A0A3Q0KTN7_SCHMA Loading...

Frizzled-4

AlphaFold DB , UniProt , Accession A0A3Q0KTN7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 921 aa.

						>A0A3Q0KTN7_SCHMA|A0A3Q0KTN7
MSGMHLHKKISLFNIINTVTIILTQCCADTDYANHKTQNYFTKSSNLHFYDRIDGDINFNDKYLPWQVITRKLRDAVPIMFPINSKEIEASDHLKSIIESNQNGNIPSEVYSNERVGEQHGEAEEGVDDVSHCVPIHEPVCHGLQYTHTWLPNSVGLTTQEEAAKRMNDYRSLINVGCSQYLKFFLCTIYFPMCTPALNPPAALQPCQNLCRYVQSKCEPIMKSFSFPWPIELNCKSLPSESGMCIQPQNYDLDKQGEIISQGIPSEAHGAIANLLPDFGEFLAHQSAQNQQLTNQTDNSHGKISLIDNNQSGLMKHHILHRSKLQASKCYVVEILLYSEQAHDNITCARRCNAHLFYKPIEKRFANIWMLVWAILCLASCAMTMITFILSRSRFAYPERPIIYISVCYFFYSTGFILHALIGRDSVACRNKVETISSSLLPSGVSQEGAKKLLTSVAQSKVNVTFLITSGHEGTWCTIVFLILFYFSQASYLWWVMLAISWFLSASCKWGCEGIEAISSILHMLAWAVPALKTIIILIMHRIDADELTGLCNVGYQNSTSLLAFILLPQVIYLLLGILFLLVGFHSLISLRSNLKQHVKSLLPVANTTTGLANCYNSQFKRNVSATLATSTTPIQPTTLTSPVIPLNNGNIRRLDKLMIKIAVFSMLYVVPKACVISVNIYNYINYPKWMKTLDKLAKQTNCLTEYGTNWSLVTQCLSDNQFPSVEANMLQIFMSLVVGITSGMWVWCNRKSSETWIKCMTGKRKDLSKNGLNYRHHNCEDAVADVAAGNNNNLSQVDQKAQSMNSMCCNSRGGCAVNSQHPGNSINFDNSMNNTSHLVVDSSQYHQHGIARNNVRNLMPSGSLNLSSGAASCTSAVPLSYGLGTMDMSLFNSNESNYCIRSSQRQTVKIRPTNIGRPDF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	41.7	Very low	248 Å²	248	145.5 Å²	145.5	100%	1.222	77%	0.768	S	S	*	*				0	89.8	0	-78.6	165.2	67.9	0	0	108.9
2	S	31.7	Very low	42.6	Very low	136 Å²	136	140.9 Å²	140.9	95%	0.951	74%	0.743	S	S	*	*			trans	168.5	92	164.2	-114.4	0	0	0	0	104.6
3	G	35.1	Very low	43.9	Very low	78 Å²	78	140 Å²	140	80%	0.804	73%	0.73	S	S	*	*			trans	163	39.1	-175.3	0	0	0	0	0	117.6
4	M	40.4	Very low	44.9	Very low	176 Å²	176	136 Å²	136	87%	0.867	71%	0.71	S	S	*	*			trans	-136.2	9.3	179.7	-95.4	178.9	67	0	0	116.3
5	H	41.5	Very low	45.7	Very low	144 Å²	144	131.1 Å²	131.1	67%	0.667	68%	0.684	S	S	*	*	S	Bend	trans	-98	3	-178.8	-120.2	-77.3	0	0	0	116.3	R813	H5-R813 PolarHBondContact CD2-NH2 3.45Å; H5-R813 VanDerWaalsContact CE1-CZ 3.5Å; H5-R813 PolarHBondContact CE1-NH1 3.46Å; H5-R813 PolarHBondContact CE1-NH2 3.39Å; H5-R813 VanDerWaalsContact CE1-NH2 3.35Å; H5-R813 PolarHBondContact NE2-NH1 3.2Å; H5-R813 VanDerWaalsContact NE2-NH1 3.15Å; H5-R813 PolarHBondContact NE2-NH2 2.82Å
6	L	38.4	Very low	47.1	Very low	149 Å²	149	128.7 Å²	128.7	78%	0.78	67%	0.671	S	S	*	*	S	Bend	trans	-103.5	-2.7	-179.2	-144.2	73.3	0	0	0	114.5
7	H	41.3	Very low	48	Very low	148 Å²	148	124.4 Å²	124.4	69%	0.685	65%	0.648	S	S	*	*	S	Bend	trans	-92.8	-1.9	-166.6	-137.9	-87	0	0	0	116.2
8	K	44.8	Very low	48.8	Very low	204 Å²	204	121.8 Å²	121.8	89%	0.887	64%	0.639	S	S	*	*	S	Bend	trans	-91.3	-23.4	179.4	-84.9	-173.5	175.9	-176.5	0	115.2
9	K	44.4	Very low	49.3	Very low	191 Å²	191	117.7 Å²	117.7	83%	0.83	62%	0.62	S	S	*	*	S	Bend	trans	-80.3	-20.8	174.6	-80.9	-172.4	174.7	-175.1	0	113.4	S11	K9-S11 VanDerWaalsContact C-N 3.34Å; K9-S11 PolarHBondContact O-N 2.73Å
10	I	43.9	Very low	50	Low	71 Å²	71	115.3 Å²	115.3	36%	0.364	61%	0.61	S	S	.	*	H	α-helix	trans	-72.7	-23.6	-175.2	-67.4	170.7	0	0	0	112.6	N14	I10-N14 WeakPolarHBondContact CG2-ND2 3.2Å; I10-N14 WeakPolarHBondContact O-CB 3.2Å; I10-N14 PolarHBondContact O-N 3.44Å; I10-N14 VanDerWaalsContact O-N 3.13Å; I10-N14 PolarHBondContact O-ND2 2.92Å
11	S	58.2	Low	50.8	Low	56 Å²	56	114.4 Å²	114.4	39%	0.392	60%	0.604	S	S	.	*	H	α-helix	trans	-73.2	-37.4	-178.6	-168.8	0	0	0	0	113.9	K9 I15	K9-S11 VanDerWaalsContact C-N 3.34Å; K9-S11 PolarHBondContact O-N 2.73Å; S11-I15 WeakPolarHBondContact O-CD1 3.2Å; S11-I15 WeakPolarHBondContact O-CG1 3.48Å; S11-I15 PolarHBondContact O-N 2.02Å
12	L	52.1	Low	51.7	Low	90 Å²	90	105.5 Å²	105.5	47%	0.471	56%	0.561	S	S	.	*	H	α-helix	trans	-72.9	-40.7	-178	-160.1	81.4	0	0	0	111	I15 I16	L12-I15 PolarHBondContact O-N 3.21Å; L12-I16 HydrophobicContact CD2-CD1 4.46Å; L12-I16 HydrophobicContact CG-CD1 4.3Å; L12-I16 VanDerWaalsContact O-CG1 3.32Å; L12-I16 WeakPolarHBondContact O-CG1 3.35Å; L12-I16 PolarHBondContact O-N 3.31Å
13	F	59.9	Low	52.6	Low	129 Å²	129	102.8 Å²	102.8	57%	0.566	54%	0.536	S	S	*	.	H	α-helix	trans	-63.2	-41.6	174.9	-170.7	-107	0	0	0	111.5	I15 I16 N17	F13-I15 PolarHBondContact O-N 3.36Å; F13-I16 PolarHBondContact O-N 3.06Å; F13-N17 VanDerWaalsContact CD1-ND2 3.3Å; F13-N17 WeakPolarHBondContact CD1-ND2 3.14Å; F13-N17 WeakPolarHBondContact CE1-ND2 2.93Å; F13-N17 WeakPolarHBondContact CZ-ND2 3.5Å; F13-N17 VanDerWaalsContact O-CB 3.31Å; F13-N17 WeakPolarHBondContact O-CB 3.43Å; F13-N17 VanDerWaalsContact O-CG 3.29Å; F13-N17 PolarHBondContact O-N 2.9Å
14	N	57.7	Low	53.4	Low	84 Å²	84	103.2 Å²	103.2	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-37.3	174.8	-73.7	-10.3	0	0	0	112.5	I10 T18	I10-N14 WeakPolarHBondContact CG2-ND2 3.2Å; I10-N14 WeakPolarHBondContact O-CB 3.2Å; I10-N14 PolarHBondContact O-N 3.44Å; I10-N14 VanDerWaalsContact O-N 3.13Å; I10-N14 PolarHBondContact O-ND2 2.92Å; N14-T18 VanDerWaalsContact O-CB 3.26Å; N14-T18 WeakPolarHBondContact O-CB 3.45Å; N14-T18 PolarHBondContact O-N 2.93Å; N14-T18 PolarHBondContact O-OG1 2.97Å
15	I	57.5	Low	53.8	Low	63 Å²	63	100.3 Å²	100.3	32%	0.323	51%	0.507	S	S	.	.	H	α-helix	trans	-66.1	-47	175.2	-69.1	162.9	0	0	0	110.4	S11 L12 F13 T18 V19	S11-I15 WeakPolarHBondContact O-CD1 3.2Å; S11-I15 WeakPolarHBondContact O-CG1 3.48Å; S11-I15 PolarHBondContact O-N 2.02Å; L12-I15 PolarHBondContact O-N 3.21Å; F13-I15 PolarHBondContact O-N 3.36Å; I15-T18 PolarHBondContact O-N 3.04Å; I15-V19 HydrophobicContact CG2-CG2 4.49Å; I15-V19 VanDerWaalsContact O-CG2 3.31Å; I15-V19 WeakPolarHBondContact O-CG2 3.07Å; I15-V19 PolarHBondContact O-N 3.38Å
