85.5	Confident	83.2	Confident	48 Å²	48	54.2 Å²	54.2	21%	0.211	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	120.6	-173.4	-55.4	-54.2	0	0	0	113.5	V562 M577 E581 Y584 W587 L602	V562-F579 HydrophobicContact CB-CE2 4.42Å; V562-F579 HydrophobicContact CB-CZ 3.7Å; V562-F579 HydrophobicContact CG2-CE2 4.29Å; V562-F579 HydrophobicContact CG2-CZ 3.62Å; M577-F579 VanDerWaalsContact C-N 3.32Å; M577-F579 HydrophobicContact CB-CD1 4.06Å; M577-F579 HydrophobicContact CB-CE1 3.46Å; M577-F579 VanDerWaalsContact CB-CE1 3.46Å; M577-F579 HydrophobicContact CB-CE2 4.37Å; M577-F579 HydrophobicContact CB-CZ 3.67Å; M577-F579 HydrophobicContact CG-CE1 4.31Å; M577-F579 PolarHBondContact O-N 3.09Å; M577-F579 HydrophobicContact SD-CE1 3.96Å; M577-F579 HydrophobicContact SD-CZ 4.3Å; F579-E581 PolarHBondContact O-N 3.4Å; F579-Y584 HydrophobicContact CD1-CD1 4.49Å; F579-Y584 HydrophobicContact CD1-CE1 4.46Å; F579-W587 AromaticContact CE1-NE1 3.79Å; F579-W587 AromaticContact CE2-NE1 3.71Å; F579-W587 HydrophobicContact CZ-CZ2 4.36Å; F579-W587 AromaticContact CZ-NE1 3.55Å; F579-L602 HydrophobicContact CD1-CD1 4.05Å; F579-L602 HydrophobicContact CD1-CD2 4.26Å; F579-L602 HydrophobicContact CE1-CD1 4.13Å; F579-L602 HydrophobicContact CE1-CD2 3.55Å; F579-L602 HydrophobicContact CE1-CG 4.5Å; F579-L602 HydrophobicContact CZ-CD2 4.46Å
580	G	78.7	Confident	83.8	Confident	24 Å²	24	56.1 Å²	56.1	25%	0.247	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.4	4.9	177.2	0	0	0	0	0	115.7	P578 Y584 P585	P578-G580 PolarHBondContact O-N 2.61Å; G580-Y584 VanDerWaalsContact CA-O 3.23Å; G580-Y584 WeakPolarHBondContact CA-O 3.12Å; G580-Y584 PolarHBondContact N-O 3.16Å; G580-Y584 VanDerWaalsContact N-O 3.14Å; G580-P585 PolarHBondContact N-O 3.1Å
581	E	82.3	Confident	84.1	Confident	114 Å²	114	61.8 Å²	61.8	53%	0.533	32%	0.319	S	S	.	.	S	Bend	trans	-97.6	146.1	173.2	-60.6	-179.4	176.8	0	0	109.7	P578 F579 G583 Y584	P578-E581 HydrophobicContact CB-CB 4.2Å; P578-E581 PolarHBondContact O-N 3.16Å; P578-E581 VanDerWaalsContact O-N 3.1Å; F579-E581 PolarHBondContact O-N 3.4Å; E581-G583 PolarHBondContact O-N 3.1Å; E581-Y584 WeakPolarHBondContact O-CB 3.46Å; E581-Y584 PolarHBondContact O-N 3.02Å
582	H	80.4	Confident	84.7	Confident	99 Å²	99	61 Å²	61	46%	0.458	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	27.3	174.8	-52.4	-61.5	0	0	0	115.8	P709	H582-P709 HydrophobicContact CB-CB 4.47Å
583	G	77.2	Confident	84.6	Confident	57 Å²	57	65.5 Å²	65.5	59%	0.588	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	6.8	-177.6	0	0	0	0	0	115	E581 W608	E581-G583 PolarHBondContact O-N 3.1Å; G583-W608 WeakPolarHBondContact O-CZ2 3.43Å; G583-W608 PolarHBondContact O-NE1 2.86Å
584	Y	85.4	Confident	83.8	Confident	7 Å²	7	72.8 Å²	72.8	3%	0.027	37%	0.367	C	S	.	.			trans	-69	144.2	174.3	-153.1	-95.4	0	0	0	111	M577 P578 F579 G580 E581 L604 W608 P709	M577-Y584 HydrophobicContact CB-CE1 4.18Å; M577-Y584 HydrophobicContact CG-CE1 4.34Å; P578-Y584 HydrophobicContact CG-CD1 4.33Å; P578-Y584 HydrophobicContact CG-CD2 4.08Å; P578-Y584 HydrophobicContact CG-CG 3.97Å; P578-Y584 VanDerWaalsContact O-CB 3.26Å; P578-Y584 WeakPolarHBondContact O-CB 3.33Å; F579-Y584 HydrophobicContact CD1-CD1 4.49Å; F579-Y584 HydrophobicContact CD1-CE1 4.46Å; G580-Y584 VanDerWaalsContact CA-O 3.23Å; G580-Y584 WeakPolarHBondContact CA-O 3.12Å; G580-Y584 PolarHBondContact N-O 3.16Å; G580-Y584 VanDerWaalsContact N-O 3.14Å; E581-Y584 WeakPolarHBondContact O-CB 3.46Å; E581-Y584 PolarHBondContact O-N 3.02Å; Y584-L604 HydrophobicContact CE1-CD2 3.81Å; Y584-L604 WeakPolarHBondContact OH-CD2 3.45Å; Y584-W608 HydrophobicContact CD2-CB 4.34Å; Y584-W608 AromaticContact CD2-CD2 3.81Å; Y584-W608 HydrophobicContact CD2-CD2 3.81Å; Y584-W608 AromaticContact CD2-CE3 3.82Å; Y584-W608 HydrophobicContact CD2-CE3 3.82Å; Y584-W608 HydrophobicContact CD2-CG 4.09Å; Y584-W608 HydrophobicContact CD2-CZ3 4.39Å; Y584-W608 HydrophobicContact CE2-CB 3.87Å; Y584-W608 HydrophobicContact CE2-CD2 4.16Å; Y584-W608 HydrophobicContact CE2-CE3 4.1Å; Y584-W608 HydrophobicContact CE2-CG 4.12Å; Y584-P709 HydrophobicContact CD2-CG 4Å
585	P	87.1	Confident	83.3	Confident	24 Å²	24	73.8 Å²	73.8	16%	0.156	37%	0.372	C	S	.	.			trans	-63.5	155.2	-175.6	25.5	-38	0	0	0	113.7	G580 L602 L603 L604 W608	G580-P585 PolarHBondContact N-O 3.1Å; P585-L602 HydrophobicContact CB-CD1 4.1Å; P585-L602 HydrophobicContact CG-CD1 4.1Å; P585-L603 WeakPolarHBondContact CB-O 3.13Å; P585-L603 VanDerWaalsContact CG-O 3.27Å; P585-L603 WeakPolarHBondContact CG-O 3.38Å; P585-L604 HydrophobicContact CG-CD2 3.62Å; P585-W608 VanDerWaalsContact CD-CD1 3.45Å
586	R	88	Confident	82.8	Confident	182 Å²	182	75.8 Å²	75.8	69%	0.687	38%	0.383	S	S	*	.			trans	-105.9	162.8	171.9	-66.3	-177.2	179.5	166.3	2.3	110	E588	R586-E588 PolarHBondContact O-N 3.17Å
587	W	87.3	Confident	82.7	Confident	43 Å²	43	74.4 Å²	74.4	16%	0.163	37%	0.373	C	S	.	.			trans	-66.5	127	171.8	-71.2	96	0	0	0	111.3	L544 M546 F560 V562 F579 W600 L602	L544-W587 HydrophobicContact CB-CH2 4.48Å; L544-W587 HydrophobicContact CD2-CH2 3.56Å; L544-W587 HydrophobicContact CD2-CZ3 4.24Å; M546-W587 HydrophobicContact CG-CH2 4.38Å; M546-W587 HydrophobicContact SD-CH2 4.04Å; F560-W587 HydrophobicContact CB-CZ2 4.48Å; V562-W587 HydrophobicContact CG2-CZ2 4.01Å; F579-W587 AromaticContact CE1-NE1 3.79Å; F579-W587 AromaticContact CE2-NE1 3.71Å; F579-W587 HydrophobicContact CZ-CZ2 4.36Å; F579-W587 AromaticContact CZ-NE1 3.55Å; W587-W600 HydrophobicContact CB-CE3 3.92Å; W587-W600 HydrophobicContact CB-CZ3 4.24Å; W587-W600 HydrophobicContact CE3-CB 3.93Å; W587-W600 HydrophobicContact CG-CE3 4.32Å; W587-W600 HydrophobicContact CZ3-CB 4.14Å; W587-W600 WeakPolarHBondContact CZ3-O 3.42Å; W587-L602 HydrophobicContact CD2-CB 4.12Å; W587-L602 HydrophobicContact CE3-CB 3.85Å; W587-L602 HydrophobicContact CH2-CB 4.12Å; W587-L602 HydrophobicContact CZ2-CB 4.33Å; W587-L602 HydrophobicContact CZ2-CD2 4.47Å; W587-L602 HydrophobicContact CZ3-CB 3.85Å
588	E	87.7	Confident	82.6	Confident	80 Å²	80	75.6 Å²	75.6	37%	0.374	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128.7	170.1	-66.5	-176.2	176.3	0	0	109.2	R586 W600 T601	R586-E588 PolarHBondContact O-N 3.17Å; E588-W600 CarbonylContact O-C 3.55Å; E588-W600 WeakPolarHBondContact O-CA 3.45Å; E588-T601 PolarHBondContact N-O 3.11Å; E588-T601 PolarHBondContact O-N 3.05Å; E588-T601 PolarHBondContact O-OG1 3.39Å
589	K	86.9	Confident	82.7	Confident	80 Å²	80	75.6 Å²	75.6	35%	0.348	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	114.2	-177.8	-178.3	-174.6	179.1	-179.8	0	109.7	D557 F598 N599 W600	D557-K589 IonicContact OD1-NZ 3.01Å; D557-K589 PolarHBondContact OD1-NZ 3.01Å; D557-K589 IonicContact OD2-NZ 3.16Å; D557-K589 PolarHBondContact OD2-NZ 3.13Å; K589-F598 HydrophobicContact CD-CD1 4.23Å; K589-F598 HydrophobicContact CD-CG 4.5Å; K589-F598 HydrophobicContact CG-CB 4.06Å; K589-F598 HydrophobicContact CG-CD1 3.96Å; K589-F598 HydrophobicContact CG-CG 4.24Å; K589-N599 WeakPolarHBondContact CA-O 3.11Å; K589-W600 HydrophobicContact CB-CD2 4.5Å; K589-W600 HydrophobicContact CD-CH2 4.11Å; K589-W600 HydrophobicContact CD-CZ2 3.62Å; K589-W600 HydrophobicContact CG-CD2 4.44Å; K589-W600 HydrophobicContact CG-CZ2 4.11Å
590	V	86.1	Confident	82.8	Confident	85 Å²	85	74.2 Å²	74.2	52%	0.515	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.4	178.6	-176.7	0	0	0	0	110.1	F598 N599	V590-F598 CarbonylContact O-C 3.57Å; V590-F598 VanDerWaalsContact O-CA 3.31Å; V590-F598 WeakPolarHBondContact O-CA 3.22Å; V590-N599 PolarHBondContact N-O 3.33Å; V590-N599 PolarHBondContact O-N 2.94Å
591	R	84.3	Confident	83.3	Confident	167 Å²	167	73.9 Å²	73.9	63%	0.63	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	132	178.5	-171.7	176	179.4	177.1	-1.5	110.8	S595 F598	R591-S595 PolarHBondContact NE-O 3.38Å; R591-F598 HydrophobicContact CB-CD1 3.82Å; R591-F598 HydrophobicContact CB-CE1 3.74Å; R591-F598 HydrophobicContact CG-CD1 4.1Å; R591-F598 HydrophobicContact CG-CE1 3.75Å; R591-F598 HydrophobicContact CG-CZ 4.4Å
592	L	83.5	Confident	83.6	Confident	47 Å²	47	68.5 Å²	68.5	25%	0.246	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-80.4	136	175.1	-67.9	171.9	0	0	0	110.8	K547 N594 S595 C597	K547-L592 HydrophobicContact CD-CD1 4.04Å; K547-L592 HydrophobicContact CG-CD1 4.08Å; L592-N594 PolarHBondContact O-N 2.83Å; L592-S595 WeakPolarHBondContact CB-OG 3.45Å; L592-S595 PolarHBondContact O-N 2.93Å; L592-S595 PolarHBondContact O-OG 3.4Å; L592-C597 WeakPolarHBondContact CB-O 3.45Å; L592-C597 HydrophobicContact CD1-CB 3.84Å; L592-C597 PolarHBondContact N-O 2.76Å
593	Q	76.4	Confident	84	Confident	187 Å²	187	65.2 Å²	65.2	87%	0.874	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	135.1	-177.3	-66.7	-175.5	-3.5	0	0	111.5	S595	Q593-S595 PolarHBondContact O-N 3.48Å
594	N	65.8	Low	84.4	Confident	181 Å²	181	62.7 Å²	62.7	97%	0.968	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	21.4	178.3	-65	-12.5	0	0	0	116.9	L592	L592-N594 PolarHBondContact O-N 2.83Å
595	S	73.7	Confident	84.2	Confident	34 Å²	34	63 Å²	63	24%	0.238	30%	0.302	C	S	.	.	S	Bend	trans	-132.2	168.1	176.4	73.6	0	0	0	0	112.4	R591 L592 Q593 C597	R591-S595 PolarHBondContact NE-O 3.38Å; L592-S595 WeakPolarHBondContact CB-OG 3.45Å; L592-S595 PolarHBondContact O-N 2.93Å; L592-S595 PolarHBondContact O-OG 3.4Å; Q593-S595 PolarHBondContact O-N 3.48Å; S595-C597 PolarHBondContact OG-N 3.27Å
596	Q	78.5	Confident	83.9	Confident	58 Å²	58	63.6 Å²	63.6	27%	0.271	30%	0.304	S	S	.	.	S	Bend	trans	-96.7	25.7	167.6	-61.6	-162.6	-27.2	0	0	111.8	C549 Q550 R552	C549-Q596 WeakPolarHBondContact CA-O 3.48Å; Q550-Q596 PolarHBondContact N-O 3.25Å; Q550-Q596 WeakPolarHBondContact O-CB 3.33Å; Q550-Q596 PolarHBondContact O-OE1 3.42Å; Q550-Q596 VanDerWaalsContact O-OE1 3.04Å; R552-Q596 VanDerWaalsContact CA-NE2 3.29Å; R552-Q596 VanDerWaalsContact CB-NE2 3.33Å; R552-Q596 VanDerWaalsContact CG-OE1 3.32Å
597	C	86	Confident	83.5	Confident	19 Å²	19	63.6 Å²	63.6	13%	0.128	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	139.7	177.2	-53.1	0	0	0	0	110.2	I548 C549 L592 S595	I548-C597 CarbonylContact O-C 3.42Å; I548-C597 WeakPolarHBondContact O-CA 3.34Å; C549-C597 HydrophobicContact CB-CB 4.04Å; C549-C597 WeakPolarHBondContact CB-SG 3.49Å; C549-C597 WeakPolarHBondContact SG-CB 3.44Å; C549-C597 CovalentContact SG-SG 2.04Å; C549-C597 PolarHBondContact SG-SG 3.02Å; L592-C597 WeakPolarHBondContact CB-O 3.45Å; L592-C597 HydrophobicContact CD1-CB 3.84Å; L592-C597 PolarHBondContact N-O 2.76Å; S595-C597 PolarHBondContact OG-N 3.27Å
598	F	87.4	Confident	83.5	Confident	32 Å²	32	63.8 Å²	63.8	14%	0.14	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.4	177.5	-59.3	-89.3	0	0	0	108.8	I548 K589 V590 R591	I548-F598 PolarHBondContact N-O 2.84Å; I548-F598 PolarHBondContact O-N 2.71Å; K589-F598 HydrophobicContact CD-CD1 4.23Å; K589-F598 HydrophobicContact CD-CG 4.5Å; K589-F598 HydrophobicContact CG-CB 4.06Å; K589-F598 HydrophobicContact CG-CD1 3.96Å; K589-F598 HydrophobicContact CG-CG 4.24Å; V590-F598 CarbonylContact O-C 3.57Å; V590-F598 VanDerWaalsContact O-CA 3.31Å; V590-F598 WeakPolarHBondContact O-CA 3.22Å; R591-F598 HydrophobicContact CB-CD1 3.82Å; R591-F598 HydrophobicContact CB-CE1 3.74Å; R591-F598 HydrophobicContact CG-CD1 4.1Å; R591-F598 HydrophobicContact CG-CE1 3.75Å; R591-F598 HydrophobicContact CG-CZ 4.4Å
599	N	88.1	Confident	83.5	Confident	19 Å²	19	61.3 Å²	61.3	10%	0.102	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	121.7	164.9	-78.4	-1.4	0	0	0	108.1	K589 V590	K589-N599 WeakPolarHBondContact CA-O 3.11Å; V590-N599 PolarHBondContact N-O 3.33Å; V590-N599 PolarHBondContact O-N 2.94Å
600	W	88.6	Confident	83.7	Confident	20 Å²	20	57.5 Å²	57.5	8%	0.076	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.8	172.4	-71.1	73.2	0	0	0	107.2	S545 M546 I548 D557 F560 W587 E588 K589	S545-W600 CarbonylContact C-O 3.54Å; S545-W600 VanDerWaalsContact CA-O 3.29Å; S545-W600 WeakPolarHBondContact CA-O 3.08Å; M546-W600 HydrophobicContact CB-CB 4.34Å; M546-W600 PolarHBondContact N-O 2.83Å; M546-W600 PolarHBondContact O-N 3.44Å; I548-W600 HydrophobicContact CD1-CG 4.28Å; D557-W600 HydrophobicContact CB-CH2 4Å; D557-W600 HydrophobicContact CB-CZ2 4.25Å; F560-W600 HydrophobicContact CD2-CE3 4.33Å; F560-W600 HydrophobicContact CD2-CZ3 4.46Å; F560-W600 AromaticContact CE2-CD2 3.96Å; F560-W600 HydrophobicContact CE2-CD2 3.96Å; F560-W600 AromaticContact CE2-CE3 3.63Å; F560-W600 HydrophobicContact CE2-CE3 3.63Å; F560-W600 HydrophobicContact CE2-CH2 4.31Å; F560-W600 AromaticContact CE2-CZ3 3.84Å; F560-W600 HydrophobicContact CE2-CZ3 3.84Å; F560-W600 HydrophobicContact CZ-CD2 4.45Å; W587-W600 HydrophobicContact CB-CE3 3.92Å; W587-W600 HydrophobicContact CB-CZ3 4.24Å; W587-W600 HydrophobicContact CE3-CB 3.93Å; W587-W600 HydrophobicContact CG-CE3 4.32Å; W587-W600 HydrophobicContact CZ3-CB 4.14Å; W587-W600 WeakPolarHBondContact CZ3-O 3.42Å; E588-W600 CarbonylContact O-C 3.55Å; E588-W600 WeakPolarHBondContact O-CA 3.45Å; K589-W600 HydrophobicContact CB-CD2 4.5Å; K589-W600 HydrophobicContact CD-CH2 4.11Å; K589-W600 HydrophobicContact CD-CZ2 3.62Å; K589-W600 HydrophobicContact CG-CD2 4.44Å; K589-W600 HydrophobicContact CG-CZ2 4.11Å
601	T	88.9	Confident	83.9	Confident	16 Å²	16	53.5 Å²	53.5	10%	0.098	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.4	-176.8	50.3	0	0	0	0	110.4	L544 E588	L544-T601 CarbonylContact O-C 3.42Å; L544-T601 WeakPolarHBondContact O-CA 3.35Å; E588-T601 PolarHBondContact N-O 3.11Å; E588-T601 PolarHBondContact O-N 3.05Å; E588-T601 PolarHBondContact O-OG1 3.39Å
602	L	89.4	Confident	84.3	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	117.5	171.3	-178.7	72.9	0	0	0	108.4	G543 L544 M577 F579 P585 W587 L604	G543-L602 CarbonylContact C-O 3.55Å; G543-L602 WeakPolarHBondContact CA-O 3.02Å; L544-L602 PolarHBondContact N-O 3.34Å; L544-L602 PolarHBondContact O-N 3.36Å; M577-L602 HydrophobicContact SD-CD2 3.98Å; F579-L602 HydrophobicContact CD1-CD1 4.05Å; F579-L602 HydrophobicContact CD1-CD2 4.26Å; F579-L602 HydrophobicContact CE1-CD1 4.13Å; F579-L602 HydrophobicContact CE1-CD2 3.55Å; F579-L602 HydrophobicContact CE1-CG 4.5Å; F579-L602 HydrophobicContact CZ-CD2 4.46Å; P585-L602 HydrophobicContact CB-CD1 4.1Å; P585-L602 HydrophobicContact CG-CD1 4.1Å; W587-L602 HydrophobicContact CD2-CB 4.12Å; W587-L602 HydrophobicContact CE3-CB 3.85Å; W587-L602 HydrophobicContact CH2-CB 4.12Å; W587-L602 HydrophobicContact CZ2-CB 4.33Å; W587-L602 HydrophobicContact CZ2-CD2 4.47Å; W587-L602 HydrophobicContact CZ3-CB 3.85Å; L602-L604 HydrophobicContact CD2-CD2 3.92Å; L602-L604 HydrophobicContact CG-CD2 4.04Å
603	L	87.3	Confident	84.6	Confident	30 Å²	30	43.9 Å²	43.9	16%	0.157	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	105.4	-177	-58.3	176.5	0	0	0	109.6	K489 L492 Q493 P585	K489-L603 HydrophobicContact CG-CD1 4.24Å; L492-L603 HydrophobicContact CB-CD2 3.41Å; L492-L603 VanDerWaalsContact CB-CD2 3.41Å; L492-L603 HydrophobicContact CD1-CD2 3.73Å; L492-L603 HydrophobicContact CG-CD2 4.14Å; Q493-L603 HydrophobicContact CG-CD1 4.36Å; P585-L603 WeakPolarHBondContact CB-O 3.13Å; P585-L603 VanDerWaalsContact CG-O 3.27Å; P585-L603 WeakPolarHBondContact CG-O 3.38Å
604	L	86.3	Confident	85.2	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.026	17%	0.172	C	C	.	.			trans	-82.7	-39.1	178.8	-54.2	179.2	0	0	0	111.8	I541 I542 M577 Y584 P585 L602 W608	I541-L604 HydrophobicContact CG1-CD1 4.18Å; I541-L604 HydrophobicContact CG2-CD1 4.26Å; I542-L604 WeakPolarHBondContact O-CA 3.4Å; I542-L604 VanDerWaalsContact O-CB 3.25Å; I542-L604 WeakPolarHBondContact O-CB 3.25Å; I542-L604 PolarHBondContact O-N 3.44Å; M577-L604 HydrophobicContact CE-CD1 3.88Å; M577-L604 HydrophobicContact CE-CD2 4.49Å; Y584-L604 HydrophobicContact CE1-CD2 3.81Å; Y584-L604 WeakPolarHBondContact OH-CD2 3.45Å; P585-L604 HydrophobicContact CG-CD2 3.62Å; L602-L604 HydrophobicContact CD2-CD2 3.92Å; L602-L604 HydrophobicContact CG-CD2 4.04Å; L604-W608 HydrophobicContact CB-CB 3.99Å; L604-W608 HydrophobicContact CD2-CB 4.46Å; L604-W608 WeakPolarHBondContact O-CB 3.29Å; L604-W608 VanDerWaalsContact O-CD1 3.32Å; L604-W608 PolarHBondContact O-N 3.01Å
605	G	80.9	Confident	86.4	Confident	13 Å²	13	26.5 Å²	26.5	13%	0.134	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	-168.1	-176.4	0	0	0	0	0	112.9	I542 R607 K609	I542-G605 PolarHBondContact O-N 2.98Å; G605-R607 VanDerWaalsContact C-N 3.32Å; G605-K609 PolarHBondContact O-N 3.09Å
606	N	80.2	Confident	87.2	Confident	37 Å²	37	25.7 Å²	25.7	20%	0.198	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-24.9	177.4	-87.1	-28.2	0	0	0	112.9	F483 D485 K609	F483-N606 PolarHBondContact O-ND2 3.4Å; D485-N606 WeakPolarHBondContact OD1-CB 3.3Å; D485-N606 PolarHBondContact OD1-N 3.35Å; N606-K609 WeakPolarHBondContact O-CG 3.49Å; N606-K609 PolarHBondContact OD1-NZ 3.15Å; N606-K609 VanDerWaalsContact OD1-NZ 3.11Å
607	R	80.4	Confident	87.6	Confident	182 Å²	182	22.9 Å²	22.9	69%	0.687	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-35.8	179.3	-173.1	175.7	-178.8	171.6	2.8	113.7	G605	G605-R607 VanDerWaalsContact C-N 3.32Å
608	W	86.2	Confident	87.6	Confident	46 Å²	46	23.3 Å²	23.3	17%	0.174	10%	0.104	C	C	.	.	S	Bend	trans	-118.4	16.4	-172.2	-53.4	115.5	0	0	0	113.6	G583 Y584 P585 L604 P709	G583-W608 WeakPolarHBondContact O-CZ2 3.43Å; G583-W608 PolarHBondContact O-NE1 2.86Å; Y584-W608 HydrophobicContact CD2-CB 4.34Å; Y584-W608 AromaticContact CD2-CD2 3.81Å; Y584-W608 HydrophobicContact CD2-CD2 3.81Å; Y584-W608 AromaticContact CD2-CE3 3.82Å; Y584-W608 HydrophobicContact CD2-CE3 3.82Å; Y584-W608 HydrophobicContact CD2-CG 4.09Å; Y584-W608 HydrophobicContact CD2-CZ3 4.39Å; Y584-W608 HydrophobicContact CE2-CB 3.87Å; Y584-W608 HydrophobicContact CE2-CD2 4.16Å; Y584-W608 HydrophobicContact CE2-CE3 4.1Å; Y584-W608 HydrophobicContact CE2-CG 4.12Å; P585-W608 VanDerWaalsContact CD-CD1 3.45Å; L604-W608 HydrophobicContact CB-CB 3.99Å; L604-W608 HydrophobicContact CD2-CB 4.46Å; L604-W608 WeakPolarHBondContact O-CB 3.29Å; L604-W608 VanDerWaalsContact O-CD1 3.32Å; L604-W608 PolarHBondContact O-N 3.01Å; W608-P709 HydrophobicContact CE3-CG 4.06Å; W608-P709 HydrophobicContact CH2-CB 4.16Å; W608-P709 HydrophobicContact CH2-CG 3.97Å; W608-P709 HydrophobicContact CZ3-CB 3.7Å; W608-P709 HydrophobicContact CZ3-CG 3.41Å; W608-P709 VanDerWaalsContact CZ3-CG 3.41Å
609	K	88.3	Confident	87.1	Confident	28 Å²	28	22.1 Å²	22.1	12%	0.122	10%	0.099	C	C	.	.			trans	-64.7	142.7	177.3	67.9	-175.8	173.5	-174.4	0	111.2	D482 M540 I541 I542 G605 N606 Y660 L706	D482-K609 IonicContact OD1-NZ 3.67Å; D482-K609 PolarHBondContact OD1-NZ 3.33Å; M540-K609 HydrophobicContact CE-CB 3.85Å; M540-K609 HydrophobicContact CE-CD 3.99Å; M540-K609 HydrophobicContact CE-CG 3.63Å; I541-K609 WeakPolarHBondContact O-CA 3.49Å; I542-K609 HydrophobicContact CG2-CB 4Å; G605-K609 PolarHBondContact O-N 3.09Å; N606-K609 WeakPolarHBondContact O-CG 3.49Å; N606-K609 PolarHBondContact OD1-NZ 3.15Å; N606-K609 VanDerWaalsContact OD1-NZ 3.11Å; K609-Y660 WeakPolarHBondContact CD-OH 3.37Å; K609-Y660 WeakPolarHBondContact CE-OH 3.29Å; K609-Y660 PolarHBondContact NZ-OH 3Å; K609-L706 HydrophobicContact CG-CD2 4.03Å
610	T	90.9	Very high	86.1	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	165.2	-179.4	-164.1	0	0	0	0	111.3	M540 I541 V564 W575 L706	M540-T610 CarbonylContact C-O 3.57Å; M540-T610 WeakPolarHBondContact CA-O 3.47Å; I541-T610 HydrophobicContact CG2-CG2 3.64Å; I541-T610 WeakPolarHBondContact CG2-O 3.36Å; I541-T610 PolarHBondContact N-O 3.43Å; I541-T610 PolarHBondContact O-N 2.91Å; V564-T610 HydrophobicContact CG1-CG2 4.37Å; W575-T610 HydrophobicContact CH2-CG2 4.21Å; W575-T610 HydrophobicContact CZ2-CG2 3.57Å; T610-L706 VanDerWaalsContact CB-O 3.28Å; T610-L706 WeakPolarHBondContact CB-O 3.17Å; T610-L706 PolarHBondContact OG1-O 3.43Å
611	F	91	Very high	84.5	Confident	1 Å²	1	27.9 Å²	27.9	0%	0.004	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	146.1	174.4	-70.5	-68.2	0	0	0	111.2	L538 H539 M540 V564 P566 F567 L662 I703 L706	L538-F611 HydrophobicContact CB-CD1 3.95Å; L538-F611 HydrophobicContact CB-CE1 3.7Å; L538-F611 HydrophobicContact CD1-CD1 4.5Å; L538-F611 HydrophobicContact CD1-CE1 3.85Å; L538-F611 HydrophobicContact CD1-CZ 4.21Å; L538-F611 HydrophobicContact CG-CE1 4.38Å; H539-F611 WeakPolarHBondContact O-CA 3.28Å; M540-F611 HydrophobicContact CG-CD1 4.38Å; M540-F611 HydrophobicContact CG-CE1 4.32Å; M540-F611 HydrophobicContact SD-CD1 3.35Å; M540-F611 WeakPolarHBondContact SD-CD1 3.22Å; M540-F611 HydrophobicContact SD-CD2 4.34Å; M540-F611 HydrophobicContact SD-CE1 3.44Å; M540-F611 WeakPolarHBondContact SD-CE1 3.2Å; M540-F611 HydrophobicContact SD-CE2 4.42Å; M540-F611 HydrophobicContact SD-CG 3.83Å; M540-F611 HydrophobicContact SD-CZ 4Å; V564-F611 WeakPolarHBondContact CG1-O 3.42Å; P566-F611 WeakPolarHBondContact CA-O 3.4Å; P566-F611 HydrophobicContact CB-CB 3.69Å; F567-F611 HydrophobicContact CE1-CB 4.16Å; F567-F611 HydrophobicContact CE1-CD1 4.32Å; F567-F611 HydrophobicContact CE1-CD2 4.22Å; F567-F611 AromaticContact CE1-CG 3.98Å; F567-F611 HydrophobicContact CE1-CG 3.98Å; F567-F611 HydrophobicContact CZ-CB 4.11Å; F567-F611 AromaticContact CZ-CD2 3.71Å; F567-F611 HydrophobicContact CZ-CD2 3.71Å; F567-F611 HydrophobicContact CZ-CE2 4.27Å; F567-F611 AromaticContact CZ-CG 3.9Å; F567-F611 HydrophobicContact CZ-CG 3.9Å; F611-L662 HydrophobicContact CE1-CD1 4.11Å; F611-L662 HydrophobicContact CZ-CD1 4.5Å; F611-I703 HydrophobicContact CE2-CG1 4.38Å; F611-I703 HydrophobicContact CE2-CG2 4.26Å; F611-L706 HydrophobicContact CD2-CD1 4.08Å; F611-L706 HydrophobicContact CE2-CD1 3.47Å; F611-L706 VanDerWaalsContact CE2-CD1 3.47Å; F611-L706 HydrophobicContact CZ-CD1 3.87Å
612	F	91.5	Very high	82.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	15%	0.149	C	C	.	.			trans	-143.4	143.1	167.9	81.7	-74.9	0	0	0	112.2	I501 T503 H539 I541 V564 N565 P566 V615 V657	I501-F612 HydrophobicContact CB-CZ 4.23Å; I501-F612 HydrophobicContact CD1-CE1 3.5Å; I501-F612 VanDerWaalsContact CD1-CE1 3.5Å; I501-F612 HydrophobicContact CD1-CZ 3.66Å; I501-F612 HydrophobicContact CG2-CZ 3.95Å; T503-F612 HydrophobicContact CG2-CE2 3.94Å; T503-F612 HydrophobicContact CG2-CZ 4.37Å; H539-F612 HydrophobicContact CB-CD1 3.96Å; H539-F612 HydrophobicContact CB-CE1 3.57Å; H539-F612 HydrophobicContact CB-CZ 3.95Å; H539-F612 WeakPolarHBondContact O-CD1 3.39Å; H539-F612 PolarHBondContact O-N 3.21Å; I541-F612 HydrophobicContact CB-CD1 3.52Å; I541-F612 HydrophobicContact CB-CE1 3.9Å; I541-F612 HydrophobicContact CB-CG 4.15Å; I541-F612 HydrophobicContact CG2-CB 4.18Å; I541-F612 HydrophobicContact CG2-CD1 3.99Å; I541-F612 HydrophobicContact CG2-CG 4.34Å; V564-F612 HydrophobicContact CG1-CB 3.7Å; N565-F612 CarbonylContact O-C 3.58Å; N565-F612 WeakPolarHBondContact O-CA 3.44Å; P566-F612 CarbonylContact O-C 3.59Å; F612-V615 HydrophobicContact CB-CG2 4.19Å; F612-V615 HydrophobicContact CD2-CG2 3.78Å; F612-V615 HydrophobicContact CG-CG2 4.24Å; F612-V657 HydrophobicContact CE1-CG1 4.03Å; F612-V657 HydrophobicContact CE2-CG1 3.97Å; F612-V657 HydrophobicContact CZ-CB 4.38Å; F612-V657 HydrophobicContact CZ-CG1 3.59Å
613	E	89.9	Confident	80.6	Confident	12 Å²	12	37.1 Å²	37.1	6%	0.056	17%	0.166	C	C	.	.	S	Bend	trans	-117.5	-40.2	164.9	-178.6	73.6	179.3	0	0	109.3	S530 N565 P566 R727	S530-E613 PolarHBondContact N-O 3.48Å; S530-E613 WeakPolarHBondContact OG-CA 3.42Å; S530-E613 PolarHBondContact OG-O 3.19Å; S530-E613 PolarHBondContact OG-OE2 3.29Å; N565-E613 PolarHBondContact O-N 3.32Å; P566-E613 PolarHBondContact O-N 2.82Å; E613-R727 IonicContact OE2-CZ 3.02Å; E613-R727 IonicContact OE2-NH1 3.94Å; E613-R727 IonicContact OE2-NH2 3.44Å; E613-R727 PolarHBondContact OE2-NH2 3.29Å
614	T	90.1	Very high	78.3	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.8	173.6	52.1	0	0	0	0	111.4	T527 L528 K529 N565 S568	T527-T614 HydrophobicContact CG2-CG2 4.49Å; L528-T614 CarbonylContact O-C 3.57Å; L528-T614 VanDerWaalsContact O-CA 3.3Å; L528-T614 WeakPolarHBondContact O-CA 3.47Å; K529-T614 HydrophobicContact CB-CG2 4.01Å; K529-T614 HydrophobicContact CD-CG2 3.99Å; K529-T614 HydrophobicContact CG-CG2 3.77Å; N565-T614 WeakPolarHBondContact CB-OG1 3.45Å; N565-T614 PolarHBondContact N-O 3.41Å; N565-T614 PolarHBondContact O-N 2.62Å; S568-T614 PolarHBondContact O-OG1 3.07Å
615	V	91.3	Very high	76	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.8	173.5	-177.3	0	0	0	0	108	T527 L528 I541 L544 V562 Y563 V564 F612 I617	T527-V615 CarbonylContact C-O 3.52Å; T527-V615 WeakPolarHBondContact CA-O 3.44Å; L528-V615 HydrophobicContact CB-CB 4.31Å; L528-V615 PolarHBondContact N-O 2.96Å; L528-V615 PolarHBondContact O-N 2.91Å; I541-V615 HydrophobicContact CD1-CG2 4.37Å; L544-V615 HydrophobicContact CD1-CG1 3.91Å; V562-V615 HydrophobicContact CG1-CG1 3.42Å; V562-V615 VanDerWaalsContact CG1-CG1 3.42Å; Y563-V615 WeakPolarHBondContact O-CA 3.26Å; V564-V615 HydrophobicContact CG2-CG1 4.46Å; V564-V615 HydrophobicContact CG2-CG2 4.4Å; F612-V615 HydrophobicContact CB-CG2 4.19Å; F612-V615 HydrophobicContact CD2-CG2 3.78Å; F612-V615 HydrophobicContact CG-CG2 4.24Å; V615-I617 HydrophobicContact CG1-CG1 4.18Å
616	H	89.5	Confident	73.7	Confident	17 Å²	17	54.4 Å²	54.4	8%	0.079	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118	175.7	-56.9	-75	0	0	0	109.8	L526 T527 V562 Y563 Y618	L526-H616 CarbonylContact O-C 3.2Å; L526-H616 WeakPolarHBondContact O-CA 3.36Å; T527-H616 WeakPolarHBondContact CG2-ND1 3.35Å; T527-H616 PolarHBondContact OG1-ND1 3.35Å; V562-H616 CarbonylContact C-O 3.52Å; V562-H616 WeakPolarHBondContact CA-O 3.46Å; Y563-H616 PolarHBondContact N-O 2.78Å; Y563-H616 PolarHBondContact O-N 2.73Å; H616-Y618 HydrophobicContact CB-CE2 3.98Å
617	I	88.4	Confident	71.6	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	118.9	177.1	-47.6	178.1	0	0	0	108	L526 L528 L544 M546 F560 V562 V615 I655	L526-I617 HydrophobicContact CB-CB 4.19Å; L526-I617 PolarHBondContact N-O 2.93Å; L526-I617 PolarHBondContact O-N 3.1Å; L528-I617 HydrophobicContact CD1-CD1 4.35Å; L544-I617 HydrophobicContact CD1-CD1 4.28Å; L544-I617 HydrophobicContact CD2-CD1 3.92Å; M546-I617 HydrophobicContact CE-CD1 4.18Å; M546-I617 HydrophobicContact CE-CG2 4.33Å; M546-I617 HydrophobicContact SD-CD1 3.86Å; M546-I617 HydrophobicContact SD-CG2 4.29Å; F560-I617 HydrophobicContact CB-CG2 4.41Å; F560-I617 HydrophobicContact CD1-CG2 4.04Å; V562-I617 HydrophobicContact CG1-CG1 4.49Å; V562-I617 HydrophobicContact CG2-CG1 4.15Å; V562-I617 HydrophobicContact CG2-CG2 4.19Å; V615-I617 HydrophobicContact CG1-CG1 4.18Å; I617-I655 HydrophobicContact CD1-CG2 4.21Å
618	Y	85.2	Confident	69.8	Low	27 Å²	27	54.9 Å²	54.9	11%	0.106	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	128	174.8	-64.6	-76.6	0	0	0	111.4	R523 M524 F560 F561 Y563 H571 H616	R523-Y618 HydrophobicContact CG-CD1 3.57Å; R523-Y618 HydrophobicContact CG-CE1 4.2Å; R523-Y618 HydrophobicContact CG-CG 4.3Å; R523-Y618 PolarHBondContact NH2-OH 3.4Å; M524-Y618 VanDerWaalsContact O-CA 3.28Å; M524-Y618 WeakPolarHBondContact O-CA 3.48Å; F560-Y618 WeakPolarHBondContact CA-O 3.25Å; F561-Y618 PolarHBondContact N-O 3.21Å; F561-Y618 PolarHBondContact O-N 3.06Å; Y563-Y618 AromaticContact CD2-CD2 3.6Å; Y563-Y618 HydrophobicContact CD2-CD2 3.6Å; Y563-Y618 AromaticContact CD2-CE2 3.6Å; Y563-Y618 HydrophobicContact CD2-CE2 3.6Å; Y563-Y618 AromaticContact CE2-CD2 3.89Å; Y563-Y618 HydrophobicContact CE2-CD2 3.89Å; Y563-Y618 HydrophobicContact CE2-CE2 4.03Å; Y563-Y618 HydrophobicContact CG-CE2 4.31Å; H571-Y618 AromaticContact CD2-CE2 3.58Å; H571-Y618 AromaticContact CD2-CZ 3.6Å; H571-Y618 PolarHBondContact CD2-OH 3.08Å; H571-Y618 AromaticContact NE2-CE2 3.17Å; H571-Y618 WeakPolarHBondContact NE2-CE2 3.43Å; H571-Y618 AromaticContact NE2-CZ 3.45Å; H571-Y618 PolarHBondContact NE2-OH 3.47Å; H616-Y618 HydrophobicContact CB-CE2 3.98Å