16	I	66.6	Low	53.6	Low	92 Å²	92	97.3 Å²	97.3	47%	0.472	50%	0.501	S	S	.	.	H	α-helix	trans	-59.9	-49	176.8	-67.6	166.6	0	0	0	109.8	L12 F13 T18 V19 T20	L12-I16 HydrophobicContact CD2-CD1 4.46Å; L12-I16 HydrophobicContact CG-CD1 4.3Å; L12-I16 VanDerWaalsContact O-CG1 3.32Å; L12-I16 WeakPolarHBondContact O-CG1 3.35Å; L12-I16 PolarHBondContact O-N 3.31Å; F13-I16 PolarHBondContact O-N 3.06Å; I16-T18 VanDerWaalsContact C-N 3.33Å; I16-T18 PolarHBondContact O-N 3.29Å; I16-V19 PolarHBondContact O-N 3.06Å; I16-T20 WeakPolarHBondContact O-CB 3.39Å; I16-T20 PolarHBondContact O-N 3.33Å; I16-T20 PolarHBondContact O-OG1 3.42Å
17	N	62.5	Low	53.8	Low	55 Å²	55	94.6 Å²	94.6	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-62.8	-38.4	177.8	-74.7	-9.7	0	0	0	112.4	F13 T20 I21	F13-N17 VanDerWaalsContact CD1-ND2 3.3Å; F13-N17 WeakPolarHBondContact CD1-ND2 3.14Å; F13-N17 WeakPolarHBondContact CE1-ND2 2.93Å; F13-N17 WeakPolarHBondContact CZ-ND2 3.5Å; F13-N17 VanDerWaalsContact O-CB 3.31Å; F13-N17 WeakPolarHBondContact O-CB 3.43Å; F13-N17 VanDerWaalsContact O-CG 3.29Å; F13-N17 PolarHBondContact O-N 2.9Å; N17-T20 PolarHBondContact O-N 3.13Å; N17-I21 VanDerWaalsContact O-CB 3.26Å; N17-I21 WeakPolarHBondContact O-CB 2.89Å; N17-I21 WeakPolarHBondContact O-CD1 3.25Å; N17-I21 WeakPolarHBondContact O-CG1 2.93Å; N17-I21 PolarHBondContact O-N 2.73Å
18	T	63.2	Low	53.8	Low	78 Å²	78	91 Å²	91	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-65.9	-42.2	177	-54.9	0	0	0	0	110.5	N14 I15 I16 I21 I22	N14-T18 VanDerWaalsContact O-CB 3.26Å; N14-T18 WeakPolarHBondContact O-CB 3.45Å; N14-T18 PolarHBondContact O-N 2.93Å; N14-T18 PolarHBondContact O-OG1 2.97Å; I15-T18 PolarHBondContact O-N 3.04Å; I16-T18 VanDerWaalsContact C-N 3.33Å; I16-T18 PolarHBondContact O-N 3.29Å; T18-I21 PolarHBondContact O-N 2.76Å; T18-I22 HydrophobicContact CG2-CD1 3.89Å; T18-I22 WeakPolarHBondContact O-CB 3.18Å; T18-I22 WeakPolarHBondContact O-CG1 3.35Å; T18-I22 PolarHBondContact O-N 3Å
19	V	58.1	Low	53.6	Low	45 Å²	45	87.6 Å²	87.6	27%	0.273	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-43.2	175.2	172.2	0	0	0	0	110.8	I15 I16 I22 L23 F580	I15-V19 HydrophobicContact CG2-CG2 4.49Å; I15-V19 VanDerWaalsContact O-CG2 3.31Å; I15-V19 WeakPolarHBondContact O-CG2 3.07Å; I15-V19 PolarHBondContact O-N 3.38Å; I16-V19 PolarHBondContact O-N 3.06Å; V19-I22 PolarHBondContact O-N 3.49Å; V19-L23 HydrophobicContact CG1-CD1 3.82Å; V19-L23 HydrophobicContact CG1-CG 4.41Å; V19-L23 WeakPolarHBondContact O-CB 3.21Å; V19-L23 WeakPolarHBondContact O-CG 3.43Å; V19-L23 PolarHBondContact O-N 2.77Å; V19-F580 HydrophobicContact CG2-CZ 4.18Å
20	T	63.2	Low	53.4	Low	69 Å²	69	83.2 Å²	83.2	42%	0.423	47%	0.471	S	S	.	.	H	α-helix	trans	-63.7	-45.7	176.5	-57.6	0	0	0	0	111.5	I16 N17 L23 T24	I16-T20 WeakPolarHBondContact O-CB 3.39Å; I16-T20 PolarHBondContact O-N 3.33Å; I16-T20 PolarHBondContact O-OG1 3.42Å; N17-T20 PolarHBondContact O-N 3.13Å; T20-L23 PolarHBondContact O-N 3.32Å; T20-T24 PolarHBondContact O-N 2.84Å; T20-T24 PolarHBondContact O-OG1 3.44Å
21	I	67.6	Low	53.1	Low	96 Å²	96	87.1 Å²	87.1	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-61	-46	177.4	-71.4	164.9	0	0	0	110.3	N17 T18 L23 T24 Q25	N17-I21 VanDerWaalsContact O-CB 3.26Å; N17-I21 WeakPolarHBondContact O-CB 2.89Å; N17-I21 WeakPolarHBondContact O-CD1 3.25Å; N17-I21 WeakPolarHBondContact O-CG1 2.93Å; N17-I21 PolarHBondContact O-N 2.73Å; T18-I21 PolarHBondContact O-N 2.76Å; I21-L23 VanDerWaalsContact C-N 3.33Å; I21-L23 PolarHBondContact O-N 3.48Å; I21-T24 WeakPolarHBondContact CA-OG1 3.31Å; I21-T24 PolarHBondContact O-N 3.21Å; I21-T24 PolarHBondContact O-OG1 3.47Å; I21-T24 VanDerWaalsContact O-OG1 3.13Å; I21-Q25 WeakPolarHBondContact O-CB 3.41Å; I21-Q25 PolarHBondContact O-N 2.94Å; I21-Q25 PolarHBondContact O-OE1 3.2Å
22	I	56.8	Low	52	Low	61 Å²	61	95.2 Å²	95.2	31%	0.313	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-40.1	177.2	-67.8	168.5	0	0	0	110.8	T18 V19 Q25 C26 L579	T18-I22 HydrophobicContact CG2-CD1 3.89Å; T18-I22 WeakPolarHBondContact O-CB 3.18Å; T18-I22 WeakPolarHBondContact O-CG1 3.35Å; T18-I22 PolarHBondContact O-N 3Å; V19-I22 PolarHBondContact O-N 3.49Å; I22-Q25 PolarHBondContact O-N 3.22Å; I22-C26 VanDerWaalsContact O-CB 3.32Å; I22-C26 WeakPolarHBondContact O-CB 3.13Å; I22-C26 PolarHBondContact O-N 3.31Å; I22-L579 HydrophobicContact CD1-CD2 4.15Å; I22-L579 HydrophobicContact CG2-CD2 3.86Å
23	L	50.5	Low	51.1	Low	80 Å²	80	94.7 Å²	94.7	42%	0.419	52%	0.524	S	S	.	.	H	α-helix	trans	-66.4	-39.1	175.9	-72.2	169.7	0	0	0	112.1	V19 T20 I21 C27 L576	V19-L23 HydrophobicContact CG1-CD1 3.82Å; V19-L23 HydrophobicContact CG1-CG 4.41Å; V19-L23 WeakPolarHBondContact O-CB 3.21Å; V19-L23 WeakPolarHBondContact O-CG 3.43Å; V19-L23 PolarHBondContact O-N 2.77Å; T20-L23 PolarHBondContact O-N 3.32Å; I21-L23 VanDerWaalsContact C-N 3.33Å; I21-L23 PolarHBondContact O-N 3.48Å; L23-C27 WeakPolarHBondContact O-CB 3.22Å; L23-C27 PolarHBondContact O-N 2.9Å; L23-C27 VanDerWaalsContact O-N 3.11Å; L23-C27 PolarHBondContact O-SG 3.34Å; L23-C27 VanDerWaalsContact O-SG 3.41Å; L23-L576 HydrophobicContact CD2-CD2 4.47Å