619	L	76.6	Confident	67.7	Low	7 Å²	7	60.5 Å²	60.5	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.4	171.8	-139.4	86.4	0	0	0	110	F516 P518 M524 P558 F560 I650	F516-L619 HydrophobicContact CE2-CD2 4.03Å; F516-L619 HydrophobicContact CZ-CD2 4.27Å; P518-L619 HydrophobicContact CB-CD2 3.92Å; M524-L619 HydrophobicContact CB-CB 4.21Å; M524-L619 PolarHBondContact N-O 3.03Å; M524-L619 PolarHBondContact O-N 3.11Å; P558-L619 HydrophobicContact CB-CD1 4.06Å; P558-L619 HydrophobicContact CB-CD2 4.23Å; P558-L619 HydrophobicContact CB-CG 4.2Å; F560-L619 HydrophobicContact CD1-CD1 3.47Å; F560-L619 VanDerWaalsContact CD1-CD1 3.47Å; F560-L619 HydrophobicContact CE1-CD1 3.25Å; F560-L619 HydrophobicContact CZ-CD1 4.26Å; L619-I650 HydrophobicContact CD2-CD1 3.6Å
620	R	66.8	Low	65.3	Low	130 Å²	130	70.6 Å²	70.6	49%	0.491	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	113.5	170.3	-168.1	173	-176.3	173.6	2.3	110.3	M559 F561 R622	M559-R620 PolarHBondContact O-N 3.23Å; M559-R620 VanDerWaalsContact O-N 3.08Å; F561-R620 HydrophobicContact CE2-CB 4.19Å; R620-R622 PolarHBondContact O-N 2.95Å
621	S	56.2	Low	62.8	Low	30 Å²	30	78 Å²	78	21%	0.21	40%	0.404	C	S	.	.			trans	-77.1	112.6	170.1	-175.6	0	0	0	0	109.8	P518	P518-S621 WeakPolarHBondContact O-CB 3.48Å
622	R	52.7	Low	60.1	Low	168 Å²	168	85.6 Å²	85.6	63%	0.634	44%	0.444	S	S	*	.			trans	-96.5	94.1	160	-84.4	-171.6	176.1	-178.4	-0.9	107.2	M559 R620 K624	M559-R622 HydrophobicContact CE-CG 4.22Å; R620-R622 PolarHBondContact O-N 2.95Å; R622-K624 PolarHBondContact O-N 3.36Å
623	A	43.1	Very low	57.6	Low	43 Å²	43	92.9 Å²	92.9	36%	0.355	49%	0.489	S	S	.	.			trans	-65.8	115	151.9	0	0	0	0	0	106.2	V625	A623-V625 HydrophobicContact CB-CG2 3.99Å; A623-V625 PolarHBondContact O-N 3.26Å
624	K	38.9	Very low	55.5	Low	206 Å²	206	95.3 Å²	95.3	90%	0.896	52%	0.518	S	S	*	.			trans	-64.4	86.5	156.6	-91.9	-176.4	174.3	180	0	105.6	R622 P626	R622-K624 PolarHBondContact O-N 3.36Å; K624-P626 WeakPolarHBondContact O-CD 3.49Å
625	V	38.4	Very low	53.2	Low	98 Å²	98	102.6 Å²	102.6	59%	0.594	55%	0.551	S	S	*	*			trans	-71	120	165.6	-178.3	0	0	0	0	105.2	A623 T627	A623-V625 HydrophobicContact CB-CG2 3.99Å; A623-V625 PolarHBondContact O-N 3.26Å; V625-T627 PolarHBondContact O-N 3.4Å
626	P	32.3	Very low	50.9	Low	108 Å²	108	105.1 Å²	105.1	70%	0.701	58%	0.577	S	S	*	*			trans	-55.6	126.9	167.9	-17.5	29.8	0	0	0	107.4	K624 G628	K624-P626 WeakPolarHBondContact O-CD 3.49Å; P626-G628 PolarHBondContact O-N 2.97Å
627	T	36.5	Very low	48.6	Very low	158 Å²	158	109.9 Å²	109.9	97%	0.969	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	97.4	172.5	32.2	0	0	0	0	109.4	V625	V625-T627 PolarHBondContact O-N 3.4Å
628	G	42.1	Very low	46.8	Very low	71 Å²	71	112.5 Å²	112.5	73%	0.732	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-172.6	-32.9	-178.8	0	0	0	0	0	115.1	P626	P626-G628 PolarHBondContact O-N 2.97Å
629	L	42	Very low	44.9	Very low	164 Å²	164	117.1 Å²	117.1	86%	0.859	65%	0.652	S	S	*	*			trans	-134.5	91.8	-177.7	-80.9	148.5	0	0	0	110.7
630	R	38.3	Very low	43.6	Very low	240 Å²	240	122.2 Å²	122.2	91%	0.906	68%	0.679	S	S	*	*			trans	-115.7	79.5	172.8	-172.2	-179.1	167.3	-168.6	-6.4	107.5
631	N	37.3	Very low	42.9	Very low	156 Å²	156	119.4 Å²	119.4	83%	0.834	68%	0.683	S	S	*	*			trans	-160.9	97.4	159.9	-90.2	-16.4	0	0	0	107.1
632	D	34.4	Very low	42.8	Very low	160 Å²	160	120.9 Å²	120.9	86%	0.856	69%	0.689	S	S	*	*			trans	-172.4	96.4	141.8	-98.4	-17.6	0	0	0	108.8
633	T	39.7	Very low	42.8	Very low	153 Å²	153	117.1 Å²	117.1	94%	0.939	69%	0.686	S	S	*	*			trans	-87.3	102.1	163.9	39.9	0	0	0	0	108
634	G	45.5	Very low	43.3	Very low	64 Å²	64	121.2 Å²	121.2	66%	0.66	70%	0.702	S	S	*	*			trans	151.9	97.1	166.5	0	0	0	0	0	112.3
635	Q	41.9	Very low	44	Very low	155 Å²	155	116.5 Å²	116.5	72%	0.724	68%	0.682	S	S	*	*			trans	-146.8	104.7	161	-103.3	147.6	26.2	0	0	108.7
636	G	42.6	Very low	44.7	Very low	52 Å²	52	117.3 Å²	117.3	54%	0.536	67%	0.674	S	S	.	*			trans	-64.9	-166.9	162.6	0	0	0	0	0	111.6	V638	G636-V638 PolarHBondContact O-N 3.48Å; G636-V638 VanDerWaalsContact O-N 3.13Å
637	P	41.4	Very low	45.9	Very low	117 Å²	117	117.7 Å²	117.7	76%	0.76	67%	0.667	S	S	*	*	S	Bend	trans	-58.8	122	-175.6	6.6	-0	0	0	0	109.9
638	V	49.8	Very low	47.1	Very low	56 Å²	56	111 Å²	111	34%	0.339	63%	0.625	S	S	.	*	P	Polyproline II helix	trans	-81.6	128.5	-176.5	177.5	0	0	0	0	109.5	G636 L640 K645	G636-V638 PolarHBondContact O-N 3.48Å; G636-V638 VanDerWaalsContact O-N 3.13Å; V638-L640 PolarHBondContact O-N 2.98Å; V638-K645 HydrophobicContact CG1-CB 4.08Å; V638-K645 HydrophobicContact CG1-CD 3.6Å; V638-K645 HydrophobicContact CG1-CG 4.45Å
639	D	45.4	Very low	48.7	Very low	123 Å²	123	108.9 Å²	108.9	66%	0.658	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-64	121.1	177.3	-160.6	-10	0	0	0	111.3	A641	D639-A641 PolarHBondContact O-N 3.1Å
640	L	51.1	Low	50.6	Low	114 Å²	114	101.1 Å²	101.1	60%	0.597	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-6.8	-172.8	-72.4	162.4	0	0	0	113.3	V638 R646 Y649	V638-L640 PolarHBondContact O-N 2.98Å; L640-R646 PolarHBondContact O-NE 3.38Å; L640-R646 PolarHBondContact O-NH2 2.91Å; L640-Y649 HydrophobicContact CD2-CE1 4.11Å
641	A	51.6	Low	52.8	Low	72 Å²	72	91.5 Å²	91.5	60%	0.595	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-23.9	-179.8	0	0	0	0	0	113.9	D639 P643	D639-A641 PolarHBondContact O-N 3.1Å; A641-P643 WeakPolarHBondContact O-CD 3.12Å
642	D	52.8	Low	55.2	Low	61 Å²	61	84.1 Å²	84.1	33%	0.326	48%	0.479	S	S	.	.			trans	-88.6	110.6	-172.7	-170.9	-7.1	0	0	0	112.9	N644 K645	D642-N644 VanDerWaalsContact C-N 3.26Å; D642-N644 PolarHBondContact O-N 3.36Å; D642-N644 PolarHBondContact OD1-N 3.34Å; D642-K645 HydrophobicContact CB-CD 4.42Å; D642-K645 HydrophobicContact CB-CG 4.48Å; D642-K645 PolarHBondContact O-N 3.42Å; D642-K645 WeakPolarHBondContact OD2-CE 3.31Å; D642-K645 IonicContact OD2-NZ 2.61Å
643	P	54.1	Low	57.6	Low	88 Å²	88	76.9 Å²	76.9	57%	0.571	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-65.7	-22.5	-176.5	26	-33.3	0	0	0	114.1	A641 K645 R646	A641-P643 WeakPolarHBondContact O-CD 3.12Å; P643-K645 VanDerWaalsContact C-N 3.34Å; P643-R646 WeakPolarHBondContact O-CB 3.43Å; P643-R646 PolarHBondContact O-N 2.97Å
644	N	54	Low	59.9	Low	129 Å²	129	72.6 Å²	72.6	69%	0.69	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-77	-20.2	179.8	-78.3	-19.4	0	0	0	113.2	D642	D642-N644 VanDerWaalsContact C-N 3.26Å; D642-N644 PolarHBondContact O-N 3.36Å; D642-N644 PolarHBondContact OD1-N 3.34Å
645	K	53	Low	62	Low	108 Å²	108	69.9 Å²	69.9	47%	0.47	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-89	-7.6	174.8	-62.5	-178.7	-172.3	170.5	0	113	V638 D642 P643 Q647	V638-K645 HydrophobicContact CG1-CB 4.08Å; V638-K645 HydrophobicContact CG1-CD 3.6Å; V638-K645 HydrophobicContact CG1-CG 4.45Å; D642-K645 HydrophobicContact CB-CD 4.42Å; D642-K645 HydrophobicContact CB-CG 4.48Å; D642-K645 PolarHBondContact O-N 3.42Å; D642-K645 WeakPolarHBondContact OD2-CE 3.31Å; D642-K645 IonicContact OD2-NZ 2.61Å; P643-K645 VanDerWaalsContact C-N 3.34Å; K645-Q647 PolarHBondContact O-N 3.48Å
646	R	53.6	Low	64.3	Low	114 Å²	114	64.7 Å²	64.7	43%	0.43	36%	0.359	S	S	.	.			trans	-75.8	31.4	-178.6	-65.7	-175.8	-177.2	174.8	-0.3	115.5	L640 P643	L640-R646 PolarHBondContact O-NE 3.38Å; L640-R646 PolarHBondContact O-NH2 2.91Å; P643-R646 WeakPolarHBondContact O-CB 3.43Å; P643-R646 PolarHBondContact O-N 2.97Å
647	Q	55.9	Low	66.6	Low	117 Å²	117	62.2 Å²	62.2	55%	0.547	33%	0.333	S	S	.	.	S	Bend	trans	-83.3	-24.9	-166.6	-72.5	177.3	-10.9	0	0	114.8	K645	K645-Q647 PolarHBondContact O-N 3.48Å
648	I	63.3	Low	68.9	Low	18 Å²	18	56.9 Å²	56.9	9%	0.092	30%	0.298	C	S	.	.	S	Bend	trans	-145.9	81.3	-175.9	-48.2	169.7	0	0	0	110.8	P518 I556	P518-I648 VanDerWaalsContact CD-O 3.3Å; P518-I648 WeakPolarHBondContact CD-O 3.44Å; P518-I648 HydrophobicContact CG-CG2 3.91Å; I556-I648 HydrophobicContact CD1-CD1 3.67Å
649	Y	75.2	Confident	70.8	Confident	25 Å²	25	54.4 Å²	54.4	10%	0.098	28%	0.283	C	S	.	.			trans	-117.4	131.7	174.1	-73	-96.3	0	0	0	110.5	F516 D517 M551 L640	F516-Y649 WeakPolarHBondContact O-CA 3.46Å; D517-Y649 HydrophobicContact CB-CD1 4.47Å; D517-Y649 HydrophobicContact CB-CE1 4.2Å; M551-Y649 PolarHBondContact N-O 2.94Å; L640-Y649 HydrophobicContact CD2-CE1 4.11Å
650	I	80.6	Confident	72.7	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.1	173.9	64.6	172.4	0	0	0	109.8	F515 F516 P518 I548 C549 Q550 P558 L619	F515-I650 WeakPolarHBondContact CA-O 3.44Å; F516-I650 WeakPolarHBondContact CD1-O 3.36Å; F516-I650 HydrophobicContact CD2-CG1 4.23Å; F516-I650 HydrophobicContact CE1-CD1 4.4Å; F516-I650 HydrophobicContact CE1-CG1 4.01Å; F516-I650 HydrophobicContact CE2-CD1 3.7Å; F516-I650 HydrophobicContact CE2-CG1 3.67Å; F516-I650 HydrophobicContact CZ-CD1 3.53Å; F516-I650 HydrophobicContact CZ-CG1 3.55Å; F516-I650 PolarHBondContact N-O 2.82Å; F516-I650 PolarHBondContact O-N 2.91Å; P518-I650 HydrophobicContact CB-CD1 4.11Å; P518-I650 HydrophobicContact CB-CG1 4.5Å; P518-I650 HydrophobicContact CG-CD1 4.34Å; P518-I650 HydrophobicContact CG-CG1 4.41Å; I548-I650 HydrophobicContact CG2-CB 4.3Å; C549-I650 CarbonylContact O-C 3.4Å; C549-I650 WeakPolarHBondContact O-CA 3.33Å; Q550-I650 HydrophobicContact CG-CG2 4.11Å; P558-I650 HydrophobicContact CB-CD1 4.47Å; L619-I650 HydrophobicContact CD2-CD1 3.6Å
651	K	85.3	Confident	74.4	Confident	38 Å²	38	46.6 Å²	46.6	17%	0.165	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.3	170.7	175	-179.3	77.5	152.4	0	108.2	E513 F515 I548 C549 S653	E513-K651 WeakPolarHBondContact O-CD 3.35Å; E513-K651 WeakPolarHBondContact OE2-CE 3.16Å; E513-K651 IonicContact OE2-NZ 3.95Å; E513-K651 PolarHBondContact OE2-NZ 3.37Å; F515-K651 HydrophobicContact CD1-CB 3.55Å; F515-K651 HydrophobicContact CD2-CB 4.07Å; F515-K651 HydrophobicContact CD2-CD 4.1Å; F515-K651 HydrophobicContact CE1-CB 3.57Å; F515-K651 HydrophobicContact CE2-CB 4.09Å; F515-K651 HydrophobicContact CE2-CD 3.86Å; F515-K651 HydrophobicContact CG-CB 3.81Å; F515-K651 HydrophobicContact CZ-CB 3.85Å; F515-K651 HydrophobicContact CZ-CD 4.22Å; I548-K651 CarbonylContact C-O 3.42Å; I548-K651 WeakPolarHBondContact CA-O 3.33Å; C549-K651 HydrophobicContact CB-CB 4.25Å; C549-K651 PolarHBondContact N-O 3.49Å; C549-K651 PolarHBondContact O-N 3.24Å; K651-S653 WeakPolarHBondContact CE-OG 3.22Å
652	I	86.9	Confident	76	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	110.7	169.2	-57.8	174.6	0	0	0	106.6	I510 L512 E513 F516 L526 M546 I548 I655	I510-I652 HydrophobicContact CD1-CD1 4.36Å; L512-I652 HydrophobicContact CD2-CB 4.48Å; L512-I652 HydrophobicContact CD2-CG2 3.97Å; E513-I652 PolarHBondContact N-O 2.92Å; F516-I652 HydrophobicContact CE1-CD1 4.16Å; F516-I652 HydrophobicContact CE1-CG1 4.05Å; F516-I652 HydrophobicContact CZ-CD1 3.97Å; F516-I652 HydrophobicContact CZ-CG1 4.19Å; L526-I652 HydrophobicContact CD1-CD1 3.57Å; M546-I652 HydrophobicContact CE-CD1 4.22Å; M546-I652 HydrophobicContact CE-CG2 4.48Å; I548-I652 HydrophobicContact CG1-CG1 4.34Å; I652-I655 HydrophobicContact CG2-CD1 3.92Å; I652-I655 HydrophobicContact CG2-CG1 3.64Å
653	S	86.6	Confident	77.6	Confident	9 Å²	9	49 Å²	49	6%	0.063	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-46.5	-177.5	-91.3	0	0	0	0	111.6	E513 K547 K651	E513-S653 VanDerWaalsContact CD-OG 3.24Å; E513-S653 WeakPolarHBondContact OE1-CA 3.48Å; E513-S653 WeakPolarHBondContact OE1-CB 3.21Å; E513-S653 PolarHBondContact OE1-OG 3.02Å; E513-S653 PolarHBondContact OE2-OG 3.42Å; K547-S653 PolarHBondContact O-N 3.43Å; K651-S653 WeakPolarHBondContact CE-OG 3.22Å
654	D	88	Confident	79.2	Confident	62 Å²	62	45.2 Å²	45.2	33%	0.332	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	151.5	-175.3	-166.1	18.9	0	0	0	111	M546 K547 Q656	M546-D654 WeakPolarHBondContact CA-O 3.37Å; K547-D654 HydrophobicContact CB-CB 4.31Å; K547-D654 PolarHBondContact N-O 2.65Å; D654-Q656 WeakPolarHBondContact OD2-CG 3.22Å; D654-Q656 PolarHBondContact OD2-NE2 3.02Å
655	I	89.3	Confident	80.8	Confident	8 Å²	8	42.1 Å²	42.1	4%	0.041	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	121.9	176.1	-53.2	173.9	0	0	0	108.1	F505 L512 L526 L528 L544 S545 M546 I617 I652	F505-I655 HydrophobicContact CD2-CD1 4.01Å; F505-I655 HydrophobicContact CE2-CD1 3.69Å; L512-I655 HydrophobicContact CD2-CD1 4.17Å; L512-I655 HydrophobicContact CD2-CG1 4.24Å; L526-I655 HydrophobicContact CD1-CD1 3.96Å; L528-I655 HydrophobicContact CD1-CG2 3.43Å; L528-I655 VanDerWaalsContact CD1-CG2 3.43Å; L528-I655 HydrophobicContact CD2-CB 4.28Å; L528-I655 HydrophobicContact CD2-CG2 3.99Å; L528-I655 HydrophobicContact CG-CG2 4.19Å; L544-I655 HydrophobicContact CD2-CG2 4.37Å; S545-I655 WeakPolarHBondContact O-CA 3.07Å; M546-I655 HydrophobicContact CE-CD1 3.98Å; M546-I655 HydrophobicContact CE-CG1 4.12Å; M546-I655 HydrophobicContact CG-CG1 4.34Å; M546-I655 HydrophobicContact CG-CG2 4.06Å; I617-I655 HydrophobicContact CD1-CG2 4.21Å; I652-I655 HydrophobicContact CG2-CD1 3.92Å; I652-I655 HydrophobicContact CG2-CG1 3.64Å
656	Q	89.4	Confident	82.4	Confident	45 Å²	45	37.8 Å²	37.8	21%	0.21	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.5	-175.7	-61.2	-176.3	-10	0	0	110.8	Y500 S545 D654 F658	Y500-Q656 HydrophobicContact CD2-CB 4.4Å; Y500-Q656 HydrophobicContact CE2-CB 4.2Å; Y500-Q656 HydrophobicContact CE2-CG 4.12Å; S545-Q656 PolarHBondContact N-O 3.07Å; S545-Q656 PolarHBondContact O-N 2.9Å; D654-Q656 WeakPolarHBondContact OD2-CG 3.22Å; D654-Q656 PolarHBondContact OD2-NE2 3.02Å; Q656-F658 HydrophobicContact CB-CE2 4.42Å; Q656-F658 HydrophobicContact CB-CZ 4.28Å