24	T	53.6	Low	49.7	Very low	86 Å²	86	96.2 Å²	96.2	53%	0.528	54%	0.538	S	S	.	.	H	α-helix	trans	-73.2	-35.1	175.2	38.9	0	0	0	0	113.1	T20 I21 C27 A28	T20-T24 PolarHBondContact O-N 2.84Å; T20-T24 PolarHBondContact O-OG1 3.44Å; I21-T24 WeakPolarHBondContact CA-OG1 3.31Å; I21-T24 PolarHBondContact O-N 3.21Å; I21-T24 PolarHBondContact O-OG1 3.47Å; I21-T24 VanDerWaalsContact O-OG1 3.13Å; T24-C27 PolarHBondContact O-N 2.81Å; T24-A28 WeakPolarHBondContact O-CB 3.49Å; T24-A28 PolarHBondContact O-N 2.92Å; T24-A28 VanDerWaalsContact O-N 3.1Å
25	Q	47.5	Very low	48.6	Very low	115 Å²	115	101.1 Å²	101.1	54%	0.537	56%	0.558	S	S	.	*	H	α-helix	trans	-67.9	-42.1	174.2	-123.5	92.1	6.9	0	0	111.3	I21 I22 C27 A28 D29	I21-Q25 WeakPolarHBondContact O-CB 3.41Å; I21-Q25 PolarHBondContact O-N 2.94Å; I21-Q25 PolarHBondContact O-OE1 3.2Å; I22-Q25 PolarHBondContact O-N 3.22Å; Q25-C27 VanDerWaalsContact C-N 3.3Å; Q25-C27 PolarHBondContact O-N 2.85Å; Q25-A28 PolarHBondContact O-N 3.18Å; Q25-D29 PolarHBondContact O-N 3.44Å
26	C	38.6	Very low	47.5	Very low	81 Å²	81	107.8 Å²	107.8	55%	0.547	59%	0.585	S	S	.	*	H	α-helix	trans	-67.4	-28	176.5	-81	0	0	0	0	113.3	I22 T30	I22-C26 VanDerWaalsContact O-CB 3.32Å; I22-C26 WeakPolarHBondContact O-CB 3.13Å; I22-C26 PolarHBondContact O-N 3.31Å; C26-T30 PolarHBondContact O-OG1 2.93Å
27	C	42.6	Very low	45.9	Very low	93 Å²	93	110.4 Å²	110.4	63%	0.628	61%	0.605	S	S	*	*	H	α-helix	trans	-78.8	-24.7	173.4	-76.6	0	0	0	0	113.2	L23 T24 Q25 T30	L23-C27 WeakPolarHBondContact O-CB 3.22Å; L23-C27 PolarHBondContact O-N 2.9Å; L23-C27 VanDerWaalsContact O-N 3.11Å; L23-C27 PolarHBondContact O-SG 3.34Å; L23-C27 VanDerWaalsContact O-SG 3.41Å; T24-C27 PolarHBondContact O-N 2.81Å; Q25-C27 VanDerWaalsContact C-N 3.3Å; Q25-C27 PolarHBondContact O-N 2.85Å; C27-T30 PolarHBondContact O-OG1 3.2Å
28	A	41	Very low	44.4	Very low	73 Å²	73	116.6 Å²	116.6	60%	0.603	63%	0.632	S	S	*	*	H	α-helix	trans	-80.5	-26.8	178.5	0	0	0	0	0	113.3	T24 Q25	T24-A28 WeakPolarHBondContact O-CB 3.49Å; T24-A28 PolarHBondContact O-N 2.92Å; T24-A28 VanDerWaalsContact O-N 3.1Å; Q25-A28 PolarHBondContact O-N 3.18Å
29	D	40.7	Very low	42.9	Very low	132 Å²	132	120.2 Å²	120.2	71%	0.706	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-89.1	-5.3	-179.4	-76.9	-28.3	0	0	0	114.6	Q25	Q25-D29 PolarHBondContact O-N 3.44Å
30	T	39.8	Very low	41.5	Very low	98 Å²	98	128.7 Å²	128.7	60%	0.601	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-83.6	-3.7	179.6	31	0	0	0	0	115.8	C26 C27	C26-T30 PolarHBondContact O-OG1 2.93Å; C27-T30 PolarHBondContact O-OG1 3.2Å
31	D	37.9	Very low	40	Very low	154 Å²	154	134.9 Å²	134.9	82%	0.824	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-87.9	4.1	179.4	-88.8	-22.8	0	0	0	114.9
32	Y	34	Very low	38.1	Very low	226 Å²	226	136.9 Å²	136.9	89%	0.886	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-116	8.9	-176.1	-158.1	-104.8	0	0	0	116.1
33	A	33.7	Very low	36.8	Very low	78 Å²	78	144 Å²	144	65%	0.645	75%	0.745	S	S	*	*			trans	-110.6	6.5	-173.6	0	0	0	0	0	116.5	H35	A33-H35 PolarHBondContact O-N 3.41Å
34	N	31.4	Very low	35.9	Very low	161 Å²	161	145.3 Å²	145.3	86%	0.861	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	76.1	179.9	-90.4	-22.6	0	0	0	112.8
35	H	33.3	Very low	34.8	Very low	187 Å²	187	146.5 Å²	146.5	87%	0.866	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.7	13.2	159.6	-135.6	-83.5	0	0	0	118.6	A33	A33-H35 PolarHBondContact O-N 3.41Å
36	K	34.1	Very low	34.1	Very low	204 Å²	204	148.5 Å²	148.5	89%	0.887	79%	0.787	S	S	*	*	S	Bend	trans	-138.8	13.9	-168.9	-123.1	177	-175.2	178.4	0	120.1
37	T	34.1	Very low	33.8	Very low	146 Å²	146	151.6 Å²	151.6	90%	0.896	80%	0.797	S	S	*	*			trans	-130.7	44.7	-172.2	10.4	0	0	0	0	114.4
38	Q	31.7	Very low	33.2	Very low	185 Å²	185	156.1 Å²	156.1	86%	0.864	81%	0.809	S	S	*	*			trans	-117	23.4	-175.3	-149.1	166.4	-0.5	0	0	115.5
39	N	30.2	Very low	32.8	Very low	154 Å²	154	161.6 Å²	161.6	82%	0.824	82%	0.819	S	S	*	*	S	Bend	trans	-144.8	33.7	-173.7	-95.9	-16.1	0	0	0	117.2
40	Y	28.7	Very low	32.3	Very low	223 Å²	223	165 Å²	165	88%	0.875	82%	0.823	S	S	*	*	S	Bend	trans	-143.3	132.8	169.7	-85.1	-89.2	0	0	0	111.1
41	F	31.7	Very low	31.9	Very low	199 Å²	199	168 Å²	168	87%	0.873	84%	0.836	S	S	*	*			trans	96.4	63.9	175.8	-65.9	-82.9	0	0	0	118.7
42	T	27.9	Very low	31.6	Very low	139 Å²	139	171.4 Å²	171.4	85%	0.853	84%	0.837	S	S	*	*			trans	-111.5	106.9	147	42.3	0	0	0	0	109.2
43	K	29.7	Very low	31.6	Very low	210 Å²	210	167.9 Å²	167.9	91%	0.913	83%	0.832	S	S	*	*			trans	157.5	120.9	150.7	-103.3	177.8	168.8	175.9	0	110.7
44	S	31	Very low	31.4	Very low	108 Å²	108	172.5 Å²	172.5	76%	0.755	85%	0.846	S	S	*	*			trans	148.3	83.3	135.4	-171.8	0	0	0	0	110.8
45	S	31.1	Very low	31.4	Very low	111 Å²	111	167.4 Å²	167.4	78%	0.776	83%	0.831	S	S	*	*			trans	-93.5	117.5	155.1	38.2	0	0	0	0	107.1
46	N	33.9	Very low	31.2	Very low	156 Å²	156	166.5 Å²	166.5	83%	0.834	83%	0.833	S	S	*	*			trans	-137.7	116.5	164.3	-88.4	-36.5	0	0	0	110.5
47	L	31	Very low	31.1	Very low	146 Å²	146	163.6 Å²	163.6	76%	0.764	83%	0.825	S	S	*	*			trans	-73.9	132.9	167.2	-128.1	81.6	0	0	0	108.5