657	V	91.2	Very high	83.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127.4	170.9	-174.9	0	0	0	0	108.7	I501 T503 L528 I541 L544 F612	I501-V657 PolarHBondContact N-O 2.96Å; T503-V657 HydrophobicContact CG2-CB 4.08Å; T503-V657 HydrophobicContact CG2-CG2 3.93Å; L528-V657 HydrophobicContact CB-CG2 4.37Å; L528-V657 HydrophobicContact CD1-CG2 3.42Å; L528-V657 VanDerWaalsContact CD1-CG2 3.42Å; L528-V657 HydrophobicContact CG-CG2 4.49Å; I541-V657 HydrophobicContact CB-CG1 4.25Å; I541-V657 HydrophobicContact CD1-CG1 3.63Å; I541-V657 HydrophobicContact CG1-CG1 3.72Å; L544-V657 HydrophobicContact CD1-CG2 4.13Å; F612-V657 HydrophobicContact CE1-CG1 4.03Å; F612-V657 HydrophobicContact CE2-CG1 3.97Å; F612-V657 HydrophobicContact CZ-CB 4.38Å; F612-V657 HydrophobicContact CZ-CG1 3.59Å
658	F	90.1	Very high	85.4	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	140.4	174.5	-61.5	-73.2	0	0	0	110.7	L492 M495 L499 I542 G543 Q656	L492-F658 HydrophobicContact CD2-CB 3.32Å; L492-F658 HydrophobicContact CD2-CD1 4.27Å; L492-F658 HydrophobicContact CD2-CD2 3.92Å; L492-F658 HydrophobicContact CD2-CG 3.59Å; M495-F658 HydrophobicContact CB-CZ 4.03Å; M495-F658 HydrophobicContact CG-CZ 4.06Å; L499-F658 HydrophobicContact CB-CB 4.41Å; L499-F658 HydrophobicContact CB-CD1 4.04Å; L499-F658 CarbonylContact O-C 3.27Å; L499-F658 WeakPolarHBondContact O-CA 3.35Å; I542-F658 HydrophobicContact CG1-CB 4.29Å; I542-F658 PolarHBondContact N-O 2.95Å; G543-F658 PolarHBondContact N-O 3.05Å; G543-F658 PolarHBondContact O-N 2.78Å; Q656-F658 HydrophobicContact CB-CE2 4.42Å; Q656-F658 HydrophobicContact CB-CZ 4.28Å
659	G	88.8	Confident	86.5	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.3	-168.5	-172.7	0	0	0	0	0	114	L499 I501 M540	L499-G659 CarbonylContact C-O 3.58Å; L499-G659 PolarHBondContact O-N 2.87Å; L499-G659 VanDerWaalsContact O-O 3.07Å; I501-G659 VanDerWaalsContact CD1-C 3.46Å; M540-G659 WeakPolarHBondContact O-CA 3.42Å
660	Y	86.5	Confident	87.1	Confident	18 Å²	18	37.4 Å²	37.4	7%	0.071	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	165.5	173.5	56.7	-90.6	0	0	0	111.4	M540 I542 K609 L662	M540-Y660 HydrophobicContact CB-CD1 4.36Å; M540-Y660 HydrophobicContact CB-CD2 4.2Å; M540-Y660 HydrophobicContact CB-CE1 4.11Å; M540-Y660 HydrophobicContact CB-CE2 3.95Å; M540-Y660 HydrophobicContact CB-CG 4.41Å; M540-Y660 HydrophobicContact CG-CD2 4.34Å; M540-Y660 HydrophobicContact CG-CE2 3.79Å; M540-Y660 PolarHBondContact N-O 2.63Å; M540-Y660 PolarHBondContact O-N 2.96Å; I542-Y660 HydrophobicContact CG2-CD1 4.21Å; I542-Y660 HydrophobicContact CG2-CE1 3.88Å; K609-Y660 WeakPolarHBondContact CD-OH 3.37Å; K609-Y660 WeakPolarHBondContact CE-OH 3.29Å; K609-Y660 PolarHBondContact NZ-OH 3Å; Y660-L662 HydrophobicContact CD2-CD2 3.74Å; Y660-L662 HydrophobicContact CD2-CG 4.13Å; Y660-L662 HydrophobicContact CE2-CD1 4.31Å; Y660-L662 HydrophobicContact CE2-CD2 3.45Å; Y660-L662 VanDerWaalsContact CE2-CD2 3.45Å; Y660-L662 HydrophobicContact CE2-CG 3.86Å
661	S	86.2	Confident	87.4	Confident	55 Å²	55	40.6 Å²	40.6	39%	0.385	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	127.2	179.9	-52.2	0	0	0	0	110.2	L538 H539	L538-S661 CarbonylContact O-C 3.56Å; L538-S661 WeakPolarHBondContact O-CA 3.5Å; H539-S661 PolarHBondContact CE1-OG 3.49Å; H539-S661 VanDerWaalsContact CE1-OG 3.26Å; H539-S661 PolarHBondContact ND1-OG 3.11Å
662	L	86.3	Confident	87.4	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.021	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.8	177.1	-64.7	-179.4	0	0	0	110.3	I475 S476 T479 Y537 L538 M540 F611 Y660	I475-L662 HydrophobicContact CG2-CD1 4.33Å; S476-L662 WeakPolarHBondContact O-CD2 3.36Å; T479-L662 HydrophobicContact CG2-CD2 3.5Å; T479-L662 VanDerWaalsContact CG2-CD2 3.5Å; Y537-L662 CarbonylContact C-O 3.44Å; Y537-L662 WeakPolarHBondContact CA-O 3.5Å; Y537-L662 WeakPolarHBondContact CD1-O 3.39Å; L538-L662 HydrophobicContact CB-CB 4.46Å; L538-L662 PolarHBondContact N-O 3.36Å; L538-L662 PolarHBondContact O-N 2.94Å; M540-L662 HydrophobicContact CG-CD1 3.72Å; M540-L662 HydrophobicContact CG-CG 4.08Å; M540-L662 HydrophobicContact SD-CD1 4.31Å; F611-L662 HydrophobicContact CE1-CD1 4.11Å; F611-L662 HydrophobicContact CZ-CD1 4.5Å; Y660-L662 HydrophobicContact CD2-CD2 3.74Å; Y660-L662 HydrophobicContact CD2-CG 4.13Å; Y660-L662 HydrophobicContact CE2-CD1 4.31Å; Y660-L662 HydrophobicContact CE2-CD2 3.45Å; Y660-L662 VanDerWaalsContact CE2-CD2 3.45Å; Y660-L662 HydrophobicContact CE2-CG 3.86Å
663	R	85.4	Confident	87.4	Confident	180 Å²	180	39.3 Å²	39.3	68%	0.679	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	135.6	170	-70.7	-172.2	177.2	-174.8	3.3	109.8	Y537	Y537-R663 HydrophobicContact CD1-CG 4.34Å; Y537-R663 HydrophobicContact CE1-CG 3.68Å
664	F	87.3	Confident	87.4	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.035	22%	0.222	C	C	.	.	B	Isolated β-bridge	trans	-131.6	117.8	-179	172.5	-114.3	0	0	0	110.4	I475 D536 L538 A666 L669 M723 R727 L728	I475-F664 HydrophobicContact CD1-CD2 4.27Å; I475-F664 HydrophobicContact CD1-CE2 4.41Å; I475-F664 HydrophobicContact CG1-CD2 3.72Å; I475-F664 HydrophobicContact CG1-CE2 4.26Å; D536-F664 PolarHBondContact O-N 3.01Å; L538-F664 HydrophobicContact CD1-CB 4.02Å; L538-F664 HydrophobicContact CD1-CD2 3.9Å; L538-F664 HydrophobicContact CD1-CG 3.94Å; L538-F664 HydrophobicContact CG-CB 3.8Å; L538-F664 HydrophobicContact CG-CD1 4.49Å; L538-F664 HydrophobicContact CG-CD2 4.47Å; L538-F664 HydrophobicContact CG-CG 4Å; F664-A666 HydrophobicContact CD1-CB 4.17Å; F664-A666 HydrophobicContact CE1-CB 3.55Å; F664-A666 HydrophobicContact CZ-CB 4.16Å; F664-A666 PolarHBondContact O-N 3.32Å; F664-L669 HydrophobicContact CE2-CD2 3.71Å; F664-L669 HydrophobicContact CZ-CD2 4.1Å; F664-M723 HydrophobicContact CE2-SD 4.01Å; F664-M723 HydrophobicContact CZ-SD 4.43Å; F664-R727 HydrophobicContact CE1-CB 3.72Å; F664-R727 HydrophobicContact CE1-CG 4.31Å; F664-R727 HydrophobicContact CZ-CB 3.99Å; F664-L728 HydrophobicContact CZ-CD1 4.38Å
665	N	87.7	Confident	87.1	Confident	65 Å²	65	44.6 Å²	44.6	35%	0.348	22%	0.223	S	C	.	.			trans	-95.2	91.9	176.9	-165.4	-37.2	0	0	0	110.5	F474 D667 L668 L669	F474-N665 PolarHBondContact O-N 2.96Å; N665-D667 VanDerWaalsContact C-N 3.28Å; N665-D667 PolarHBondContact O-N 3.28Å; N665-D667 PolarHBondContact OD1-N 2.95Å; N665-L668 HydrophobicContact CB-CB 4.27Å; N665-L668 HydrophobicContact CB-CD1 4.15Å; N665-L668 HydrophobicContact CB-CG 4.39Å; N665-L668 VanDerWaalsContact ND2-CD1 3.25Å; N665-L668 WeakPolarHBondContact ND2-CD1 3.48Å; N665-L668 WeakPolarHBondContact ND2-CG 3.36Å; N665-L668 PolarHBondContact OD1-N 3.43Å; N665-L669 PolarHBondContact O-N 3.41Å
666	A	86.4	Confident	86.8	Confident	17 Å²	17	44.2 Å²	44.2	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-33.6	-178	0	0	0	0	0	113	F664 R670	F664-A666 HydrophobicContact CD1-CB 4.17Å; F664-A666 HydrophobicContact CE1-CB 3.55Å; F664-A666 HydrophobicContact CZ-CB 4.16Å; F664-A666 PolarHBondContact O-N 3.32Å; A666-R670 VanDerWaalsContact O-CB 3.31Å; A666-R670 WeakPolarHBondContact O-CB 3.38Å; A666-R670 PolarHBondContact O-N 3.3Å
667	D	85.9	Confident	86.3	Confident	111 Å²	111	43.4 Å²	43.4	59%	0.594	22%	0.218	S	C	*	.	H	α-helix	trans	-77.5	-41	-173.8	-66.9	-34.5	0	0	0	112.3	N665 R670 S671	N665-D667 VanDerWaalsContact C-N 3.28Å; N665-D667 PolarHBondContact O-N 3.28Å; N665-D667 PolarHBondContact OD1-N 2.95Å; D667-R670 WeakPolarHBondContact O-CB 3.04Å; D667-R670 PolarHBondContact O-N 3.37Å; D667-R670 IonicContact OD1-NH1 2.89Å; D667-R670 PolarHBondContact OD1-NH1 2.9Å; D667-S671 PolarHBondContact O-N 3.48Å
668	L	86.8	Confident	85.7	Confident	74 Å²	74	48.9 Å²	48.9	39%	0.387	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-46.1	172.2	-73.4	179.8	0	0	0	111.1	F474 N665 R670 S671 A672	F474-L668 HydrophobicContact CD1-CB 4.1Å; F474-L668 HydrophobicContact CE1-CB 3.93Å; N665-L668 HydrophobicContact CB-CB 4.27Å; N665-L668 HydrophobicContact CB-CD1 4.15Å; N665-L668 HydrophobicContact CB-CG 4.39Å; N665-L668 VanDerWaalsContact ND2-CD1 3.25Å; N665-L668 WeakPolarHBondContact ND2-CD1 3.48Å; N665-L668 WeakPolarHBondContact ND2-CG 3.36Å; N665-L668 PolarHBondContact OD1-N 3.43Å; L668-R670 VanDerWaalsContact C-N 3.3Å; L668-R670 PolarHBondContact O-N 2.93Å; L668-S671 PolarHBondContact O-N 3.23Å; L668-A672 PolarHBondContact O-N 3.32Å; L668-A672 VanDerWaalsContact O-N 3.1Å
669	L	87.6	Confident	84.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.4	-35.8	178.5	-168.8	59	0	0	0	111.5	F474 F664 N665 A672 V673 L696 I699 M723 L728	F474-L669 HydrophobicContact CD1-CB 3.92Å; F474-L669 HydrophobicContact CD1-CD1 3.83Å; F474-L669 HydrophobicContact CD1-CG 4.47Å; F474-L669 HydrophobicContact CE1-CD1 4.4Å; F664-L669 HydrophobicContact CE2-CD2 3.71Å; F664-L669 HydrophobicContact CZ-CD2 4.1Å; N665-L669 PolarHBondContact O-N 3.41Å; L669-A672 PolarHBondContact O-N 3.12Å; L669-V673 WeakPolarHBondContact O-CB 3.35Å; L669-V673 VanDerWaalsContact O-CG2 3.27Å; L669-V673 WeakPolarHBondContact O-CG2 3.16Å; L669-V673 PolarHBondContact O-N 3.17Å; L669-L696 HydrophobicContact CD1-CD2 3.65Å; L669-I699 HydrophobicContact CD1-CD1 4.13Å; L669-M723 HydrophobicContact CD2-CE 3.62Å; L669-L728 HydrophobicContact CB-CD2 4.15Å; L669-L728 HydrophobicContact CD2-CD1 3.83Å; L669-L728 HydrophobicContact CG-CD1 4.21Å; L669-L728 HydrophobicContact CG-CD2 4.21Å
670	R	87.9	Confident	84	Confident	80 Å²	80	51.8 Å²	51.8	30%	0.302	26%	0.255	S	S	.	.	H	α-helix	trans	-61.7	-43.9	174.8	-167.9	174.7	-73.5	123	0.2	111.5	A666 D667 L668 V673 Q674 L728	A666-R670 VanDerWaalsContact O-CB 3.31Å; A666-R670 WeakPolarHBondContact O-CB 3.38Å; A666-R670 PolarHBondContact O-N 3.3Å; D667-R670 WeakPolarHBondContact O-CB 3.04Å; D667-R670 PolarHBondContact O-N 3.37Å; D667-R670 IonicContact OD1-NH1 2.89Å; D667-R670 PolarHBondContact OD1-NH1 2.9Å; L668-R670 VanDerWaalsContact C-N 3.3Å; L668-R670 PolarHBondContact O-N 2.93Å; R670-V673 PolarHBondContact O-N 3.27Å; R670-Q674 WeakPolarHBondContact O-CB 3.48Å; R670-Q674 VanDerWaalsContact O-CG 3.3Å; R670-Q674 WeakPolarHBondContact O-CG 3.4Å; R670-Q674 PolarHBondContact O-N 2.85Å; R670-L728 VanDerWaalsContact CA-CD2 3.44Å; R670-L728 HydrophobicContact CB-CD2 3.7Å; R670-L728 HydrophobicContact CG-CD2 4.33Å; R670-L728 VanDerWaalsContact N-CD2 3.32Å; R670-L728 PolarHBondContact NH2-O 3.07Å
671	S	86.6	Confident	83.3	Confident	70 Å²	70	55.2 Å²	55.2	49%	0.49	28%	0.278	S	S	.	.	H	α-helix	trans	-61.4	-45.2	177.3	179.2	0	0	0	0	111.8	D667 L668 V673 Q674 Q675	D667-S671 PolarHBondContact O-N 3.48Å; L668-S671 PolarHBondContact O-N 3.23Å; S671-V673 PolarHBondContact O-N 3.23Å; S671-Q674 PolarHBondContact O-N 3.49Å; S671-Q675 PolarHBondContact O-N 2.75Å
672	A	85.3	Confident	82.2	Confident	7 Å²	7	57.4 Å²	57.4	6%	0.058	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-42.9	177.5	0	0	0	0	0	112.3	F474 L668 L669 Q675 V676 V692 L696	F474-A672 HydrophobicContact CE1-CB 4.09Å; L668-A672 PolarHBondContact O-N 3.32Å; L668-A672 VanDerWaalsContact O-N 3.1Å; L669-A672 PolarHBondContact O-N 3.12Å; A672-Q675 PolarHBondContact O-N 3.37Å; A672-V676 PolarHBondContact O-N 3.48Å; A672-V676 VanDerWaalsContact O-N 3.12Å; A672-V692 HydrophobicContact CB-CG1 3.98Å; A672-L696 HydrophobicContact CB-CD1 4.38Å; A672-L696 HydrophobicContact CB-CD2 4.48Å
673	V	87.2	Confident	80.8	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-64.6	-40.4	176.6	170.9	0	0	0	0	111.6	L669 R670 S671 Q675 V676 N677 L696 L724 L730 V738	L669-V673 WeakPolarHBondContact O-CB 3.35Å; L669-V673 VanDerWaalsContact O-CG2 3.27Å; L669-V673 WeakPolarHBondContact O-CG2 3.16Å; L669-V673 PolarHBondContact O-N 3.17Å; R670-V673 PolarHBondContact O-N 3.27Å; S671-V673 PolarHBondContact O-N 3.23Å; V673-Q675 VanDerWaalsContact C-N 3.33Å; V673-Q675 PolarHBondContact O-N 3.12Å; V673-V676 PolarHBondContact O-N 2.95Å; V673-N677 PolarHBondContact O-N 3.04Å; V673-L696 HydrophobicContact CG2-CD2 4.26Å; V673-L724 HydrophobicContact CG2-CD2 4.13Å; V673-L730 HydrophobicContact CG1-CD1 4.03Å; V673-L730 HydrophobicContact CG1-CD2 4.05Å; V673-V738 HydrophobicContact CG1-CG1 4.46Å; V673-V738 HydrophobicContact CG1-CG2 3.65Å
674	Q	85.1	Confident	79.1	Confident	105 Å²	105	57 Å²	57	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-62.3	-41	175	-76.6	174.4	-10.7	0	0	111.8	R670 S671 V676 N677 Q678	R670-Q674 WeakPolarHBondContact O-CB 3.48Å; R670-Q674 VanDerWaalsContact O-CG 3.3Å; R670-Q674 WeakPolarHBondContact O-CG 3.4Å; R670-Q674 PolarHBondContact O-N 2.85Å; S671-Q674 PolarHBondContact O-N 3.49Å; Q674-V676 VanDerWaalsContact C-N 3.35Å; Q674-V676 PolarHBondContact O-N 3.12Å; Q674-N677 PolarHBondContact O-N 3.34Å; Q674-Q678 WeakPolarHBondContact O-CB 3.42Å; Q674-Q678 VanDerWaalsContact O-CG 3.29Å; Q674-Q678 WeakPolarHBondContact O-CG 3.41Å; Q674-Q678 PolarHBondContact O-N 2.88Å
675	Q	83.1	Confident	77.4	Confident	77 Å²	77	61.3 Å²	61.3	36%	0.36	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-42.2	176.5	-172	175	-4.4	0	0	111.8	S671 A672 V673 Q678 S679	S671-Q675 PolarHBondContact O-N 2.75Å; A672-Q675 PolarHBondContact O-N 3.37Å; V673-Q675 VanDerWaalsContact C-N 3.33Å; V673-Q675 PolarHBondContact O-N 3.12Å; Q675-Q678 PolarHBondContact O-N 3.16Å; Q675-S679 PolarHBondContact O-N 2.98Å; Q675-S679 PolarHBondContact O-OG 2.79Å
676	V	82.9	Confident	75.7	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-44.6	174.1	170.1	0	0	0	0	111.8	A672 V673 Q674 Q678 S679 Y680 V692 M693 L696 A741	A672-V676 PolarHBondContact O-N 3.48Å; A672-V676 VanDerWaalsContact O-N 3.12Å; V673-V676 PolarHBondContact O-N 2.95Å; Q674-V676 VanDerWaalsContact C-N 3.35Å; Q674-V676 PolarHBondContact O-N 3.12Å; V676-Q678 VanDerWaalsContact C-N 3.33Å; V676-Q678 PolarHBondContact O-N 2.84Å; V676-S679 PolarHBondContact O-N 3.25Å; V676-Y680 WeakPolarHBondContact O-CB 3.38Å; V676-Y680 PolarHBondContact O-N 2.9Å; V676-V692 HydrophobicContact CG2-CG1 4.26Å; V676-M693 HydrophobicContact CG1-CE 4.15Å; V676-M693 HydrophobicContact CG1-SD 4.07Å; V676-M693 HydrophobicContact CG2-SD 4.06Å; V676-L696 HydrophobicContact CB-CD1 4.28Å; V676-L696 HydrophobicContact CG2-CD1 3.37Å; V676-A741 HydrophobicContact CG1-CB 3.73Å
677	N	79.3	Confident	74	Confident	28 Å²	28	66.4 Å²	66.4	15%	0.15	34%	0.344	C	S	.	.	H	α-helix	trans	-64.4	-39.2	179.9	-160.9	16.7	0	0	0	111.5	V673 Q674 Y680 T681	V673-N677 PolarHBondContact O-N 3.04Å; Q674-N677 PolarHBondContact O-N 3.34Å; N677-Y680 PolarHBondContact O-N 3.14Å; N677-T681 WeakPolarHBondContact O-CG2 3.38Å; N677-T681 PolarHBondContact O-N 2.85Å; N677-T681 PolarHBondContact O-OG1 3.3Å
678	Q	77	Confident	72.1	Confident	116 Å²	116	64.9 Å²	64.9	54%	0.542	34%	0.342	S	S	.	.	H	α-helix	trans	-62.8	-48	173.4	-73.1	172.3	3.8	0	0	111.4	Q674 Q675 V676 Y680 T681 Q682	Q674-Q678 WeakPolarHBondContact O-CB 3.42Å; Q674-Q678 VanDerWaalsContact O-CG 3.29Å; Q674-Q678 WeakPolarHBondContact O-CG 3.41Å; Q674-Q678 PolarHBondContact O-N 2.88Å; Q675-Q678 PolarHBondContact O-N 3.16Å; V676-Q678 VanDerWaalsContact C-N 3.33Å; V676-Q678 PolarHBondContact O-N 2.84Å; Q678-Y680 VanDerWaalsContact C-N 3.28Å; Q678-Y680 PolarHBondContact O-N 3.08Å; Q678-T681 PolarHBondContact O-N 2.79Å; Q678-T681 PolarHBondContact O-OG1 2.98Å; Q678-Q682 PolarHBondContact O-N 3.2Å
679	S	73	Confident	70.6	Confident	5 Å²	5	61.6 Å²	61.6	4%	0.035	33%	0.325	C	S	.	.	H	α-helix	trans	-59.8	-38.1	176.1	-60.9	0	0	0	0	112.5	Q675 V676 F686 S689	Q675-S679 PolarHBondContact O-N 2.98Å; Q675-S679 PolarHBondContact O-OG 2.79Å; V676-S679 PolarHBondContact O-N 3.25Å; S679-F686 WeakPolarHBondContact O-CD2 3.41Å; S679-S689 PolarHBondContact OG-OG 3.11Å
680	Y	71.1	Confident	69.6	Low	65 Å²	65	63.8 Å²	63.8	26%	0.255	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-45.8	176.9	-175.5	-93.3	0	0	0	112.5	V676 N677 Q678 Q682 F686 R737 H740 A741 M744	V676-Y680 WeakPolarHBondContact O-CB 3.38Å; V676-Y680 PolarHBondContact O-N 2.9Å; N677-Y680 PolarHBondContact O-N 3.14Å; Q678-Y680 VanDerWaalsContact C-N 3.28Å; Q678-Y680 PolarHBondContact O-N 3.08Å; Y680-Q682 PolarHBondContact O-N 3.18Å; Y680-F686 HydrophobicContact CD2-CE1 4.37Å; Y680-F686 HydrophobicContact CD2-CE2 4.34Å; Y680-F686 AromaticContact CD2-CZ 3.53Å; Y680-F686 HydrophobicContact CD2-CZ 3.53Å; Y680-F686 HydrophobicContact CE2-CZ 4.24Å; Y680-F686 HydrophobicContact CG-CZ 4.22Å; Y680-R737 HydrophobicContact CD1-CB 4.26Å; Y680-R737 HydrophobicContact CD1-CG 4.31Å; Y680-R737 HydrophobicContact CE1-CB 4.33Å; Y680-R737 HydrophobicContact CE1-CG 4.09Å; Y680-H740 AromaticContact CE2-ND1 3.37Å; Y680-H740 WeakPolarHBondContact CE2-ND1 3.4Å; Y680-H740 AromaticContact CZ-ND1 3.52Å; Y680-H740 PolarHBondContact OH-CE1 2.76Å; Y680-H740 PolarHBondContact OH-ND1 2.76Å; Y680-A741 HydrophobicContact CD2-CB 3.51Å; Y680-A741 HydrophobicContact CE2-CB 4.26Å; Y680-A741 HydrophobicContact CG-CB 4.21Å; Y680-M744 HydrophobicContact CD2-CE 4.11Å; Y680-M744 HydrophobicContact CE2-CE 3.63Å
681	T	70.5	Confident	69	Low	89 Å²	89	62.9 Å²	62.9	55%	0.546	35%	0.346	S	S	.	.	H	α-helix	trans	-70.9	-26.6	-177.6	55	0	0	0	0	114.4	N677 Q678	N677-T681 WeakPolarHBondContact O-CG2 3.38Å; N677-T681 PolarHBondContact O-N 2.85Å; N677-T681 PolarHBondContact O-OG1 3.3Å; Q678-T681 PolarHBondContact O-N 2.79Å; Q678-T681 PolarHBondContact O-OG1 2.98Å
682	Q	64.6	Low	68.6	Low	102 Å²	102	60.4 Å²	60.4	48%	0.477	33%	0.328	S	S	.	.	H	α-helix	trans	-90.3	-7.6	-174	-69.4	-174.6	0.1	0	0	114.7	Q678 Y680 T684	Q678-Q682 PolarHBondContact O-N 3.2Å; Y680-Q682 PolarHBondContact O-N 3.18Å; Q682-T684 PolarHBondContact O-N 3.21Å; Q682-T684 PolarHBondContact O-OG1 3.15Å
683	G	56.9	Low	68.3	Low	54 Å²	54	60.2 Å²	60.2	56%	0.557	33%	0.326	S	S	*	.	S	Bend	trans	62.5	-24.7	173.2	0	0	0	0	0	117
684	T	49.7	Very low	67.9	Low	121 Å²	121	61 Å²	61	74%	0.742	33%	0.33	S	S	*	.	S	Bend	trans	-113.5	-11.5	-169.2	46.2	0	0	0	0	112.7	Q682	Q682-T684 PolarHBondContact O-N 3.21Å; Q682-T684 PolarHBondContact O-OG1 3.15Å
685	Q	50.6	Low	67.6	Low	98 Å²	98	56.6 Å²	56.6	46%	0.458	31%	0.31	S	S	.	.			trans	-108	12.8	177	-67.8	-166.8	-2.1	0	0	114.7	Y687 S688	Q685-Y687 PolarHBondContact O-N 2.83Å; Q685-S688 PolarHBondContact O-N 3.09Å; Q685-S688 PolarHBondContact O-OG 3.29Å; Q685-S688 VanDerWaalsContact O-OG 3.11Å
686	F	52.6	Low	67.8	Low	38 Å²	38	53 Å²	53	17%	0.167	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-22.2	174.6	-98.7	-88.2	0	0	0	113.6	S679 Y680 M693 M744	S679-F686 WeakPolarHBondContact O-CD2 3.41Å; Y680-F686 HydrophobicContact CD2-CE1 4.37Å; Y680-F686 HydrophobicContact CD2-CE2 4.34Å; Y680-F686 AromaticContact CD2-CZ 3.53Å; Y680-F686 HydrophobicContact CD2-CZ 3.53Å; Y680-F686 HydrophobicContact CE2-CZ 4.24Å; Y680-F686 HydrophobicContact CG-CZ 4.22Å; F686-M693 HydrophobicContact CD1-CE 4.44Å; F686-M693 HydrophobicContact CE1-CE 4.31Å; F686-M744 HydrophobicContact CE1-CE 3.93Å; F686-M744 HydrophobicContact CE2-CE 4.41Å; F686-M744 HydrophobicContact CZ-CE 3.51Å
687	Y	49.5	Very low	67.8	Low	151 Å²	151	53.9 Å²	53.9	59%	0.592	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	-20.5	-176.1	-59.6	-68.2	0	0	0	115.6	K452 Q685	K452-Y687 HydrophobicContact CD-CD1 4.34Å; Q685-Y687 PolarHBondContact O-N 2.83Å
688	S	47.4	Very low	67.9	Low	80 Å²	80	54.5 Å²	54.5	56%	0.559	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-17.2	-177.2	54.8	0	0	0	0	113.9	Q685	Q685-S688 PolarHBondContact O-N 3.09Å; Q685-S688 PolarHBondContact O-OG 3.29Å; Q685-S688 VanDerWaalsContact O-OG 3.11Å
689	S	55.5	Low	68.4	Low	4 Å²	4	49 Å²	49	3%	0.028	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	19.2	-174.1	-54.9	0	0	0	0	114.3	S679 S691 V692 M693	S679-S689 PolarHBondContact OG-OG 3.11Å; S689-S691 VanDerWaalsContact C-N 3.27Å; S689-S691 PolarHBondContact O-N 3.07Å; S689-V692 PolarHBondContact O-N 3.3Å; S689-V692 VanDerWaalsContact O-N 3.1Å; S689-M693 PolarHBondContact O-N 3.42Å
690	S	66.5	Low	69.1	Low	46 Å²	46	50.5 Å²	50.5	32%	0.322	28%	0.28	S	S	.	.	H	α-helix	trans	-55.1	-38	-174	55.3	0	0	0	0	113.7	L694 Y745	S690-L694 WeakPolarHBondContact O-CB 3.4Å; S690-L694 VanDerWaalsContact O-CG 3.25Å; S690-L694 WeakPolarHBondContact O-CG 3.45Å; S690-L694 PolarHBondContact O-N 3.46Å; S690-Y745 WeakPolarHBondContact CB-OH 3.37Å
691	S	73.6	Confident	69.7	Low	61 Å²	61	50.4 Å²	50.4	43%	0.427	28%	0.284	S	S	.	.	H	α-helix	trans	-68.4	-40.4	177.7	56.1	0	0	0	0	113.2	S689 L695	S689-S691 VanDerWaalsContact C-N 3.27Å; S689-S691 PolarHBondContact O-N 3.07Å; S691-L695 VanDerWaalsContact O-CB 3.29Å; S691-L695 WeakPolarHBondContact O-CB 3.29Å; S691-L695 PolarHBondContact O-N 2.79Å; S691-L695 VanDerWaalsContact O-N 3.08Å
692	V	78.4	Confident	70.3	Confident	19 Å²	19	48.7 Å²	48.7	12%	0.115	27%	0.268	C	S	.	.	H	α-helix	trans	-74	-35.6	179.7	179.5	0	0	0	0	111	A672 V676 S689 L695 L696	A672-V692 HydrophobicContact CB-CG1 3.98Å; V676-V692 HydrophobicContact CG2-CG1 4.26Å; S689-V692 PolarHBondContact O-N 3.3Å; S689-V692 VanDerWaalsContact O-N 3.1Å; V692-L695 PolarHBondContact O-N 2.78Å; V692-L696 HydrophobicContact CG1-CD1 4.18Å; V692-L696 PolarHBondContact O-N 3.18Å
693	M	79.8	Confident	71.5	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.015	25%	0.245	C	C	.	.	H	α-helix	trans	-66.2	-46.5	175.6	-161.8	71.8	92.3	0	0	111.5	V676 F686 S689 L695 L696 L697 A741 L742 Y745	V676-M693 HydrophobicContact CG1-CE 4.15Å; V676-M693 HydrophobicContact CG1-SD 4.07Å; V676-M693 HydrophobicContact CG2-SD 4.06Å; F686-M693 HydrophobicContact CD1-CE 4.44Å; F686-M693 HydrophobicContact CE1-CE 4.31Å; S689-M693 PolarHBondContact O-N 3.42Å; M693-L695 VanDerWaalsContact C-N 3.31Å; M693-L695 PolarHBondContact O-N 3.09Å; M693-L696 PolarHBondContact O-N 2.72Å; M693-L697 WeakPolarHBondContact O-CB 3.33Å; M693-L697 VanDerWaalsContact O-CG 3.3Å; M693-L697 WeakPolarHBondContact O-CG 3.18Å; M693-L697 PolarHBondContact O-N 2.99Å; M693-A741 HydrophobicContact CE-CB 4.15Å; M693-L742 HydrophobicContact CG-CD2 4.13Å; M693-L742 HydrophobicContact SD-CD2 3.41Å; M693-L742 WeakPolarHBondContact SD-CD2 3.47Å; M693-L742 HydrophobicContact SD-CG 4.1Å; M693-Y745 HydrophobicContact CB-CD1 4.31Å; M693-Y745 HydrophobicContact CB-CD2 4.16Å; M693-Y745 HydrophobicContact CB-CE1 4.27Å; M693-Y745 HydrophobicContact CB-CE2 4.11Å; M693-Y745 HydrophobicContact CB-CG 4.26Å; M693-Y745 HydrophobicContact CE-CD2 4.24Å; M693-Y745 HydrophobicContact CE-CG 4.44Å; M693-Y745 HydrophobicContact CG-CD1 3.61Å; M693-Y745 HydrophobicContact CG-CD2 3.6Å; M693-Y745 HydrophobicContact CG-CE1 4.06Å; M693-Y745 HydrophobicContact CG-CE2 4.05Å; M693-Y745 HydrophobicContact CG-CG 3.35Å
694	L	77.9	Confident	73	Confident	19 Å²	19	41.7 Å²	41.7	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-40.8	174.7	-73.5	170.6	0	0	0	112	Q464 V466 S690 L697 D698 Y745 L750	Q464-L694 HydrophobicContact CB-CD1 4.5Å; V466-L694 HydrophobicContact CG2-CB 3.6Å; S690-L694 WeakPolarHBondContact O-CB 3.4Å; S690-L694 VanDerWaalsContact O-CG 3.25Å; S690-L694 WeakPolarHBondContact O-CG 3.45Å; S690-L694 PolarHBondContact O-N 3.46Å; L694-L697 PolarHBondContact O-N 3.36Å; L694-D698 PolarHBondContact O-N 2.96Å; L694-Y745 HydrophobicContact CD2-CE1 4.02Å; L694-Y745 HydrophobicContact CG-CE1 4.18Å; L694-L750 HydrophobicContact CD2-CD1 3.89Å; L694-L750 HydrophobicContact CD2-CD2 4.2Å
695	L	80.6	Confident	74.7	Confident	12 Å²	12	44 Å²	44	6%	0.063	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-45.3	176.9	177.3	68.3	0	0	0	112.5	V466 F474 S691 V692 M693 L697 D698 I699	V466-L695 HydrophobicContact CG1-CB 4.24Å; V466-L695 HydrophobicContact CG1-CD1 3.76Å; F474-L695 HydrophobicContact CD2-CD2 4.38Å; F474-L695 HydrophobicContact CE2-CD1 4.38Å; F474-L695 HydrophobicContact CE2-CD2 3.55Å; F474-L695 HydrophobicContact CE2-CG 4.34Å; F474-L695 HydrophobicContact CZ-CD2 3.71Å; S691-L695 VanDerWaalsContact O-CB 3.29Å; S691-L695 WeakPolarHBondContact O-CB 3.29Å; S691-L695 PolarHBondContact O-N 2.79Å; S691-L695 VanDerWaalsContact O-N 3.08Å; V692-L695 PolarHBondContact O-N 2.78Å; M693-L695 VanDerWaalsContact C-N 3.31Å; M693-L695 PolarHBondContact O-N 3.09Å; L695-L697 VanDerWaalsContact C-N 3.33Å; L695-D698 PolarHBondContact O-N 2.89Å; L695-I699 HydrophobicContact CD1-CD1 4.41Å; L695-I699 HydrophobicContact CG-CD1 4.25Å; L695-I699 WeakPolarHBondContact O-CG1 3.4Å; L695-I699 PolarHBondContact O-N 3.13Å
696	L	85.8	Confident	76.5	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-68.8	-32.5	177.3	-78	169.3	0	0	0	112.4	L669 A672 V673 V676 V692 M693 R700 F720 L742	L669-L696 HydrophobicContact CD1-CD2 3.65Å; A672-L696 HydrophobicContact CB-CD1 4.38Å; A672-L696 HydrophobicContact CB-CD2 4.48Å; V673-L696 HydrophobicContact CG2-CD2 4.26Å; V676-L696 HydrophobicContact CB-CD1 4.28Å; V676-L696 HydrophobicContact CG2-CD1 3.37Å; V692-L696 HydrophobicContact CG1-CD1 4.18Å; V692-L696 PolarHBondContact O-N 3.18Å; M693-L696 PolarHBondContact O-N 2.72Å; L696-R700 VanDerWaalsContact O-CB 3.26Å; L696-R700 WeakPolarHBondContact O-CB 3.22Å; L696-R700 PolarHBondContact O-N 2.79Å; L696-F720 HydrophobicContact CD2-CZ 4.49Å; L696-L742 HydrophobicContact CB-CD2 3.81Å
697	L	84	Confident	78.1	Confident	20 Å²	20	39.4 Å²	39.4	11%	0.105	20%	0.197	C	C	.	.	H	α-helix	trans	-63.4	-43.6	171.2	-75.5	173.5	0	0	0	111.8	M693 L694 L695 R700 D701 L742 Y745 L750	M693-L697 WeakPolarHBondContact O-CB 3.33Å; M693-L697 VanDerWaalsContact O-CG 3.3Å; M693-L697 WeakPolarHBondContact O-CG 3.18Å; M693-L697 PolarHBondContact O-N 2.99Å; L694-L697 PolarHBondContact O-N 3.36Å; L695-L697 VanDerWaalsContact C-N 3.33Å; L697-R700 PolarHBondContact O-N 2.93Å; L697-D701 PolarHBondContact O-N 2.66Å; L697-L742 HydrophobicContact CD2-CB 3.85Å; L697-L742 HydrophobicContact CD2-CD2 3.85Å; L697-L742 HydrophobicContact CD2-CG 4.4Å; L697-L742 HydrophobicContact CG-CD2 3.77Å; L697-Y745 HydrophobicContact CD1-CD1 3.69Å; L697-Y745 HydrophobicContact CD1-CE1 4.28Å; L697-L750 HydrophobicContact CD1-CD1 3.9Å
698	D	81.5	Confident	79.5	Confident	40 Å²	40	33 Å²	33	21%	0.214	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-47	175.5	-179.2	68	0	0	0	111.6	L694 L695 R700 D701 R702	L694-D698 PolarHBondContact O-N 2.96Å; L695-D698 PolarHBondContact O-N 2.89Å; D698-R700 VanDerWaalsContact C-N 3.33Å; D698-R700 PolarHBondContact O-N 3.15Å; D698-D701 PolarHBondContact O-N 2.96Å; D698-R702 WeakPolarHBondContact O-CG 3.48Å; D698-R702 PolarHBondContact O-N 2.79Å; D698-R702 IonicContact OD1-NE 3.12Å; D698-R702 PolarHBondContact OD1-NE 3.21Å; D698-R702 IonicContact OD1-NH2 3.63Å; D698-R702 IonicContact OD2-CZ 3.4Å; D698-R702 IonicContact OD2-NE 2.93Å; D698-R702 PolarHBondContact OD2-NE 3.46Å; D698-R702 IonicContact OD2-NH2 2.79Å
699	I	85.9	Confident	80.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-43.2	176.3	-66.6	168.2	0	0	0	110.9	F474 I475 L669 L695 R702 I703 F720	F474-I699 HydrophobicContact CB-CD1 3.94Å; F474-I699 HydrophobicContact CD1-CD1 4.35Å; F474-I699 HydrophobicContact CD2-CD1 4.17Å; F474-I699 HydrophobicContact CG-CD1 3.88Å; I475-I699 HydrophobicContact CD1-CG2 4.31Å; L669-I699 HydrophobicContact CD1-CD1 4.13Å; L695-I699 HydrophobicContact CD1-CD1 4.41Å; L695-I699 HydrophobicContact CG-CD1 4.25Å; L695-I699 WeakPolarHBondContact O-CG1 3.4Å; L695-I699 PolarHBondContact O-N 3.13Å; I699-R702 PolarHBondContact O-N 2.83Å; I699-I703 HydrophobicContact CG2-CD1 3.69Å; I699-I703 HydrophobicContact CG2-CG1 4.37Å; I699-I703 WeakPolarHBondContact O-CB 3.21Å; I699-I703 VanDerWaalsContact O-CG1 3.28Å; I699-I703 WeakPolarHBondContact O-CG1 3.34Å; I699-I703 PolarHBondContact O-N 3.23Å; I699-F720 HydrophobicContact CG2-CD2 4.5Å; I699-F720 HydrophobicContact CG2-CE2 4.13Å