48	H	30.7	Very low	30.8	Very low	189 Å²	189	163.6 Å²	163.6	88%	0.875	82%	0.82	S	S	*	*			trans	169.2	100.8	145.5	-106.6	-83.2	0	0	0	108.5
49	F	32.8	Very low	30.9	Very low	188 Å²	188	162.9 Å²	162.9	83%	0.825	82%	0.815	S	S	*	*			trans	-165.4	-19.5	150.3	-146.9	-110.8	0	0	0	119.5
50	Y	30.5	Very low	30.8	Very low	203 Å²	203	162.2 Å²	162.2	80%	0.796	81%	0.811	S	S	*	*			trans	-110.4	78.4	-171.6	-92.8	-85.9	0	0	0	113.6
51	D	30.3	Very low	31.1	Very low	160 Å²	160	159 Å²	159	86%	0.856	81%	0.809	S	S	*	*			trans	-133.9	61.5	164.1	-150.1	14.9	0	0	0	108.7
52	R	31.4	Very low	31.1	Very low	226 Å²	226	157.6 Å²	157.6	85%	0.853	80%	0.802	S	S	*	*			trans	-170.9	143.7	166.7	-140.6	158.3	-112.4	177.1	-4.4	109.6
53	I	34.2	Very low	31.4	Very low	152 Å²	152	160.8 Å²	160.8	78%	0.779	80%	0.8	S	S	*	*			trans	99.4	63.1	-176	-46.6	162.9	0	0	0	112.1
54	D	29.3	Very low	31.7	Very low	176 Å²	176	156.4 Å²	156.4	94%	0.941	79%	0.786	S	S	*	*			trans	-97.6	129.4	144.3	-142.2	-3	0	0	0	105.4
55	G	32	Very low	32	Very low	54 Å²	54	155.3 Å²	155.3	56%	0.557	78%	0.777	S	S	*	*			trans	150.7	92.3	-178.5	0	0	0	0	0	114.9
56	D	28.9	Very low	32.3	Very low	167 Å²	167	159.1 Å²	159.1	89%	0.893	77%	0.774	S	S	*	*			trans	29.2	104.8	145.9	-64.9	-27.4	0	0	0	119.2
57	I	32.5	Very low	32.8	Very low	143 Å²	143	159.4 Å²	159.4	73%	0.733	77%	0.77	S	S	*	*			trans	-132.7	99	151.8	-53.9	-180	0	0	0	109.9	F59	I57-F59 HydrophobicContact CG2-CD2 3.71Å; I57-F59 HydrophobicContact CG2-CE2 3.69Å
58	N	27	Very low	33.6	Very low	147 Å²	147	155.2 Å²	155.2	79%	0.786	75%	0.751	S	S	*	*			trans	-73.6	114.1	168.5	-162.5	-3.6	0	0	0	108.9	N60	N58-N60 PolarHBondContact O-N 2.87Å
59	F	33.4	Very low	34.4	Very low	170 Å²	170	149.6 Å²	149.6	75%	0.746	73%	0.726	S	S	*	*			trans	-94.8	72.2	-179.1	-105.2	-86	0	0	0	110.9	I57	I57-F59 HydrophobicContact CG2-CD2 3.71Å; I57-F59 HydrophobicContact CG2-CE2 3.69Å
60	N	29.9	Very low	35.1	Very low	139 Å²	139	143.1 Å²	143.1	74%	0.743	70%	0.702	S	S	*	*			trans	-111	77.9	157.6	-91.4	-18.2	0	0	0	107.5	N58	N58-N60 PolarHBondContact O-N 2.87Å
61	D	34.1	Very low	35.8	Very low	155 Å²	155	142.2 Å²	142.2	83%	0.829	70%	0.697	S	S	*	*			trans	-153.9	135.1	153.5	-106.5	-28.9	0	0	0	113.9
62	K	30.8	Very low	36.5	Very low	171 Å²	171	142.2 Å²	142.2	74%	0.743	69%	0.69	S	S	*	*			trans	-87.4	134.5	-166.8	-127.8	173.2	-178.4	174.9	0	108.5
63	Y	34.5	Very low	37	Very low	205 Å²	205	136.7 Å²	136.7	80%	0.804	68%	0.677	S	S	*	*			trans	67.5	94.2	168.1	-55.4	-81.7	0	0	0	117.2
64	L	36.8	Very low	37.4	Very low	119 Å²	119	138.1 Å²	138.1	62%	0.623	67%	0.672	S	S	*	*			trans	-111.2	127.5	160.5	-103.6	128.2	0	0	0	111.5	V68	L64-V68 HydrophobicContact CD2-CB 3.93Å; L64-V68 HydrophobicContact CD2-CG1 3.72Å; L64-V68 HydrophobicContact CD2-CG2 4.16Å
65	P	37.9	Very low	38	Very low	85 Å²	85	135 Å²	135	55%	0.552	66%	0.656	S	S	*	*			trans	-72	146.5	-174.2	25.1	-30.9	0	0	0	113.4	Q67 V68	P65-Q67 PolarHBondContact O-N 3.27Å; P65-V68 HydrophobicContact CG-CG2 4.33Å; P65-V68 PolarHBondContact O-N 2.77Å
66	W	36.1	Very low	38.4	Very low	191 Å²	191	135.1 Å²	135.1	72%	0.723	65%	0.651	S	S	*	*	H	α-helix	trans	-50.8	-24.5	-174.2	-167.4	-114.9	0	0	0	115.5	V68 I69 T70	W66-V68 VanDerWaalsContact C-N 3.34Å; W66-V68 PolarHBondContact O-N 3.15Å; W66-I69 HydrophobicContact CE3-CD1 4.3Å; W66-T70 WeakPolarHBondContact O-CG2 3.21Å; W66-T70 PolarHBondContact O-N 3.48Å; W66-T70 VanDerWaalsContact O-N 3.17Å; W66-T70 PolarHBondContact O-OG1 3.25Å
67	Q	44.4	Very low	38.7	Very low	161 Å²	161	132.3 Å²	132.3	75%	0.752	64%	0.64	S	S	*	*	H	α-helix	trans	-72.7	-22.4	177.9	-67.8	-168.2	-21.6	0	0	113.9	P65 T70 R71	P65-Q67 PolarHBondContact O-N 3.27Å; Q67-T70 WeakPolarHBondContact CA-OG1 3.46Å; Q67-T70 PolarHBondContact O-OG1 3.45Å; Q67-R71 PolarHBondContact O-N 2.97Å
68	V	49	Very low	38.9	Very low	58 Å²	58	130.2 Å²	130.2	35%	0.352	64%	0.635	S	S	.	*	H	α-helix	trans	-83.4	-38.5	176.5	-177.3	0	0	0	0	110.9	L64 P65 W66 T70 R71 K72	L64-V68 HydrophobicContact CD2-CB 3.93Å; L64-V68 HydrophobicContact CD2-CG1 3.72Å; L64-V68 HydrophobicContact CD2-CG2 4.16Å; P65-V68 HydrophobicContact CG-CG2 4.33Å; P65-V68 PolarHBondContact O-N 2.77Å; W66-V68 VanDerWaalsContact C-N 3.34Å; W66-V68 PolarHBondContact O-N 3.15Å; V68-T70 PolarHBondContact O-N 3.35Å; V68-R71 PolarHBondContact O-N 3.4Å; V68-K72 WeakPolarHBondContact O-CG 3.49Å; V68-K72 PolarHBondContact O-N 3.19Å
69	I	46.9	Very low	39.6	Very low	72 Å²	72	130 Å²	130	37%	0.369	63%	0.633	S	S	.	*	H	α-helix	trans	-62.9	-43.1	175.4	-63.8	170.8	0	0	0	110.4	W66 R71 L73	W66-I69 HydrophobicContact CE3-CD1 4.3Å; I69-R71 PolarHBondContact O-N 2.94Å; I69-L73 HydrophobicContact CG2-CD1 3.74Å; I69-L73 VanDerWaalsContact O-CB 3.31Å; I69-L73 WeakPolarHBondContact O-CB 3.18Å; I69-L73 WeakPolarHBondContact O-CD1 3.47Å; I69-L73 WeakPolarHBondContact O-CG 3.03Å; I69-L73 PolarHBondContact O-N 3.42Å
70	T	46.9	Very low	39.8	Very low	52 Å²	52	127.7 Å²	127.7	32%	0.319	63%	0.626	S	S	.	*	H	α-helix	trans	-71.8	-26.4	178.2	50	0	0	0	0	113.8	W66 Q67 V68 R74	W66-T70 WeakPolarHBondContact O-CG2 3.21Å; W66-T70 PolarHBondContact O-N 3.48Å; W66-T70 VanDerWaalsContact O-N 3.17Å; W66-T70 PolarHBondContact O-OG1 3.25Å; Q67-T70 WeakPolarHBondContact CA-OG1 3.46Å; Q67-T70 PolarHBondContact O-OG1 3.45Å; V68-T70 PolarHBondContact O-N 3.35Å; T70-R74 WeakPolarHBondContact O-CB 3.29Å; T70-R74 PolarHBondContact O-N 2.95Å; T70-R74 VanDerWaalsContact O-N 3.13Å