700	R	87.8	Confident	81.6	Confident	37 Å²	37	33.1 Å²	33.1	14%	0.14	17%	0.174	C	C	.	.	H	α-helix	trans	-59.6	-46.9	177.5	178.3	173.9	73.4	164.5	8.1	111.6	L696 L697 D698 N704 F720 D743	L696-R700 VanDerWaalsContact O-CB 3.26Å; L696-R700 WeakPolarHBondContact O-CB 3.22Å; L696-R700 PolarHBondContact O-N 2.79Å; L697-R700 PolarHBondContact O-N 2.93Å; D698-R700 VanDerWaalsContact C-N 3.33Å; D698-R700 PolarHBondContact O-N 3.15Å; R700-N704 VanDerWaalsContact O-CB 3.31Å; R700-N704 WeakPolarHBondContact O-CB 3.41Å; R700-N704 PolarHBondContact O-N 2.83Å; R700-F720 HydrophobicContact CB-CB 4.43Å; R700-F720 HydrophobicContact CB-CD1 4.05Å; R700-F720 HydrophobicContact CB-CD2 3.99Å; R700-F720 HydrophobicContact CB-CE1 4.24Å; R700-F720 HydrophobicContact CB-CE2 4.22Å; R700-F720 HydrophobicContact CB-CG 3.9Å; R700-F720 HydrophobicContact CB-CZ 4.33Å; R700-F720 HydrophobicContact CG-CB 3.96Å; R700-F720 HydrophobicContact CG-CD1 3.77Å; R700-F720 HydrophobicContact CG-CD2 4.39Å; R700-F720 HydrophobicContact CG-CE1 4.33Å; R700-F720 HydrophobicContact CG-CG 3.79Å; R700-D743 IonicContact CZ-OD1 3.92Å; R700-D743 IonicContact NH1-OD1 3.88Å; R700-D743 PolarHBondContact NH1-OD1 3.28Å; R700-D743 IonicContact NH2-OD1 3.6Å; R700-D743 PolarHBondContact NH2-OD1 3.15Å
701	D	83.8	Confident	81.7	Confident	63 Å²	63	32.1 Å²	32.1	34%	0.337	17%	0.169	S	C	.	.	H	α-helix	trans	-64.9	-48	179	-175.1	35.6	0	0	0	111.3	L697 D698 I703 N704 R705	L697-D701 PolarHBondContact O-N 2.66Å; D698-D701 PolarHBondContact O-N 2.96Å; D701-I703 VanDerWaalsContact C-N 3.33Å; D701-I703 PolarHBondContact O-N 2.76Å; D701-N704 PolarHBondContact O-N 2.97Å; D701-R705 WeakPolarHBondContact O-CB 2.89Å; D701-R705 VanDerWaalsContact O-CG 3.24Å; D701-R705 WeakPolarHBondContact O-CG 3.43Å; D701-R705 PolarHBondContact O-N 3.08Å; D701-R705 IonicContact OD1-CZ 3.09Å; D701-R705 IonicContact OD1-NE 2.65Å; D701-R705 PolarHBondContact OD1-NE 2.93Å; D701-R705 IonicContact OD1-NH2 2.77Å; D701-R705 IonicContact OD2-CZ 3.83Å; D701-R705 IonicContact OD2-NE 3.99Å; D701-R705 PolarHBondContact OD2-NE 3.27Å; D701-R705 IonicContact OD2-NH2 3.12Å; D701-R705 PolarHBondContact OD2-NH2 3.28Å
702	R	84.7	Confident	81.3	Confident	53 Å²	53	35.2 Å²	35.2	20%	0.2	19%	0.188	C	C	.	.	H	α-helix	trans	-57.7	-42.3	177.4	-71	-178.8	-172.9	-126.3	2.6	112.7	S468 F477 D698 I699	S468-R702 PolarHBondContact OG-NH2 3.05Å; F477-R702 HydrophobicContact CE1-CB 4.19Å; F477-R702 HydrophobicContact CE2-CB 4.1Å; F477-R702 HydrophobicContact CZ-CB 3.94Å; D698-R702 WeakPolarHBondContact O-CG 3.48Å; D698-R702 PolarHBondContact O-N 2.79Å; D698-R702 IonicContact OD1-NE 3.12Å; D698-R702 PolarHBondContact OD1-NE 3.21Å; D698-R702 IonicContact OD1-NH2 3.63Å; D698-R702 IonicContact OD2-CZ 3.4Å; D698-R702 IonicContact OD2-NE 2.93Å; D698-R702 PolarHBondContact OD2-NE 3.46Å; D698-R702 IonicContact OD2-NH2 2.79Å; I699-R702 PolarHBondContact O-N 2.83Å
703	I	88.3	Confident	80.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.3	-46.3	178.5	-70.1	176.1	0	0	0	111.3	I475 F477 F611 I699 D701 R705 L706 L719 F720 M723	I475-I703 HydrophobicContact CD1-CD1 3.64Å; I475-I703 HydrophobicContact CD1-CG1 4.28Å; F477-I703 HydrophobicContact CE1-CG1 4.11Å; F477-I703 HydrophobicContact CZ-CD1 4.45Å; F477-I703 HydrophobicContact CZ-CG1 3.8Å; F611-I703 HydrophobicContact CE2-CG1 4.38Å; F611-I703 HydrophobicContact CE2-CG2 4.26Å; I699-I703 HydrophobicContact CG2-CD1 3.69Å; I699-I703 HydrophobicContact CG2-CG1 4.37Å; I699-I703 WeakPolarHBondContact O-CB 3.21Å; I699-I703 VanDerWaalsContact O-CG1 3.28Å; I699-I703 WeakPolarHBondContact O-CG1 3.34Å; I699-I703 PolarHBondContact O-N 3.23Å; D701-I703 VanDerWaalsContact C-N 3.33Å; D701-I703 PolarHBondContact O-N 2.76Å; I703-R705 VanDerWaalsContact C-N 3.27Å; I703-R705 PolarHBondContact O-N 2.66Å; I703-L706 WeakPolarHBondContact O-CB 3.24Å; I703-L706 PolarHBondContact O-N 3.32Å; I703-L706 VanDerWaalsContact O-N 3.08Å; I703-L719 HydrophobicContact CG2-CB 3.72Å; I703-F720 HydrophobicContact CD1-CD2 4.12Å; I703-F720 HydrophobicContact CG2-CB 4.34Å; I703-M723 HydrophobicContact CD1-CE 3.29Å; I703-M723 HydrophobicContact CD1-SD 3.51Å; I703-M723 VanDerWaalsContact CD1-SD 3.51Å
704	N	88.9	Confident	80.3	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.053	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-27.6	-177.2	-75.6	-13.3	0	0	0	112.1	R700 D701 L706 A707 Q716 D718 L719 F720	R700-N704 VanDerWaalsContact O-CB 3.31Å; R700-N704 WeakPolarHBondContact O-CB 3.41Å; R700-N704 PolarHBondContact O-N 2.83Å; D701-N704 PolarHBondContact O-N 2.97Å; N704-L706 PolarHBondContact O-N 3.42Å; N704-A707 WeakPolarHBondContact O-CB 3.46Å; N704-A707 PolarHBondContact O-N 2.92Å; N704-Q716 VanDerWaalsContact O-CD 3.28Å; N704-Q716 PolarHBondContact O-NE2 2.67Å; N704-D718 PolarHBondContact ND2-OD1 2.97Å; N704-D718 VanDerWaalsContact ND2-OD1 3.11Å; N704-D718 PolarHBondContact OD1-OD1 3.07Å; N704-L719 PolarHBondContact OD1-N 2.79Å; N704-F720 PolarHBondContact OD1-N 2.94Å
705	R	85.3	Confident	80.3	Confident	169 Å²	169	47.3 Å²	47.3	64%	0.638	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.3	170.3	-75.7	173.9	-171.3	-162.3	4.6	114.2	D701 I703 A707	D701-R705 WeakPolarHBondContact O-CB 2.89Å; D701-R705 VanDerWaalsContact O-CG 3.24Å; D701-R705 WeakPolarHBondContact O-CG 3.43Å; D701-R705 PolarHBondContact O-N 3.08Å; D701-R705 IonicContact OD1-CZ 3.09Å; D701-R705 IonicContact OD1-NE 2.65Å; D701-R705 PolarHBondContact OD1-NE 2.93Å; D701-R705 IonicContact OD1-NH2 2.77Å; D701-R705 IonicContact OD2-CZ 3.83Å; D701-R705 IonicContact OD2-NE 3.99Å; D701-R705 PolarHBondContact OD2-NE 3.27Å; D701-R705 IonicContact OD2-NH2 3.12Å; D701-R705 PolarHBondContact OD2-NH2 3.28Å; I703-R705 VanDerWaalsContact C-N 3.27Å; I703-R705 PolarHBondContact O-N 2.66Å; R705-A707 PolarHBondContact O-N 2.98Å
706	L	87.8	Confident	80.4	Confident	29 Å²	29	49.9 Å²	49.9	15%	0.152	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.1	175.8	-60.3	172.7	0	0	0	113	M540 K609 T610 F611 I703 N704 L719	M540-L706 HydrophobicContact CE-CD1 3.88Å; M540-L706 HydrophobicContact CE-CD2 3.98Å; M540-L706 HydrophobicContact CE-CG 4.46Å; M540-L706 HydrophobicContact SD-CD1 4.2Å; K609-L706 HydrophobicContact CG-CD2 4.03Å; T610-L706 VanDerWaalsContact CB-O 3.28Å; T610-L706 WeakPolarHBondContact CB-O 3.17Å; T610-L706 PolarHBondContact OG1-O 3.43Å; F611-L706 HydrophobicContact CD2-CD1 4.08Å; F611-L706 HydrophobicContact CE2-CD1 3.47Å; F611-L706 VanDerWaalsContact CE2-CD1 3.47Å; F611-L706 HydrophobicContact CZ-CD1 3.87Å; I703-L706 WeakPolarHBondContact O-CB 3.24Å; I703-L706 PolarHBondContact O-N 3.32Å; I703-L706 VanDerWaalsContact O-N 3.08Å; N704-L706 PolarHBondContact O-N 3.42Å; L706-L719 HydrophobicContact CB-CD1 4.43Å
707	A	86.3	Confident	80.5	Confident	10 Å²	10	51.5 Å²	51.5	8%	0.083	29%	0.289	C	S	.	.	S	Bend	trans	-67.8	154.1	170.6	0	0	0	0	0	111.2	N704 R705 Q716 L717 L719	N704-A707 WeakPolarHBondContact O-CB 3.46Å; N704-A707 PolarHBondContact O-N 2.92Å; R705-A707 PolarHBondContact O-N 2.98Å; A707-Q716 HydrophobicContact CB-CG 3.72Å; A707-L717 HydrophobicContact CB-CB 4.14Å; A707-L719 HydrophobicContact CB-CD1 4Å; A707-L719 HydrophobicContact CB-CG 4.01Å
708	P	80.7	Confident	80.7	Confident	16 Å²	16	51.1 Å²	51.1	10%	0.104	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-57.4	153	174.7	25.1	-36.4	0	0	0	112.7	W575 S710 L717	W575-P708 HydrophobicContact CD2-CB 4.19Å; W575-P708 HydrophobicContact CD2-CG 3.59Å; W575-P708 HydrophobicContact CE3-CB 3.66Å; W575-P708 HydrophobicContact CE3-CG 3.51Å; W575-P708 HydrophobicContact CG-CG 4.11Å; W575-P708 HydrophobicContact CH2-CB 3.76Å; W575-P708 HydrophobicContact CH2-CG 4.16Å; W575-P708 HydrophobicContact CZ2-CB 4.25Å; W575-P708 HydrophobicContact CZ2-CG 4.2Å; W575-P708 HydrophobicContact CZ3-CB 3.42Å; W575-P708 VanDerWaalsContact CZ3-CB 3.42Å; W575-P708 HydrophobicContact CZ3-CG 3.81Å; P708-S710 PolarHBondContact O-N 3.34Å; P708-L717 HydrophobicContact CG-CD1 3.65Å; P708-L717 HydrophobicContact CG-CG 4.48Å
709	P	75	Confident	81.1	Confident	35 Å²	35	49.2 Å²	49.2	23%	0.227	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59.9	130.5	173.7	25.7	-33.4	0	0	0	110.4	P578 H582 Y584 W608	P578-P709 HydrophobicContact CG-CG 4.44Å; H582-P709 HydrophobicContact CB-CB 4.47Å; Y584-P709 HydrophobicContact CD2-CG 4Å; W608-P709 HydrophobicContact CE3-CG 4.06Å; W608-P709 HydrophobicContact CH2-CB 4.16Å; W608-P709 HydrophobicContact CH2-CG 3.97Å; W608-P709 HydrophobicContact CZ3-CB 3.7Å; W608-P709 HydrophobicContact CZ3-CG 3.41Å; W608-P709 VanDerWaalsContact CZ3-CG 3.41Å
710	S	71	Confident	81.4	Confident	52 Å²	52	49.2 Å²	49.2	36%	0.364	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-90.4	151.1	169.6	60.6	0	0	0	0	110.6	P708 K714	P708-S710 PolarHBondContact O-N 3.34Å; S710-K714 WeakPolarHBondContact CB-O 3Å; S710-K714 PolarHBondContact OG-O 2.86Å
711	A	69.5	Low	81.5	Confident	25 Å²	25	47.6 Å²	47.6	21%	0.207	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-60.8	152.2	171	0	0	0	0	0	110.5	G713 K714	A711-G713 PolarHBondContact O-N 2.66Å; A711-K714 HydrophobicContact CB-CD 4.18Å; A711-K714 HydrophobicContact CB-CG 4.37Å; A711-K714 WeakPolarHBondContact O-CB 3.32Å; A711-K714 PolarHBondContact O-N 3.21Å
712	P	64.9	Low	81.7	Confident	126 Å²	126	44.6 Å²	44.6	82%	0.818	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	124.5	177.5	-22.9	31.6	0	0	0	111.2
713	G	62.5	Low	82	Confident	88 Å²	88	42.1 Å²	42.1	91%	0.907	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	1.3	-177.8	0	0	0	0	0	115.8	A711	A711-G713 PolarHBondContact O-N 2.66Å
714	K	73.2	Confident	82.1	Confident	146 Å²	146	42.1 Å²	42.1	64%	0.635	25%	0.246	S	C	*	.	S	Bend	trans	-98.2	137.6	169.9	-70.9	-169.3	-179.5	179.9	0	111.7	S710 A711	S710-K714 WeakPolarHBondContact CB-O 3Å; S710-K714 PolarHBondContact OG-O 2.86Å; A711-K714 HydrophobicContact CB-CD 4.18Å; A711-K714 HydrophobicContact CB-CG 4.37Å; A711-K714 WeakPolarHBondContact O-CB 3.32Å; A711-K714 PolarHBondContact O-N 3.21Å
715	P	78.1	Confident	82.1	Confident	61 Å²	61	44.1 Å²	44.1	40%	0.396	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-63.3	144.7	177.4	27.6	-36.1	0	0	0	111.8	L756 A758	P715-L756 WeakPolarHBondContact CA-O 3.43Å; P715-L756 HydrophobicContact CB-CB 4.23Å; P715-L756 WeakPolarHBondContact CB-O 3.44Å; P715-A758 HydrophobicContact CB-CB 4.29Å; P715-A758 HydrophobicContact CG-CB 3.92Å
716	Q	83.6	Confident	82.2	Confident	66 Å²	66	38.4 Å²	38.4	31%	0.308	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.8	176.7	-171.5	168.2	20.9	0	0	110.6	N704 A707 T757 A758	N704-Q716 VanDerWaalsContact O-CD 3.28Å; N704-Q716 PolarHBondContact O-NE2 2.67Å; A707-Q716 HydrophobicContact CB-CG 3.72Å; Q716-T757 CarbonylContact O-C 3.56Å; Q716-T757 WeakPolarHBondContact O-CA 3.4Å; Q716-T757 WeakPolarHBondContact O-CB 3.47Å; Q716-A758 PolarHBondContact O-N 3.04Å
717	L	87.4	Confident	82.1	Confident	36 Å²	36	38 Å²	38	19%	0.188	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	136.8	179	-65.9	175	0	0	0	111.5	W575 A707 P708 L719 A758 L760	W575-L717 HydrophobicContact CB-CD1 3.69Å; W575-L717 HydrophobicContact CG-CD1 3.92Å; A707-L717 HydrophobicContact CB-CB 4.14Å; P708-L717 HydrophobicContact CG-CD1 3.65Å; P708-L717 HydrophobicContact CG-CG 4.48Å; L717-L719 PolarHBondContact O-N 3.04Å; L717-A758 WeakPolarHBondContact CA-O 3.37Å; L717-A758 HydrophobicContact CD2-CB 4.15Å; L717-L760 HydrophobicContact CD1-CD1 4.38Å; L717-L760 HydrophobicContact CD2-CB 4.45Å
718	D	89	Confident	82.2	Confident	11 Å²	11	37.7 Å²	37.7	6%	0.059	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	87.4	177.2	-170.7	8.9	0	0	0	111.5	N704 F720 S721 A758	N704-D718 PolarHBondContact ND2-OD1 2.97Å; N704-D718 VanDerWaalsContact ND2-OD1 3.11Å; N704-D718 PolarHBondContact OD1-OD1 3.07Å; D718-F720 PolarHBondContact OD1-N 3.42Å; D718-S721 PolarHBondContact OD1-N 3.47Å; D718-S721 WeakPolarHBondContact OD2-CB 3.27Å; D718-S721 PolarHBondContact OD2-OG 3.48Å; D718-A758 PolarHBondContact N-O 3.05Å
719	L	89.9	Confident	82.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-72.7	-30.6	174.9	-63.8	-171.2	0	0	0	112	P566 F567 I703 N704 L706 A707 L717 C722 M723 L760	P566-L719 HydrophobicContact CB-CD2 4.45Å; P566-L719 HydrophobicContact CG-CD2 3.95Å; F567-L719 HydrophobicContact CE2-CB 4.4Å; F567-L719 WeakPolarHBondContact CE2-O 3.48Å; I703-L719 HydrophobicContact CG2-CB 3.72Å; N704-L719 PolarHBondContact OD1-N 2.79Å; L706-L719 HydrophobicContact CB-CD1 4.43Å; A707-L719 HydrophobicContact CB-CD1 4Å; A707-L719 HydrophobicContact CB-CG 4.01Å; L717-L719 PolarHBondContact O-N 3.04Å; L719-C722 WeakPolarHBondContact O-CB 3.39Å; L719-C722 PolarHBondContact O-N 2.91Å; L719-M723 PolarHBondContact O-N 3.44Å; L719-L760 HydrophobicContact CD2-CD2 3.71Å
720	F	91.2	Very high	83.2	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-49.7	-179.4	178.3	-106.7	0	0	0	111.4	L696 I699 R700 I703 N704 D718 C722 M723 L724 L742	L696-F720 HydrophobicContact CD2-CZ 4.49Å; I699-F720 HydrophobicContact CG2-CD2 4.5Å; I699-F720 HydrophobicContact CG2-CE2 4.13Å; R700-F720 HydrophobicContact CB-CB 4.43Å; R700-F720 HydrophobicContact CB-CD1 4.05Å; R700-F720 HydrophobicContact CB-CD2 3.99Å; R700-F720 HydrophobicContact CB-CE1 4.24Å; R700-F720 HydrophobicContact CB-CE2 4.22Å; R700-F720 HydrophobicContact CB-CG 3.9Å; R700-F720 HydrophobicContact CB-CZ 4.33Å; R700-F720 HydrophobicContact CG-CB 3.96Å; R700-F720 HydrophobicContact CG-CD1 3.77Å; R700-F720 HydrophobicContact CG-CD2 4.39Å; R700-F720 HydrophobicContact CG-CE1 4.33Å; R700-F720 HydrophobicContact CG-CG 3.79Å; I703-F720 HydrophobicContact CD1-CD2 4.12Å; I703-F720 HydrophobicContact CG2-CB 4.34Å; N704-F720 PolarHBondContact OD1-N 2.94Å; D718-F720 PolarHBondContact OD1-N 3.42Å; F720-C722 VanDerWaalsContact C-N 3.34Å; F720-C722 PolarHBondContact O-N 3.25Å; F720-M723 HydrophobicContact CD2-CE 4.05Å; F720-M723 HydrophobicContact CE2-CE 4.19Å; F720-M723 WeakPolarHBondContact O-CB 3.38Å; F720-M723 PolarHBondContact O-N 2.78Å; F720-M723 VanDerWaalsContact O-N 3.1Å; F720-L724 HydrophobicContact CD1-CD1 4.08Å; F720-L724 HydrophobicContact CD1-CG 4.36Å; F720-L724 HydrophobicContact CE1-CD1 3.57Å; F720-L724 HydrophobicContact CE1-CD2 4.41Å; F720-L724 HydrophobicContact CE1-CG 4.08Å; F720-L724 HydrophobicContact CE2-CD2 4.24Å; F720-L724 HydrophobicContact CZ-CD1 3.97Å; F720-L724 HydrophobicContact CZ-CD2 4Å; F720-L724 HydrophobicContact CZ-CG 4.17Å; F720-L724 WeakPolarHBondContact O-CG 3.47Å; F720-L724 PolarHBondContact O-N 2.9Å; F720-L742 HydrophobicContact CE1-CD1 3.98Å; F720-L742 HydrophobicContact CZ-CD1 4.41Å
721	S	90.2	Very high	84	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.028	25%	0.254	C	S	.	.	H	α-helix	trans	-58	-42.8	175.4	-72.5	0	0	0	0	113.1	D718 M723 L724 K725 N739	D718-S721 PolarHBondContact OD1-N 3.47Å; D718-S721 WeakPolarHBondContact OD2-CB 3.27Å; D718-S721 PolarHBondContact OD2-OG 3.48Å; S721-M723 VanDerWaalsContact C-N 3.32Å; S721-M723 PolarHBondContact O-N 3.28Å; S721-L724 WeakPolarHBondContact O-CB 3.45Å; S721-L724 PolarHBondContact O-N 2.95Å; S721-K725 PolarHBondContact O-N 2.94Å; S721-N739 PolarHBondContact OG-ND2 2.78Å
722	C	89.1	Confident	84.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.8	-41.1	175	-73.8	0	0	0	0	112.3	F567 L719 F720 K725 H726 C761	F567-C722 HydrophobicContact CD2-CB 3.81Å; F567-C722 HydrophobicContact CE2-CB 4.32Å; L719-C722 WeakPolarHBondContact O-CB 3.39Å; L719-C722 PolarHBondContact O-N 2.91Å; F720-C722 VanDerWaalsContact C-N 3.34Å; F720-C722 PolarHBondContact O-N 3.25Å; C722-K725 PolarHBondContact O-N 2.65Å; C722-H726 PolarHBondContact O-CD2 3.21Å; C722-H726 VanDerWaalsContact O-CD2 3.3Å; C722-H726 PolarHBondContact O-N 2.82Å; C722-C761 HydrophobicContact CB-CB 3.95Å; C722-C761 WeakPolarHBondContact CB-SG 3.49Å; C722-C761 WeakPolarHBondContact SG-CB 3.43Å; C722-C761 PolarHBondContact SG-N 3.42Å; C722-C761 CovalentContact SG-SG 2.03Å; C722-C761 PolarHBondContact SG-SG 2.73Å
723	M	90	Very high	85.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-45.9	176.4	-171.9	-170.7	60.9	0	0	110.8	I475 L538 F567 F664 L669 I703 L719 F720 S721 K725 H726 R727 L728	I475-M723 HydrophobicContact CD1-CE 4.45Å; I475-M723 HydrophobicContact CD1-SD 4.02Å; L538-M723 HydrophobicContact CD1-SD 4.33Å; F567-M723 HydrophobicContact CD1-CB 4.5Å; F567-M723 HydrophobicContact CD1-CG 4.39Å; F567-M723 HydrophobicContact CD2-CB 4.1Å; F567-M723 HydrophobicContact CE1-CB 4.14Å; F567-M723 HydrophobicContact CE1-CG 3.99Å; F567-M723 HydrophobicContact CE2-CB 3.7Å; F567-M723 HydrophobicContact CE2-CG 4.45Å; F567-M723 HydrophobicContact CG-CB 4.49Å; F567-M723 HydrophobicContact CZ-CB 3.72Å; F567-M723 HydrophobicContact CZ-CG 4.02Å; F664-M723 HydrophobicContact CE2-SD 4.01Å; F664-M723 HydrophobicContact CZ-SD 4.43Å; L669-M723 HydrophobicContact CD2-CE 3.62Å; I703-M723 HydrophobicContact CD1-CE 3.29Å; I703-M723 HydrophobicContact CD1-SD 3.51Å; I703-M723 VanDerWaalsContact CD1-SD 3.51Å; L719-M723 PolarHBondContact O-N 3.44Å; F720-M723 HydrophobicContact CD2-CE 4.05Å; F720-M723 HydrophobicContact CE2-CE 4.19Å; F720-M723 WeakPolarHBondContact O-CB 3.38Å; F720-M723 PolarHBondContact O-N 2.78Å; F720-M723 VanDerWaalsContact O-N 3.1Å; S721-M723 VanDerWaalsContact C-N 3.32Å; S721-M723 PolarHBondContact O-N 3.28Å; M723-K725 VanDerWaalsContact C-N 3.32Å; M723-K725 PolarHBondContact O-N 2.83Å; M723-H726 PolarHBondContact O-N 2.92Å; M723-R727 HydrophobicContact CG-CB 4.17Å; M723-R727 HydrophobicContact CG-CG 4.07Å; M723-R727 WeakPolarHBondContact O-CA 3.46Å; M723-R727 VanDerWaalsContact O-CB 3.3Å; M723-R727 WeakPolarHBondContact O-CB 3.34Å; M723-R727 PolarHBondContact O-N 2.78Å; M723-L728 PolarHBondContact O-N 2.9Å
724	L	90.1	Very high	86.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-55.7	-46.9	175.7	-67	-169.9	0	0	0	111.4	V673 F720 S721 L728 K729 L730 V738	V673-L724 HydrophobicContact CG2-CD2 4.13Å; F720-L724 HydrophobicContact CD1-CD1 4.08Å; F720-L724 HydrophobicContact CD1-CG 4.36Å; F720-L724 HydrophobicContact CE1-CD1 3.57Å; F720-L724 HydrophobicContact CE1-CD2 4.41Å; F720-L724 HydrophobicContact CE1-CG 4.08Å; F720-L724 HydrophobicContact CE2-CD2 4.24Å; F720-L724 HydrophobicContact CZ-CD1 3.97Å; F720-L724 HydrophobicContact CZ-CD2 4Å; F720-L724 HydrophobicContact CZ-CG 4.17Å; F720-L724 WeakPolarHBondContact O-CG 3.47Å; F720-L724 PolarHBondContact O-N 2.9Å; S721-L724 WeakPolarHBondContact O-CB 3.45Å; S721-L724 PolarHBondContact O-N 2.95Å; L724-L728 HydrophobicContact CD2-CD1 3.55Å; L724-L728 WeakPolarHBondContact O-CB 3.11Å; L724-L728 PolarHBondContact O-N 2.83Å; L724-K729 PolarHBondContact O-N 3.23Å; L724-L730 HydrophobicContact CB-CD1 3.68Å; L724-L730 HydrophobicContact CD1-CD1 4.42Å; L724-L730 HydrophobicContact CD2-CD1 4Å; L724-L730 HydrophobicContact CG-CD1 4.23Å; L724-L730 PolarHBondContact O-N 2.81Å; L724-V738 HydrophobicContact CD1-CG1 4.24Å
725	K	89.3	Confident	87.6	Confident	52 Å²	52	37.6 Å²	37.6	23%	0.226	19%	0.191	C	C	.	.	H	α-helix	trans	-64.4	-50.4	179.9	-173.5	-175	-178	-171.4	0	112.8	E573 S721 C722 M723 K729 M735 C761	E573-K725 IonicContact OE1-NZ 3.48Å; E573-K725 PolarHBondContact OE1-NZ 3.37Å; S721-K725 PolarHBondContact O-N 2.94Å; C722-K725 PolarHBondContact O-N 2.65Å; M723-K725 VanDerWaalsContact C-N 3.32Å; M723-K725 PolarHBondContact O-N 2.83Å; K725-K729 VanDerWaalsContact O-CA 3.23Å; K725-K729 WeakPolarHBondContact O-CA 3.46Å; K725-K729 PolarHBondContact O-N 3.33Å; K725-M735 HydrophobicContact CB-SD 4.3Å; K725-C761 HydrophobicContact CD-CB 3.92Å
726	H	87.3	Confident	87.9	Confident	50 Å²	50	39.4 Å²	39.4	23%	0.231	20%	0.196	C	C	.	.	H	α-helix	trans	-90.3	-37.2	-170.3	-68.7	-69.2	0	0	0	114.5	F567 S568 E573 C722 M723	F567-H726 HydrophobicContact CB-CB 3.92Å; S568-H726 VanDerWaalsContact CB-CE1 3.44Å; S568-H726 WeakPolarHBondContact CB-CE1 3.35Å; E573-H726 IonicContact OE1-CE1 2.63Å; E573-H726 IonicContact OE1-NE2 2.67Å; E573-H726 PolarHBondContact OE1-NE2 2.91Å; E573-H726 IonicContact OE2-CE1 2.82Å; E573-H726 PolarHBondContact OE2-CE1 3.18Å; E573-H726 IonicContact OE2-NE2 3.32Å; E573-H726 PolarHBondContact OE2-NE2 3Å; E573-H726 VanDerWaalsContact OE2-NE2 3.09Å; C722-H726 PolarHBondContact O-CD2 3.21Å; C722-H726 VanDerWaalsContact O-CD2 3.3Å; C722-H726 PolarHBondContact O-N 2.82Å; M723-H726 PolarHBondContact O-N 2.92Å
727	R	86.2	Confident	88.1	Confident	19 Å²	19	41.3 Å²	41.3	7%	0.072	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-40.5	-177.6	-64.5	-65.4	-175.3	-166.3	-4	112.4	L538 F567 E613 F664 M723	L538-R727 HydrophobicContact CD2-CG 4.09Å; L538-R727 VanDerWaalsContact CD2-NE 3.28Å; F567-R727 HydrophobicContact CD1-CG 4.09Å; E613-R727 IonicContact OE2-CZ 3.02Å; E613-R727 IonicContact OE2-NH1 3.94Å; E613-R727 IonicContact OE2-NH2 3.44Å; E613-R727 PolarHBondContact OE2-NH2 3.29Å; F664-R727 HydrophobicContact CE1-CB 3.72Å; F664-R727 HydrophobicContact CE1-CG 4.31Å; F664-R727 HydrophobicContact CZ-CB 3.99Å; M723-R727 HydrophobicContact CG-CB 4.17Å; M723-R727 HydrophobicContact CG-CG 4.07Å; M723-R727 WeakPolarHBondContact O-CA 3.46Å; M723-R727 VanDerWaalsContact O-CB 3.3Å; M723-R727 WeakPolarHBondContact O-CB 3.34Å; M723-R727 PolarHBondContact O-N 2.78Å
728	L	88.1	Confident	88	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	19%	0.192	C	C	.	.	S	Bend	trans	-89.6	-13.4	177.4	-69.5	117.1	0	0	0	113.9	F664 L669 R670 M723 L724 L730	F664-L728 HydrophobicContact CZ-CD1 4.38Å; L669-L728 HydrophobicContact CB-CD2 4.15Å; L669-L728 HydrophobicContact CD2-CD1 3.83Å; L669-L728 HydrophobicContact CG-CD1 4.21Å; L669-L728 HydrophobicContact CG-CD2 4.21Å; R670-L728 VanDerWaalsContact CA-CD2 3.44Å; R670-L728 HydrophobicContact CB-CD2 3.7Å; R670-L728 HydrophobicContact CG-CD2 4.33Å; R670-L728 VanDerWaalsContact N-CD2 3.32Å; R670-L728 PolarHBondContact NH2-O 3.07Å; M723-L728 PolarHBondContact O-N 2.9Å; L724-L728 HydrophobicContact CD2-CD1 3.55Å; L724-L728 WeakPolarHBondContact O-CB 3.11Å; L724-L728 PolarHBondContact O-N 2.83Å; L728-L730 VanDerWaalsContact C-N 3.29Å; L728-L730 HydrophobicContact CB-CD1 3.69Å; L728-L730 HydrophobicContact CB-CG 4.15Å; L728-L730 HydrophobicContact CD1-CD1 4.5Å
729	K	87.4	Confident	87.9	Confident	161 Å²	161	40.2 Å²	40.2	70%	0.7	20%	0.195	S	C	*	.			trans	62.4	32.5	-177.3	-55.3	179.2	-178	174.2	0	113.1	L724 K725	L724-K729 PolarHBondContact O-N 3.23Å; K725-K729 VanDerWaalsContact O-CA 3.23Å; K725-K729 WeakPolarHBondContact O-CA 3.46Å; K725-K729 PolarHBondContact O-N 3.33Å
730	L	88.3	Confident	87.8	Confident	25 Å²	25	44.2 Å²	44.2	13%	0.131	21%	0.214	C	C	.	.			trans	-69.3	144.5	175.6	-75.3	146.9	0	0	0	110.7	V673 L724 L728 E734	V673-L730 HydrophobicContact CG1-CD1 4.03Å; V673-L730 HydrophobicContact CG1-CD2 4.05Å; L724-L730 HydrophobicContact CB-CD1 3.68Å; L724-L730 HydrophobicContact CD1-CD1 4.42Å; L724-L730 HydrophobicContact CD2-CD1 4Å; L724-L730 HydrophobicContact CG-CD1 4.23Å; L724-L730 PolarHBondContact O-N 2.81Å; L728-L730 VanDerWaalsContact C-N 3.29Å; L728-L730 HydrophobicContact CB-CD1 3.69Å; L728-L730 HydrophobicContact CB-CG 4.15Å; L728-L730 HydrophobicContact CD1-CD1 4.5Å; L730-E734 HydrophobicContact CD2-CB 3.75Å; L730-E734 HydrophobicContact CD2-CG 4.44Å
731	N	88.1	Confident	87.4	Confident	76 Å²	76	44.2 Å²	44.2	41%	0.406	21%	0.214	S	C	.	.			trans	-79.2	164.1	173.8	72.4	47.8	0	0	0	111.2	S733 E734 M735	N731-S733 PolarHBondContact O-N 3.49Å; N731-S733 WeakPolarHBondContact OD1-CA 3.44Å; N731-S733 WeakPolarHBondContact OD1-CB 3.4Å; N731-S733 PolarHBondContact OD1-N 3.4Å; N731-S733 PolarHBondContact OD1-OG 3.15Å; N731-E734 PolarHBondContact N-OE2 2.88Å; N731-E734 PolarHBondContact ND2-OE2 2.82Å; N731-E734 VanDerWaalsContact ND2-OE2 3.1Å; N731-E734 PolarHBondContact O-N 2.9Å; N731-E734 WeakPolarHBondContact OD1-CG 3.36Å; N731-E734 PolarHBondContact OD1-N 3.41Å; N731-M735 PolarHBondContact O-N 2.86Å
732	N	85.7	Confident	87.2	Confident	95 Å²	95	44 Å²	44	51%	0.508	21%	0.213	S	C	.	.	H	α-helix	trans	-58.9	-34.6	-177.4	-75.2	-2.8	0	0	0	112.8	I736	N732-I736 WeakPolarHBondContact O-CD1 3.17Å; N732-I736 WeakPolarHBondContact O-CG1 3.29Å; N732-I736 PolarHBondContact O-N 3.36Å
733	S	86.7	Confident	87	Confident	57 Å²	57	47 Å²	47	40%	0.399	23%	0.228	S	C	.	.	H	α-helix	trans	-72	-39.4	-178.7	76.1	0	0	0	0	112.6	N731 I736 R737	N731-S733 PolarHBondContact O-N 3.49Å; N731-S733 WeakPolarHBondContact OD1-CA 3.44Å; N731-S733 WeakPolarHBondContact OD1-CB 3.4Å; N731-S733 PolarHBondContact OD1-N 3.4Å; N731-S733 PolarHBondContact OD1-OG 3.15Å; S733-I736 PolarHBondContact O-N 2.88Å; S733-R737 VanDerWaalsContact O-CG 3.3Å; S733-R737 WeakPolarHBondContact O-CG 3.25Å; S733-R737 PolarHBondContact O-N 2.88Å; S733-R737 VanDerWaalsContact O-N 3.07Å
734	E	86.2	Confident	86.5	Confident	59 Å²	59	49 Å²	49	28%	0.276	24%	0.238	S	C	.	.	H	α-helix	trans	-65.8	-44.9	176.1	-70.9	168.6	147.9	0	0	110.6	L730 N731 I736 R737 V738	L730-E734 HydrophobicContact CD2-CB 3.75Å; L730-E734 HydrophobicContact CD2-CG 4.44Å; N731-E734 PolarHBondContact N-OE2 2.88Å; N731-E734 PolarHBondContact ND2-OE2 2.82Å; N731-E734 VanDerWaalsContact ND2-OE2 3.1Å; N731-E734 PolarHBondContact O-N 2.9Å; N731-E734 WeakPolarHBondContact OD1-CG 3.36Å; N731-E734 PolarHBondContact OD1-N 3.41Å; E734-I736 PolarHBondContact O-N 3.27Å; E734-R737 PolarHBondContact O-N 3.21Å; E734-V738 VanDerWaalsContact O-CG2 3.24Å; E734-V738 WeakPolarHBondContact O-CG2 3.06Å; E734-V738 PolarHBondContact O-N 2.91Å
735	M	87.4	Confident	85.9	Confident	13 Å²	13	49.3 Å²	49.3	6%	0.064	24%	0.24	C	C	.	.	H	α-helix	trans	-60.1	-45.9	176.7	-179.1	178.1	59.2	0	0	112	K725 N731 R737 V738 N739	K725-M735 HydrophobicContact CB-SD 4.3Å; N731-M735 PolarHBondContact O-N 2.86Å; M735-R737 VanDerWaalsContact C-N 3.34Å; M735-R737 PolarHBondContact O-N 3.18Å; M735-V738 PolarHBondContact O-N 3.25Å; M735-N739 PolarHBondContact O-N 2.98Å; M735-N739 PolarHBondContact O-ND2 2.73Å
736	I	85.3	Confident	85.3	Confident	98 Å²	98	47.3 Å²	47.3	50%	0.503	23%	0.232	S	C	.	.	H	α-helix	trans	-61.2	-42.8	176.8	-70.1	165.4	0	0	0	111	N732 S733 E734 H740	N732-I736 WeakPolarHBondContact O-CD1 3.17Å; N732-I736 WeakPolarHBondContact O-CG1 3.29Å; N732-I736 PolarHBondContact O-N 3.36Å; S733-I736 PolarHBondContact O-N 2.88Å; E734-I736 PolarHBondContact O-N 3.27Å; I736-H740 VanDerWaalsContact O-CB 3.27Å; I736-H740 WeakPolarHBondContact O-CB 3.11Å; I736-H740 PolarHBondContact O-N 3.42Å
737	R	86.5	Confident	84.7	Confident	106 Å²	106	47.3 Å²	47.3	40%	0.4	24%	0.235	S	C	.	.	H	α-helix	trans	-62.2	-44.3	177.8	-73.2	173.5	-167.4	176.3	5.3	112.2	Y680 S733 E734 M735 H740 A741	Y680-R737 HydrophobicContact CD1-CB 4.26Å; Y680-R737 HydrophobicContact CD1-CG 4.31Å; Y680-R737 HydrophobicContact CE1-CB 4.33Å; Y680-R737 HydrophobicContact CE1-CG 4.09Å; S733-R737 VanDerWaalsContact O-CG 3.3Å; S733-R737 WeakPolarHBondContact O-CG 3.25Å; S733-R737 PolarHBondContact O-N 2.88Å; S733-R737 VanDerWaalsContact O-N 3.07Å; E734-R737 PolarHBondContact O-N 3.21Å; M735-R737 VanDerWaalsContact C-N 3.34Å; M735-R737 PolarHBondContact O-N 3.18Å; R737-H740 PolarHBondContact O-N 2.64Å; R737-A741 WeakPolarHBondContact O-CB 3.27Å; R737-A741 PolarHBondContact O-N 3.45Å
738	V	86.8	Confident	84	Confident	1 Å²	1	53 Å²	53	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-64.5	-47.2	-179.8	172.9	0	0	0	0	110.9	V673 L724 E734 M735 H740 A741 L742	V673-V738 HydrophobicContact CG1-CG1 4.46Å; V673-V738 HydrophobicContact CG1-CG2 3.65Å; L724-V738 HydrophobicContact CD1-CG1 4.24Å; E734-V738 VanDerWaalsContact O-CG2 3.24Å; E734-V738 WeakPolarHBondContact O-CG2 3.06Å; E734-V738 PolarHBondContact O-N 2.91Å; M735-V738 PolarHBondContact O-N 3.25Å; V738-H740 PolarHBondContact O-N 3.39Å; V738-A741 WeakPolarHBondContact O-CB 2.89Å; V738-A741 PolarHBondContact O-N 3.48Å; V738-L742 HydrophobicContact CG1-CD1 4.03Å; V738-L742 WeakPolarHBondContact O-CG 3.41Å; V738-L742 PolarHBondContact O-N 3.04Å