71	R	45	Very low	39.9	Very low	183 Å²	183	128.4 Å²	128.4	69%	0.691	62%	0.623	S	S	*	*	H	α-helix	trans	-73.7	-48	171.6	-118.2	176	-176	156.4	0.2	111.5	Q67 V68 I69 L73 R74 D75	Q67-R71 PolarHBondContact O-N 2.97Å; V68-R71 PolarHBondContact O-N 3.4Å; I69-R71 PolarHBondContact O-N 2.94Å; R71-L73 VanDerWaalsContact C-N 3.32Å; R71-L73 PolarHBondContact O-N 3.01Å; R71-R74 WeakPolarHBondContact O-CB 3.12Å; R71-R74 PolarHBondContact O-N 2.03Å; R71-D75 VanDerWaalsContact O-CG 3.27Å; R71-D75 PolarHBondContact O-N 3.05Å
72	K	45.3	Very low	39.8	Very low	161 Å²	161	127.3 Å²	127.3	70%	0.7	62%	0.624	S	S	*	*	H	α-helix	trans	-65.6	-32.8	178.3	-67	-130.4	177	-164.2	0	113	V68 A76	V68-K72 WeakPolarHBondContact O-CG 3.49Å; V68-K72 PolarHBondContact O-N 3.19Å; K72-A76 PolarHBondContact O-N 3.39Å
73	L	42.1	Very low	39.9	Very low	110 Å²	110	126.2 Å²	126.2	58%	0.576	63%	0.625	S	S	*	*	H	α-helix	trans	-72.5	-32	170.7	-77	164.4	0	0	0	112.6	I69 R71 V77	I69-L73 HydrophobicContact CG2-CD1 3.74Å; I69-L73 VanDerWaalsContact O-CB 3.31Å; I69-L73 WeakPolarHBondContact O-CB 3.18Å; I69-L73 WeakPolarHBondContact O-CD1 3.47Å; I69-L73 WeakPolarHBondContact O-CG 3.03Å; I69-L73 PolarHBondContact O-N 3.42Å; R71-L73 VanDerWaalsContact C-N 3.32Å; R71-L73 PolarHBondContact O-N 3.01Å; L73-V77 WeakPolarHBondContact O-CG2 3.18Å
74	R	42.4	Very low	39.6	Very low	181 Å²	181	123.6 Å²	123.6	68%	0.683	63%	0.625	S	S	*	*	H	α-helix	trans	-71	-32.2	176	-173.8	-178.6	-60.1	-172.5	0.6	112.3	T70 R71	T70-R74 WeakPolarHBondContact O-CB 3.29Å; T70-R74 PolarHBondContact O-N 2.95Å; T70-R74 VanDerWaalsContact O-N 3.13Å; R71-R74 WeakPolarHBondContact O-CB 3.12Å; R71-R74 PolarHBondContact O-N 2.03Å
75	D	43.2	Very low	39.6	Very low	112 Å²	112	123.2 Å²	123.2	60%	0.599	63%	0.632	S	S	*	*	H	α-helix	trans	-82.3	-16.8	179.4	-59.8	-23.3	0	0	0	112.9	R71	R71-D75 VanDerWaalsContact O-CG 3.27Å; R71-D75 PolarHBondContact O-N 3.05Å
76	A	40	Very low	39.4	Very low	55 Å²	55	128.1 Å²	128.1	46%	0.455	65%	0.645	S	S	.	*	H	α-helix	trans	-87.4	-17.3	175.6	0	0	0	0	0	114	K72	K72-A76 PolarHBondContact O-N 3.39Å
77	V	35.5	Very low	39.1	Very low	108 Å²	108	127 Å²	127	66%	0.655	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-72.6	-29.2	-174.4	167.1	0	0	0	0	114.8	L73 I79	L73-V77 WeakPolarHBondContact O-CG2 3.18Å; V77-I79 PolarHBondContact O-N 2.88Å
78	P	36.7	Very low	38.5	Very low	99 Å²	99	127.3 Å²	127.3	64%	0.643	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-80.6	-5.8	176.8	-13.3	29.6	0	0	0	115.5	M80	P78-M80 VanDerWaalsContact C-N 3.35Å
79	I	41.5	Very low	37.7	Very low	143 Å²	143	133.3 Å²	133.3	73%	0.733	68%	0.677	S	S	*	*	G	3₁₀ helix	trans	-85.3	-12.4	-176.5	-55.6	175.9	0	0	0	111.5	V77	V77-I79 PolarHBondContact O-N 2.88Å
80	M	37.3	Very low	36.8	Very low	121 Å²	121	133.6 Å²	133.6	60%	0.596	69%	0.69	S	S	*	*	S	Bend	trans	-95.2	-0.5	-169	-147.9	153.1	-164.1	0	0	115.1	P78 W369	P78-M80 VanDerWaalsContact C-N 3.35Å; M80-W369 HydrophobicContact CE-CH2 4.35Å
81	F	31.6	Very low	36	Very low	155 Å²	155	136.4 Å²	136.4	68%	0.68	71%	0.712	S	S	*	*			trans	-155.8	101.1	179	-68.2	-82.8	0	0	0	113
82	P	31.8	Very low	35.4	Very low	132 Å²	132	134.3 Å²	134.3	86%	0.857	71%	0.714	S	S	*	*			trans	-91.3	108.4	161.6	30.8	-21.8	0	0	0	109.6
83	I	32.3	Very low	35	Very low	147 Å²	147	134 Å²	134	75%	0.754	72%	0.715	S	S	*	*			trans	-88.5	134.2	164.4	-64.2	172	0	0	0	107.6
84	N	29.7	Very low	34.6	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	72%	0.723	S	S	*	*			trans	82	125.9	164.8	-87.5	-14.4	0	0	0	121.3
85	S	36.3	Very low	34.3	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	72%	0.723	S	S	*	*				144.7	106.1	126.1	53.7	0	0	0	0	109.7
86	K	32.5	Very low	34.1	Very low	188 Å²	188	133.3 Å²	133.3	82%	0.817	72%	0.724	S	S	*	*				49.9	117.6	95	-81	-163.8	174.9	-168.7	0	114.6
87	E	30.3	Very low	33.9	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	73%	0.733	S	S	*	*			trans	58	122.4	151.6	-72.8	161.7	145.2	0	0	118.5
88	I	31.2	Very low	34	Very low	166 Å²	166	138.7 Å²	138.7	85%	0.851	74%	0.738	S	S	*	*				-177.5	105.3	119.7	-82.9	149.6	0	0	0	108.6
89	E	32.7	Very low	34.1	Very low	185 Å²	185	141.2 Å²	141.2	86%	0.864	74%	0.742	S	S	*	*			trans	11.2	124.7	136.6	-115.2	157.7	-179.9	0	0	121.3
90	A	27.5	Very low	33.8	Very low	78 Å²	78	138.7 Å²	138.7	65%	0.645	74%	0.737	S	S	*	*			trans	20.4	133.1	140.3	0	0	0	0	0	121.9
91	S	30.5	Very low	33.7	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	75%	0.748	S	S	*	*			trans	-133.9	116.1	137	-172.2	0	0	0	0	109.7	H93	S91-H93 VanDerWaalsContact C-N 3.34Å; S91-H93 PolarHBondContact O-N 2.87Å; S91-H93 VanDerWaalsContact O-N 3.09Å
92	D	33.7	Very low	33.8	Very low	139 Å²	139	141.7 Å²	141.7	74%	0.743	76%	0.756	S	S	*	*			trans	-79.6	48.5	-165.5	-71	-52.9	0	0	0	115.2
93	H	36.6	Very low	33.8	Very low	154 Å²	154	143.8 Å²	143.8	71%	0.713	76%	0.76	S	S	*	*	S	Bend	trans	-115.7	-3.2	-176.5	-103.1	-71.4	0	0	0	116.6	S91	S91-H93 VanDerWaalsContact C-N 3.34Å; S91-H93 PolarHBondContact O-N 2.87Å; S91-H93 VanDerWaalsContact O-N 3.09Å
94	L	33.8	Very low	33.8	Very low	144 Å²	144	140.7 Å²	140.7	75%	0.754	77%	0.765	S	S	*	*	S	Bend	trans	-120.6	11	-175.4	-145.8	74.3	0	0	0	114.7
95	K	35.5	Very low	33.9	Very low	157 Å²	157	140.8 Å²	140.8	68%	0.683	77%	0.766	S	S	*	*	S	Bend	trans	-102.1	-13.8	179.4	-145.4	-179.4	179.4	-159.7	0	114
96	S	38.8	Very low	33.7	Very low	87 Å²	87	143.5 Å²	143.5	61%	0.608	77%	0.769	S	S	*	*	S	Bend	trans	-90.7	-11	178.9	59.5	0	0	0	0	114.9
97	I	36.4	Very low	33.5	Very low	127 Å²	127	139.5 Å²	139.5	65%	0.651	76%	0.763	S	S	*	*	S	Bend	trans	-91.8	-13.8	-176.8	-64.2	175.2	0	0	0	112.3
98	I	37.5	Very low	33.3	Very low	149 Å²	149	136.8 Å²	136.8	76%	0.764	76%	0.762	S	S	*	*	S	Bend	trans	-103.9	-10	-178.2	-60.6	177.2	0	0	0	112.1
99	E	38	Very low	33.2	Very low	153 Å²	153	137.4 Å²	137.4	72%	0.715	76%	0.761	S	S	*	*	S	Bend	trans	-91.5	7.6	179.4	-77.4	179.9	171.2	0	0	115.1
100	S	36	Very low	32.9	Very low	90 Å²	90	134.1 Å²	134.1	63%	0.629	75%	0.754	S	S	*	*	S	Bend	trans	-105.3	10.4	-176.6	100.1	0	0	0	0	117.4
101	N	34	Very low	32.8	Very low	157 Å²	157	140.1 Å²	140.1	84%	0.84	76%	0.761	S	S	*	*			trans	-122.2	25.2	-180	-83	-22.7	0	0	0	115
102	Q	34.5	Very low	32.6	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	76%	0.755	S	S	*	*			trans	-102.5	96.2	160	-78.2	-172.5	-17.6	0	0	109.4
103	N	32.7	Very low	32.2	Very low	175 Å²	175	140 Å²	140	94%	0.936	76%	0.759	S	S	*	*			trans	-160.6	109.2	157.8	-93.2	-24.4	0	0	0	108.5
104	G	32.5	Very low	31.8	Very low	83 Å²	83	139.4 Å²	139.4	86%	0.856	76%	0.757	S	S	*	*			trans	176	69.8	-178.9	0	0	0	0	0	112.5
105	N	30.9	Very low	31.5	Very low	153 Å²	153	142.4 Å²	142.4	82%	0.818	76%	0.758	S	S	*	*			trans	-43.6	148.4	171.3	-81.2	-26	0	0	0	114.7
106	I	31.4	Very low	31.3	Very low	167 Å²	167	142.1 Å²	142.1	86%	0.856	77%	0.769	S	S	*	*				-179.2	126.8	113.2	-81.4	149.7	0	0	0	108.8
107	P	29.6	Very low	31	Very low	105 Å²	105	141.7 Å²	141.7	68%	0.682	78%	0.778	S	S	*	*			trans	-114.1	158.4	179.9	39.3	-28.3	0	0	0	115.5
108	S	25	Very low	30.3	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	79%	0.79	S	S	*	*			trans	72.6	148.5	144.5	-51.1	0	0	0	0	123.6
109	E	29	Very low	30	Very low	179 Å²	179	145.8 Å²	145.8	84%	0.836	79%	0.791	S	S	*	*			trans	89.7	111.8	154.1	-66.8	-170.8	156.2	0	0	119.8
110	V	26.5	Very low	29.7	Very low	116 Å²	116	146.6 Å²	146.6	70%	0.703	80%	0.795	S	S	*	*				96.6	114.2	93.3	169.2	0	0	0	0	111.6
111	Y	26.8	Very low	29.4	Very low	204 Å²	204	145.2 Å²	145.2	80%	0.8	80%	0.795	S	S	*	*				-170.7	135.2	125	-132.6	-99.3	0	0	0	111.7
112	S	26.2	Very low	29.1	Very low	94 Å²	94	147.2 Å²	147.2	66%	0.657	80%	0.799	S	S	*	*			trans	-108.9	148.7	171.8	34.6	0	0	0	0	108.5
113	N	24.4	Very low	28.8	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	79%	0.794	S	S	*	*			trans	36.6	123.5	158.9	-66.5	-13.8	0	0	0	120.5
114	E	29	Very low	28.8	Very low	141 Å²	141	144 Å²	144	66%	0.659	79%	0.794	S	S	*	*			trans	-163	121.1	131.6	-115.2	170.7	144.4	0	0	114.9
115	R	27.2	Very low	28.6	Very low	208 Å²	208	149.5 Å²	149.5	79%	0.785	80%	0.798	S	S	*	*			trans	31.4	138.8	137.4	-68	-175.8	-87.4	-175.5	-5.2	122.4
116	V	31.9	Very low	28.6	Very low	150 Å²	150	145.8 Å²	145.8	91%	0.909	80%	0.795	S	S	*	*				160.4	113.8	116.4	167.1	0	0	0	0	106.6
117	G	31.4	Very low	28.6	Very low	78 Å²	78	144.2 Å²	144.2	80%	0.804	79%	0.793	S	S	*	*				172	136.5	73.4	0	0	0	0	0	111.3
118	E	22.8	Very low	28.7	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	80%	0.796	S	S	*	*			trans	-107.2	162.4	178.1	-126.6	173.5	133.1	0	0	109.8
119	Q	30.2	Very low	29.2	Very low	170 Å²	170	148 Å²	148	79%	0.794	80%	0.799	S	S	*	*			trans	120.2	129.6	171.7	-71.6	177.5	2.2	0	0	111.5
120	H	32	Very low	30.3	Very low	170 Å²	170	143.9 Å²	143.9	79%	0.787	79%	0.786	S	S	*	*			cis	-166.9	148.9	13.5	-117	-50.6	0	0	0	110.6
121	G	30.5	Very low	31.8	Very low	61 Å²	61	140.9 Å²	140.9	63%	0.629	77%	0.77	S	S	*	*			trans	71.3	111.9	143.4	0	0	0	0	0	118.6
122	E	25.9	Very low	33.7	Very low	199 Å²	199	136.4 Å²	136.4	93%	0.93	76%	0.756	S	S	*	*				83.8	129.7	67.9	-86.8	-179.8	130.4	0	0	115.9
123	A	28.7	Very low	36.6	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	74%	0.736	S	S	*	*			trans	92.8	119.1	147.1	0	0	0	0	0	121.4
124	E	32.5	Very low	39.6	Very low	198 Å²	198	128.1 Å²	128.1	93%	0.925	71%	0.708	S	S	*	*			trans	112.8	133.4	131.5	-81.5	177.4	-179.8	0	0	121.7
125	E	29.2	Very low	42.4	Very low	200 Å²	200	124.5 Å²	124.5	94%	0.935	70%	0.697	S	S	*	*			trans	-94.8	132.4	-165.6	-175.3	176.2	-164.1	0	0	109.3
126	G	30.5	Very low	45.4	Very low	74 Å²	74	115.2 Å²	115.2	76%	0.763	66%	0.663	S	S	*	*			trans	-166.7	103.9	-177.3	0	0	0	0	0	112.2	D128	G126-D128 PolarHBondContact O-N 2.89Å
127	V	32.6	Very low	48.2	Very low	134 Å²	134	113.8 Å²	113.8	81%	0.812	65%	0.646	S	S	*	*			trans	-36.1	121.9	167.1	175.8	0	0	0	0	112
128	D	30	Very low	51	Low	138 Å²	138	111.5 Å²	111.5	74%	0.738	61%	0.614	S	S	*	*			trans	170.1	124.8	138	-81.3	-26.8	0	0	0	110.6	G126	G126-D128 PolarHBondContact O-N 2.89Å
129	D	35.9	Very low	54.1	Low	157 Å²	157	105.9 Å²	105.9	84%	0.84	59%	0.594	S	S	*	*			trans	53.6	72.2	155.1	-158.5	28.4	0	0	0	118.2
130	V	51.5	Low	56.9	Low	93 Å²	93	99 Å²	99	56%	0.564	56%	0.564	S	S	*	*			trans	-125.9	92.7	173.1	-159.3	0	0	0	0	111.1	H132	V130-H132 WeakPolarHBondContact CB-CE1 3.45Å; V130-H132 WeakPolarHBondContact CG1-CE1 3.49Å; V130-H132 WeakPolarHBondContact CG1-ND1 3.48Å; V130-H132 WeakPolarHBondContact CG1-NE2 3.43Å; V130-H132 PolarHBondContact O-CE1 3.41Å; V130-H132 PolarHBondContact O-N 3.27Å; V130-H132 PolarHBondContact O-ND1 3.17Å