739	N	87.2	Confident	83	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.123	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-44.7	176.5	-76.4	-41.1	0	0	0	111.9	S721 M735 A741 L742 D743	S721-N739 PolarHBondContact OG-ND2 2.78Å; M735-N739 PolarHBondContact O-N 2.98Å; M735-N739 PolarHBondContact O-ND2 2.73Å; N739-A741 VanDerWaalsContact C-N 3.32Å; N739-A741 PolarHBondContact O-N 3.4Å; N739-L742 PolarHBondContact O-N 3.43Å; N739-D743 WeakPolarHBondContact O-CB 3.37Å; N739-D743 PolarHBondContact O-N 2.96Å
740	H	86	Confident	82	Confident	85 Å²	85	47.7 Å²	47.7	39%	0.394	24%	0.242	S	C	.	.	H	α-helix	trans	-61.8	-40.1	177.1	-172.4	-104.9	0	0	0	112.2	Y680 I736 R737 V738 L742 D743 M744	Y680-H740 AromaticContact CE2-ND1 3.37Å; Y680-H740 WeakPolarHBondContact CE2-ND1 3.4Å; Y680-H740 AromaticContact CZ-ND1 3.52Å; Y680-H740 PolarHBondContact OH-CE1 2.76Å; Y680-H740 PolarHBondContact OH-ND1 2.76Å; I736-H740 VanDerWaalsContact O-CB 3.27Å; I736-H740 WeakPolarHBondContact O-CB 3.11Å; I736-H740 PolarHBondContact O-N 3.42Å; R737-H740 PolarHBondContact O-N 2.64Å; V738-H740 PolarHBondContact O-N 3.39Å; H740-L742 VanDerWaalsContact C-N 3.34Å; H740-L742 PolarHBondContact O-N 2.67Å; H740-D743 PolarHBondContact O-N 3.24Å; H740-M744 PolarHBondContact CE1-SD 2.86Å; H740-M744 WeakPolarHBondContact O-CB 3.43Å; H740-M744 WeakPolarHBondContact O-CG 3.47Å; H740-M744 PolarHBondContact O-N 3.4Å
741	A	84.8	Confident	80.8	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-42.8	175.1	0	0	0	0	0	112.3	V676 Y680 M693 R737 V738 N739 Y745	V676-A741 HydrophobicContact CG1-CB 3.73Å; Y680-A741 HydrophobicContact CD2-CB 3.51Å; Y680-A741 HydrophobicContact CE2-CB 4.26Å; Y680-A741 HydrophobicContact CG-CB 4.21Å; M693-A741 HydrophobicContact CE-CB 4.15Å; R737-A741 WeakPolarHBondContact O-CB 3.27Å; R737-A741 PolarHBondContact O-N 3.45Å; V738-A741 WeakPolarHBondContact O-CB 2.89Å; V738-A741 PolarHBondContact O-N 3.48Å; N739-A741 VanDerWaalsContact C-N 3.32Å; N739-A741 PolarHBondContact O-N 3.4Å; A741-Y745 WeakPolarHBondContact O-CB 3.38Å; A741-Y745 PolarHBondContact O-N 2.95Å; A741-Y745 VanDerWaalsContact O-N 3.08Å
742	L	84.7	Confident	79.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-40.4	177.9	-69.6	166.8	0	0	0	111.6	M693 L696 L697 F720 V738 N739 H740 Y745 S746	M693-L742 HydrophobicContact CG-CD2 4.13Å; M693-L742 HydrophobicContact SD-CD2 3.41Å; M693-L742 WeakPolarHBondContact SD-CD2 3.47Å; M693-L742 HydrophobicContact SD-CG 4.1Å; L696-L742 HydrophobicContact CB-CD2 3.81Å; L697-L742 HydrophobicContact CD2-CB 3.85Å; L697-L742 HydrophobicContact CD2-CD2 3.85Å; L697-L742 HydrophobicContact CD2-CG 4.4Å; L697-L742 HydrophobicContact CG-CD2 3.77Å; F720-L742 HydrophobicContact CE1-CD1 3.98Å; F720-L742 HydrophobicContact CZ-CD1 4.41Å; V738-L742 HydrophobicContact CG1-CD1 4.03Å; V738-L742 WeakPolarHBondContact O-CG 3.41Å; V738-L742 PolarHBondContact O-N 3.04Å; N739-L742 PolarHBondContact O-N 3.43Å; H740-L742 VanDerWaalsContact C-N 3.34Å; H740-L742 PolarHBondContact O-N 2.67Å; L742-Y745 PolarHBondContact O-N 3.36Å; L742-S746 WeakPolarHBondContact O-CB 3.44Å; L742-S746 PolarHBondContact O-N 3.35Å
743	D	84.4	Confident	78.3	Confident	62 Å²	62	53 Å²	53	33%	0.332	27%	0.269	S	S	.	.	H	α-helix	trans	-68.7	-44	179.1	-65.8	-20.4	0	0	0	111.7	R700 N739 H740 Y745 S746 T747	R700-D743 IonicContact CZ-OD1 3.92Å; R700-D743 IonicContact NH1-OD1 3.88Å; R700-D743 PolarHBondContact NH1-OD1 3.28Å; R700-D743 IonicContact NH2-OD1 3.6Å; R700-D743 PolarHBondContact NH2-OD1 3.15Å; N739-D743 WeakPolarHBondContact O-CB 3.37Å; N739-D743 PolarHBondContact O-N 2.96Å; H740-D743 PolarHBondContact O-N 3.24Å; D743-Y745 VanDerWaalsContact C-N 3.31Å; D743-Y745 PolarHBondContact O-N 3.17Å; D743-S746 PolarHBondContact O-N 2.91Å; D743-T747 WeakPolarHBondContact O-CB 3.28Å; D743-T747 WeakPolarHBondContact O-CG2 3.46Å; D743-T747 PolarHBondContact O-N 2.91Å; D743-T747 PolarHBondContact O-OG1 3.22Å
744	M	79.4	Confident	76.9	Confident	42 Å²	42	55 Å²	55	21%	0.207	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-42	172.1	-71.7	-164.4	-42.1	0	0	111.4	Y680 F686 H740 S746 T747 E748	Y680-M744 HydrophobicContact CD2-CE 4.11Å; Y680-M744 HydrophobicContact CE2-CE 3.63Å; F686-M744 HydrophobicContact CE1-CE 3.93Å; F686-M744 HydrophobicContact CE2-CE 4.41Å; F686-M744 HydrophobicContact CZ-CE 3.51Å; H740-M744 PolarHBondContact CE1-SD 2.86Å; H740-M744 WeakPolarHBondContact O-CB 3.43Å; H740-M744 WeakPolarHBondContact O-CG 3.47Å; H740-M744 PolarHBondContact O-N 3.4Å; M744-S746 PolarHBondContact O-N 2.96Å; M744-T747 WeakPolarHBondContact CA-OG1 3.3Å; M744-T747 PolarHBondContact O-N 2.66Å; M744-T747 PolarHBondContact O-OG1 2.82Å; M744-E748 VanDerWaalsContact O-CB 3.23Å; M744-E748 WeakPolarHBondContact O-CB 3.32Å; M744-E748 WeakPolarHBondContact O-CG 3.47Å; M744-E748 PolarHBondContact O-N 3.37Å
745	Y	78.3	Confident	75.7	Confident	7 Å²	7	59.6 Å²	59.6	3%	0.027	30%	0.296	C	S	.	.	I	π-helix	trans	-64.4	-41	177.5	-168.7	-89.8	0	0	0	112.2	S690 M693 L694 L697 A741 L742 D743 I749 L750	S690-Y745 WeakPolarHBondContact CB-OH 3.37Å; M693-Y745 HydrophobicContact CB-CD1 4.31Å; M693-Y745 HydrophobicContact CB-CD2 4.16Å; M693-Y745 HydrophobicContact CB-CE1 4.27Å; M693-Y745 HydrophobicContact CB-CE2 4.11Å; M693-Y745 HydrophobicContact CB-CG 4.26Å; M693-Y745 HydrophobicContact CE-CD2 4.24Å; M693-Y745 HydrophobicContact CE-CG 4.44Å; M693-Y745 HydrophobicContact CG-CD1 3.61Å; M693-Y745 HydrophobicContact CG-CD2 3.6Å; M693-Y745 HydrophobicContact CG-CE1 4.06Å; M693-Y745 HydrophobicContact CG-CE2 4.05Å; M693-Y745 HydrophobicContact CG-CG 3.35Å; L694-Y745 HydrophobicContact CD2-CE1 4.02Å; L694-Y745 HydrophobicContact CG-CE1 4.18Å; L697-Y745 HydrophobicContact CD1-CD1 3.69Å; L697-Y745 HydrophobicContact CD1-CE1 4.28Å; A741-Y745 WeakPolarHBondContact O-CB 3.38Å; A741-Y745 PolarHBondContact O-N 2.95Å; A741-Y745 VanDerWaalsContact O-N 3.08Å; L742-Y745 PolarHBondContact O-N 3.36Å; D743-Y745 VanDerWaalsContact C-N 3.31Å; D743-Y745 PolarHBondContact O-N 3.17Å; Y745-I749 HydrophobicContact CD2-CB 4.38Å; Y745-I749 HydrophobicContact CD2-CD1 3.63Å; Y745-I749 HydrophobicContact CD2-CG1 4.25Å; Y745-I749 HydrophobicContact CE2-CB 4.42Å; Y745-I749 HydrophobicContact CE2-CD1 3.65Å; Y745-I749 HydrophobicContact CE2-CG1 4.48Å; Y745-I749 HydrophobicContact CE2-CG2 4.32Å; Y745-I749 HydrophobicContact CG-CB 4.49Å; Y745-I749 HydrophobicContact CG-CD1 4.48Å; Y745-I749 VanDerWaalsContact O-CB 3.31Å; Y745-I749 WeakPolarHBondContact O-CB 3.26Å; Y745-I749 PolarHBondContact O-N 3.47Å; Y745-I749 VanDerWaalsContact O-N 3.15Å; Y745-L750 HydrophobicContact CD1-CD1 4.1Å; Y745-L750 HydrophobicContact CD1-CG 4.17Å; Y745-L750 HydrophobicContact CE1-CD1 4.03Å; Y745-L750 HydrophobicContact CE1-CD2 4.34Å; Y745-L750 HydrophobicContact CE1-CG 3.99Å; Y745-L750 PolarHBondContact O-N 3.3Å; Y745-L750 VanDerWaalsContact O-N 3.09Å
746	S	76.6	Confident	74.7	Confident	10 Å²	10	65.9 Å²	65.9	7%	0.07	33%	0.329	C	S	.	.	I	π-helix	trans	-63.3	-44	176.7	-175.3	0	0	0	0	112.6	L742 D743 M744 L750 K751 Q752	L742-S746 WeakPolarHBondContact O-CB 3.44Å; L742-S746 PolarHBondContact O-N 3.35Å; D743-S746 PolarHBondContact O-N 2.91Å; M744-S746 PolarHBondContact O-N 2.96Å; S746-L750 CarbonylContact O-C 3.57Å; S746-L750 WeakPolarHBondContact O-CB 3.03Å; S746-K751 PolarHBondContact O-N 3.37Å; S746-Q752 PolarHBondContact O-N 3.26Å
747	T	74.7	Confident	74.3	Confident	49 Å²	49	64 Å²	64	30%	0.301	32%	0.323	S	S	.	.	I	π-helix	trans	-82.3	-46.5	-175.4	51.7	0	0	0	0	113.1	D743 M744 K751 D754	D743-T747 WeakPolarHBondContact O-CB 3.28Å; D743-T747 WeakPolarHBondContact O-CG2 3.46Å; D743-T747 PolarHBondContact O-N 2.91Å; D743-T747 PolarHBondContact O-OG1 3.22Å; M744-T747 WeakPolarHBondContact CA-OG1 3.3Å; M744-T747 PolarHBondContact O-N 2.66Å; M744-T747 PolarHBondContact O-OG1 2.82Å; T747-K751 WeakPolarHBondContact O-CA 3.11Å; T747-D754 WeakPolarHBondContact CG2-OD1 3.37Å
748	E	71.1	Confident	74.1	Confident	138 Å²	138	60.4 Å²	60.4	65%	0.645	32%	0.315	S	S	*	.	I	π-helix	trans	-83.1	-36.3	-174.3	-60.1	-172.6	158.6	0	0	112.6	M744	M744-E748 VanDerWaalsContact O-CB 3.23Å; M744-E748 WeakPolarHBondContact O-CB 3.32Å; M744-E748 WeakPolarHBondContact O-CG 3.47Å; M744-E748 PolarHBondContact O-N 3.37Å
749	I	68.1	Low	73.8	Confident	44 Å²	44	68.4 Å²	68.4	23%	0.226	35%	0.35	C	S	.	.	I	π-helix	trans	-100	-53.1	-174.5	-55.3	-163.6	0	0	0	111.4	K452 Y745	K452-I749 HydrophobicContact CB-CG2 4.28Å; Y745-I749 HydrophobicContact CD2-CB 4.38Å; Y745-I749 HydrophobicContact CD2-CD1 3.63Å; Y745-I749 HydrophobicContact CD2-CG1 4.25Å; Y745-I749 HydrophobicContact CE2-CB 4.42Å; Y745-I749 HydrophobicContact CE2-CD1 3.65Å; Y745-I749 HydrophobicContact CE2-CG1 4.48Å; Y745-I749 HydrophobicContact CE2-CG2 4.32Å; Y745-I749 HydrophobicContact CG-CB 4.49Å; Y745-I749 HydrophobicContact CG-CD1 4.48Å; Y745-I749 VanDerWaalsContact O-CB 3.31Å; Y745-I749 WeakPolarHBondContact O-CB 3.26Å; Y745-I749 PolarHBondContact O-N 3.47Å; Y745-I749 VanDerWaalsContact O-N 3.15Å
750	L	65.4	Low	73.5	Confident	11 Å²	11	68.5 Å²	68.5	6%	0.058	35%	0.35	C	S	.	.	S	Bend	trans	-82.7	-16.5	-178.8	-60.1	177.9	0	0	0	113.2	Y454 L694 L697 Y745 S746 Q752	Y454-L750 PolarHBondContact OH-O 3.34Å; L694-L750 HydrophobicContact CD2-CD1 3.89Å; L694-L750 HydrophobicContact CD2-CD2 4.2Å; L697-L750 HydrophobicContact CD1-CD1 3.9Å; Y745-L750 HydrophobicContact CD1-CD1 4.1Å; Y745-L750 HydrophobicContact CD1-CG 4.17Å; Y745-L750 HydrophobicContact CE1-CD1 4.03Å; Y745-L750 HydrophobicContact CE1-CD2 4.34Å; Y745-L750 HydrophobicContact CE1-CG 3.99Å; Y745-L750 PolarHBondContact O-N 3.3Å; Y745-L750 VanDerWaalsContact O-N 3.09Å; S746-L750 CarbonylContact O-C 3.57Å; S746-L750 WeakPolarHBondContact O-CB 3.03Å; L750-Q752 HydrophobicContact CB-CG 4.07Å; L750-Q752 PolarHBondContact O-N 3.33Å
751	K	63.9	Low	73	Confident	113 Å²	113	65.8 Å²	65.8	49%	0.491	34%	0.341	S	S	.	.			trans	51.6	37.4	-177.6	-67.7	-178.1	177.9	-174.5	0	112.6	N433 S746 T747	N433-K751 WeakPolarHBondContact OD1-CB 3.05Å; N433-K751 VanDerWaalsContact OD1-CD 3.29Å; N433-K751 WeakPolarHBondContact OD1-CD 3.45Å; S746-K751 PolarHBondContact O-N 3.37Å; T747-K751 WeakPolarHBondContact O-CA 3.11Å
752	Q	64.8	Low	72.4	Confident	104 Å²	104	69.1 Å²	69.1	49%	0.486	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-85.1	150.8	173.7	-70	-179.3	-7.5	0	0	110.1	S746 L750	S746-Q752 PolarHBondContact O-N 3.26Å; L750-Q752 HydrophobicContact CB-CG 4.07Å; L750-Q752 PolarHBondContact O-N 3.33Å
753	S	56.6	Low	71.8	Confident	91 Å²	91	72.7 Å²	72.7	64%	0.636	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-66.5	136.2	175.9	53.3	0	0	0	0	110.9	H755	S753-H755 PolarHBondContact O-N 3.45Å
754	D	56.7	Low	71.1	Confident	100 Å²	100	73.3 Å²	73.3	54%	0.535	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-59.4	118.7	175.2	-83.6	-30.8	0	0	0	111.6	T747 L756	T747-D754 WeakPolarHBondContact CG2-OD1 3.37Å; D754-L756 PolarHBondContact O-N 3.18Å
755	H	61	Low	70.6	Confident	155 Å²	155	75.2 Å²	75.2	72%	0.718	39%	0.389	S	S	*	.			trans	-81.8	98.7	165.8	-72.9	-60.4	0	0	0	108.8	S753 T757	S753-H755 PolarHBondContact O-N 3.45Å; H755-T757 PolarHBondContact O-N 3.04Å; H755-T757 VanDerWaalsContact O-N 3.16Å
756	L	67.1	Low	70.1	Confident	145 Å²	145	79.4 Å²	79.4	76%	0.759	41%	0.412	S	S	*	.			trans	-61.1	117.8	172	-70.7	167	0	0	0	109.3	P715 D754	P715-L756 WeakPolarHBondContact CA-O 3.43Å; P715-L756 HydrophobicContact CB-CB 4.23Å; P715-L756 WeakPolarHBondContact CB-O 3.44Å; D754-L756 PolarHBondContact O-N 3.18Å
757	T	76.6	Confident	69.7	Low	59 Å²	59	84.1 Å²	84.1	36%	0.362	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	149.7	173.3	56.8	0	0	0	0	110.8	Q716 H755	Q716-T757 CarbonylContact O-C 3.56Å; Q716-T757 WeakPolarHBondContact O-CA 3.4Å; Q716-T757 WeakPolarHBondContact O-CB 3.47Å; H755-T757 PolarHBondContact O-N 3.04Å; H755-T757 VanDerWaalsContact O-N 3.16Å
758	A	81.4	Confident	69.3	Low	30 Å²	30	86.6 Å²	86.6	25%	0.248	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	132	175.1	0	0	0	0	0	110.2	P715 Q716 L717 D718 L760	P715-A758 HydrophobicContact CB-CB 4.29Å; P715-A758 HydrophobicContact CG-CB 3.92Å; Q716-A758 PolarHBondContact O-N 3.04Å; L717-A758 WeakPolarHBondContact CA-O 3.37Å; L717-A758 HydrophobicContact CD2-CB 4.15Å; D718-A758 PolarHBondContact N-O 3.05Å; A758-L760 PolarHBondContact O-N 3.42Å
759	K	80.1	Confident	69.2	Low	169 Å²	169	82.6 Å²	82.6	74%	0.735	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.4	123.8	176.4	-66.1	-174.8	-179.6	-178.5	0	110.7
760	L	81.1	Confident	69.3	Low	24 Å²	24	85.8 Å²	85.8	13%	0.126	45%	0.446	C	S	.	.			trans	-96.5	-36.4	169.4	-179.9	66.8	0	0	0	111.1	P566 W575 L717 L719 A758	P566-L760 HydrophobicContact CG-CD2 4.14Å; W575-L760 HydrophobicContact CB-CD1 4.39Å; L717-L760 HydrophobicContact CD1-CD1 4.38Å; L717-L760 HydrophobicContact CD2-CB 4.45Å; L719-L760 HydrophobicContact CD2-CD2 3.71Å; A758-L760 PolarHBondContact O-N 3.42Å
761	C	76.9	Confident	69.7	Low	29 Å²	29	92.6 Å²	92.6	20%	0.196	48%	0.481	C	S	.	.			trans	-127.5	0	171	-41.1	0	0	0	0	108.8	C722 K725	C722-C761 HydrophobicContact CB-CB 3.95Å; C722-C761 WeakPolarHBondContact CB-SG 3.49Å; C722-C761 WeakPolarHBondContact SG-CB 3.43Å; C722-C761 PolarHBondContact SG-N 3.42Å; C722-C761 CovalentContact SG-SG 2.03Å; C722-C761 PolarHBondContact SG-SG 2.73Å; K725-C761 HydrophobicContact CD-CB 3.92Å

Retrieved 761 of 761 residues in 178.2 ms (Link to these results)

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