131	S	58.3	Low	59.6	Low	52 Å²	52	91 Å²	91	36%	0.364	53%	0.527	S	S	.	.			trans	-69.5	111.8	159.5	47	0	0	0	0	107.9	W150	S131-W150 VanDerWaalsContact C-CZ3 3.45Å; S131-W150 WeakPolarHBondContact O-CH2 3.44Å; S131-W150 WeakPolarHBondContact O-CZ3 3.17Å; S131-W150 WeakPolarHBondContact OG-CH2 3.41Å; S131-W150 WeakPolarHBondContact OG-CZ2 2.63Å
132	H	67.7	Low	62.3	Low	110 Å²	110	91.6 Å²	91.6	51%	0.509	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.3	-166.1	-74.8	97.1	0	0	0	112	V130 V134	V130-H132 WeakPolarHBondContact CB-CE1 3.45Å; V130-H132 WeakPolarHBondContact CG1-CE1 3.49Å; V130-H132 WeakPolarHBondContact CG1-ND1 3.48Å; V130-H132 WeakPolarHBondContact CG1-NE2 3.43Å; V130-H132 PolarHBondContact O-CE1 3.41Å; V130-H132 PolarHBondContact O-N 3.27Å; V130-H132 PolarHBondContact O-ND1 3.17Å; H132-V134 HydrophobicContact CB-CG1 4.01Å; H132-V134 PolarHBondContact O-N 3.16Å
133	C	85.7	Confident	64.7	Low	34 Å²	34	83.9 Å²	83.9	23%	0.23	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	108.5	165.3	-148.1	0	0	0	0	109.1	T149 C194 P196	C133-T149 WeakPolarHBondContact CA-O 3.33Å; C133-C194 WeakPolarHBondContact CA-SG 3.49Å; C133-C194 HydrophobicContact CB-CB 4.13Å; C133-C194 WeakPolarHBondContact CB-SG 3.41Å; C133-C194 WeakPolarHBondContact SG-CB 3.37Å; C133-C194 CovalentContact SG-SG 2.02Å; C133-C194 PolarHBondContact SG-SG 3.02Å; C133-P196 HydrophobicContact CB-CG 4.43Å
134	V	87.4	Confident	67.1	Low	40 Å²	40	80.8 Å²	80.8	24%	0.242	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.3	-175.7	-66.3	0	0	0	0	111.7	H132 H148 T149 L151 Q160	H132-V134 HydrophobicContact CB-CG1 4.01Å; H132-V134 PolarHBondContact O-N 3.16Å; V134-H148 CarbonylContact O-C 3.21Å; V134-H148 VanDerWaalsContact O-CA 3.31Å; V134-H148 WeakPolarHBondContact O-CA 3.34Å; V134-T149 HydrophobicContact CG2-CG2 3.88Å; V134-T149 PolarHBondContact N-O 3.12Å; V134-T149 PolarHBondContact O-N 3.06Å; V134-L151 HydrophobicContact CG2-CD1 4.13Å; V134-Q160 HydrophobicContact CG2-CG 4.48Å; V134-Q160 VanDerWaalsContact CG2-NE2 3.31Å
135	P	89	Confident	69.4	Low	66 Å²	66	78.1 Å²	78.1	43%	0.429	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	142.5	178.2	27.6	-34.7	0	0	0	111.7	H137 Q160	P135-H137 PolarHBondContact O-N 2.92Å; P135-Q160 PolarHBondContact O-NE2 3.15Å; P135-Q160 PolarHBondContact O-OE1 2.9Å
136	I	90.2	Very high	71.9	Confident	13 Å²	13	69.7 Å²	69.7	7%	0.067	41%	0.405	C	S	.	.			trans	-73.9	119.5	-177.1	-62.2	165.8	0	0	0	110.8	E138 C141 H142 Y146 T147 T149 F191	I136-E138 HydrophobicContact CG2-CB 4.29Å; I136-C141 HydrophobicContact CG2-CB 3.93Å; I136-H142 PolarHBondContact O-NE2 3.24Å; I136-Y146 HydrophobicContact CD1-CD2 3.74Å; I136-Y146 HydrophobicContact CD1-CE2 3.56Å; I136-T147 PolarHBondContact N-O 3.22Å; I136-T149 HydrophobicContact CG1-CG2 3.97Å; I136-F191 HydrophobicContact CD1-CB 4.44Å; I136-F191 HydrophobicContact CG2-CD1 4.12Å; I136-F191 HydrophobicContact CG2-CG 4.49Å
137	H	90.1	Very high	74.6	Confident	120 Å²	120	70.8 Å²	70.8	56%	0.556	40%	0.397	S	S	*	.			trans	-91.6	-15.8	176.7	-61.4	152.8	0	0	0	113.8	P135 P139	P135-H137 PolarHBondContact O-N 2.92Å; H137-P139 VanDerWaalsContact O-CD 3.29Å; H137-P139 WeakPolarHBondContact O-CD 3.46Å
138	E	90.1	Very high	77.3	Confident	29 Å²	29	67.4 Å²	67.4	14%	0.136	37%	0.373	C	S	.	.			trans	-73.5	115	-176.3	176	47.7	-131.2	0	0	112.4	I136 V140 C141 H142 A164 M167 F191	I136-E138 HydrophobicContact CG2-CB 4.29Å; E138-V140 HydrophobicContact CG-CB 4.2Å; E138-V140 PolarHBondContact O-N 3.1Å; E138-V140 WeakPolarHBondContact OE1-CB 3.49Å; E138-V140 VanDerWaalsContact OE1-CG2 3.25Å; E138-V140 WeakPolarHBondContact OE1-CG2 3.32Å; E138-V140 PolarHBondContact OE1-N 3.48Å; E138-C141 PolarHBondContact O-N 3.02Å; E138-H142 PolarHBondContact O-CD2 2.04Å; E138-H142 VanDerWaalsContact O-CD2 3.22Å; E138-H142 PolarHBondContact O-N 3.05Å; E138-A164 WeakPolarHBondContact OE2-CB 3.39Å; E138-M167 HydrophobicContact CG-CG 4.38Å; E138-F191 HydrophobicContact CB-CD1 4.49Å; E138-F191 HydrophobicContact CB-CE1 3.76Å; E138-F191 HydrophobicContact CB-CE2 3.81Å; E138-F191 HydrophobicContact CB-CZ 3.37Å; E138-F191 HydrophobicContact CG-CE2 3.79Å; E138-F191 HydrophobicContact CG-CZ 3.79Å
139	P	88.9	Confident	80.1	Confident	74 Å²	74	60.9 Å²	60.9	48%	0.481	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-59.1	-32.3	-176.7	-25.2	34.7	0	0	0	113.8	H137 C141 H142	H137-P139 VanDerWaalsContact O-CD 3.29Å; H137-P139 WeakPolarHBondContact O-CD 3.46Å; P139-C141 VanDerWaalsContact C-N 3.25Å; P139-C141 PolarHBondContact O-N 3.38Å; P139-H142 PolarHBondContact O-N 3.19Å
140	V	87.8	Confident	82.5	Confident	27 Å²	27	55 Å²	55	16%	0.164	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-62.9	-35.1	176	177.2	0	0	0	0	110.5	E138 M167 I174 K183	E138-V140 HydrophobicContact CG-CB 4.2Å; E138-V140 PolarHBondContact O-N 3.1Å; E138-V140 WeakPolarHBondContact OE1-CB 3.49Å; E138-V140 VanDerWaalsContact OE1-CG2 3.25Å; E138-V140 WeakPolarHBondContact OE1-CG2 3.32Å; E138-V140 PolarHBondContact OE1-N 3.48Å; V140-M167 HydrophobicContact CB-CG 4.26Å; V140-M167 HydrophobicContact CG1-CG 4.23Å; V140-M167 HydrophobicContact CG1-SD 4.34Å; V140-I174 HydrophobicContact CG1-CD1 3.82Å; V140-K183 HydrophobicContact CG1-CG 4.48Å; V140-K183 WeakPolarHBondContact O-CE 3.04Å; V140-K183 PolarHBondContact O-NZ 3.29Å
141	C	89.6	Confident	84.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.014	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-92.7	5.5	-178.9	-62.6	0	0	0	0	114	I136 E138 P139 L144 C187 F191	I136-C141 HydrophobicContact CG2-CB 3.93Å; E138-C141 PolarHBondContact O-N 3.02Å; P139-C141 VanDerWaalsContact C-N 3.25Å; P139-C141 PolarHBondContact O-N 3.38Å; C141-L144 HydrophobicContact CB-CD1 3.94Å; C141-L144 VanDerWaalsContact O-CD1 3.32Å; C141-L144 WeakPolarHBondContact O-CD1 3.32Å; C141-L144 WeakPolarHBondContact O-CG 3.39Å; C141-C187 WeakPolarHBondContact CA-SG 3.49Å; C141-C187 HydrophobicContact CB-CB 3.88Å; C141-C187 WeakPolarHBondContact CB-SG 3.06Å; C141-C187 WeakPolarHBondContact SG-CB 3.38Å; C141-C187 CovalentContact SG-SG 2.04Å; C141-C187 PolarHBondContact SG-SG 2.82Å; C141-F191 HydrophobicContact CB-CD2 4.43Å; C141-F191 VanDerWaalsContact SG-CD2 3.57Å
142	H	87.4	Confident	85.6	Confident	73 Å²	73	52.4 Å²	52.4	34%	0.338	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	139.6	170.1	-67.2	176.4	0	0	0	110.8	I136 E138 P139 K183	I136-H142 PolarHBondContact O-NE2 3.24Å; E138-H142 PolarHBondContact O-CD2 2.04Å; E138-H142 VanDerWaalsContact O-CD2 3.22Å; E138-H142 PolarHBondContact O-N 3.05Å; P139-H142 PolarHBondContact O-N 3.19Å; H142-K183 PolarHBondContact O-NZ 3.44Å
143	G	76.4	Confident	86.5	Confident	37 Å²	37	47.6 Å²	47.6	38%	0.381	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.3	2.8	178.9	0	0	0	0	0	116.7	Q341	G143-Q341 PolarHBondContact O-OE1 2.92Å; G143-Q341 VanDerWaalsContact O-OE1 3.13Å
144	L	79	Confident	86.3	Confident	25 Å²	25	48.8 Å²	48.8	13%	0.131	27%	0.273	C	S	.	.	S	Bend	trans	-71.8	164.3	171.3	-59.2	170.5	0	0	0	111	C141 Y146 F184 C187	C141-L144 HydrophobicContact CB-CD1 3.94Å; C141-L144 VanDerWaalsContact O-CD1 3.32Å; C141-L144 WeakPolarHBondContact O-CD1 3.32Å; C141-L144 WeakPolarHBondContact O-CG 3.39Å; L144-Y146 HydrophobicContact CB-CD1 4.21Å; L144-Y146 HydrophobicContact CB-CE1 4.06Å; L144-Y146 HydrophobicContact CD1-CE1 4.03Å; L144-Y146 HydrophobicContact CD1-CE2 4.22Å; L144-Y146 WeakPolarHBondContact CD1-OH 3.36Å; L144-Y146 PolarHBondContact O-N 3.31Å; L144-Y146 VanDerWaalsContact O-N 3.1Å; L144-F184 HydrophobicContact CD2-CD2 3.9Å; L144-C187 HydrophobicContact CD1-CB 3.32Å
145	Q	79.8	Confident	86.2	Confident	143 Å²	143	49 Å²	49	67%	0.668	27%	0.274	S	S	*	.	S	Bend	trans	-67.3	-6	177.3	-64.6	83	5.7	0	0	113.9
146	Y	82.7	Confident	86.1	Confident	23 Å²	23	48.4 Å²	48.4	9%	0.09	28%	0.279	C	S	.	.			trans	-127.2	148.4	175.2	62.5	-89.5	0	0	0	110.1	I136 L144 C187 T188 F191 M193 I246	I136-Y146 HydrophobicContact CD1-CD2 3.74Å; I136-Y146 HydrophobicContact CD1-CE2 3.56Å; L144-Y146 HydrophobicContact CB-CD1 4.21Å; L144-Y146 HydrophobicContact CB-CE1 4.06Å; L144-Y146 HydrophobicContact CD1-CE1 4.03Å; L144-Y146 HydrophobicContact CD1-CE2 4.22Å; L144-Y146 WeakPolarHBondContact CD1-OH 3.36Å; L144-Y146 PolarHBondContact O-N 3.31Å; L144-Y146 VanDerWaalsContact O-N 3.1Å; Y146-C187 VanDerWaalsContact OH-C 3.31Å; Y146-C187 PolarHBondContact OH-O 2.99Å; Y146-T188 HydrophobicContact CE1-CG2 4.13Å; Y146-T188 PolarHBondContact OH-N 2.69Å; Y146-F191 WeakPolarHBondContact CE2-O 3.19Å; Y146-F191 PolarHBondContact OH-O 3.37Å; Y146-M193 HydrophobicContact CD1-CB 3.85Å; Y146-M193 HydrophobicContact CD2-CB 3.67Å; Y146-M193 HydrophobicContact CE1-CB 4.28Å; Y146-M193 HydrophobicContact CE2-CB 4.12Å; Y146-M193 HydrophobicContact CG-CB 3.52Å; Y146-I246 HydrophobicContact CD1-CD1 4.32Å; Y146-I246 HydrophobicContact CE1-CD1 4.26Å
147	T	87	Confident	86.1	Confident	96 Å²	96	49 Å²	49	59%	0.589	28%	0.283	S	S	*	.			trans	-116.8	-12.6	-174.2	52.6	0	0	0	0	113.8	I136	I136-T147 PolarHBondContact N-O 3.22Å
148	H	88.8	Confident	85.9	Confident	64 Å²	64	47.4 Å²	47.4	30%	0.296	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	144.8	-178.2	-64.3	70	0	0	0	109.9	V134 C194	V134-H148 CarbonylContact O-C 3.21Å; V134-H148 VanDerWaalsContact O-CA 3.31Å; V134-H148 WeakPolarHBondContact O-CA 3.34Å; H148-C194 PolarHBondContact O-N 3.09Å
149	T	89.3	Confident	86	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	157.4	179.3	-166.7	0	0	0	0	112.5	C133 V134 I136 Q160 F191 P192 C194	C133-T149 WeakPolarHBondContact CA-O 3.33Å; V134-T149 HydrophobicContact CG2-CG2 3.88Å; V134-T149 PolarHBondContact N-O 3.12Å; V134-T149 PolarHBondContact O-N 3.06Å; I136-T149 HydrophobicContact CG1-CG2 3.97Å; T149-Q160 HydrophobicContact CG2-CG 4.37Å; T149-F191 HydrophobicContact CG2-CD1 4.27Å; T149-F191 WeakPolarHBondContact OG1-CA 3.07Å; T149-F191 PolarHBondContact OG1-O 3.49Å; T149-P192 WeakPolarHBondContact CA-O 3.25Å; T149-P192 WeakPolarHBondContact CB-O 3.37Å; T149-P192 WeakPolarHBondContact OG1-CD 3.39Å; T149-P192 PolarHBondContact OG1-O 3.23Å; T149-C194 VanDerWaalsContact C-CB 3.47Å
150	W	85.7	Confident	86.1	Confident	35 Å²	35	45.4 Å²	45.4	13%	0.133	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.6	175.3	-175.1	-102.3	0	0	0	110.7	S131 P192 C194 P201 A203	S131-W150 VanDerWaalsContact C-CZ3 3.45Å; S131-W150 WeakPolarHBondContact O-CH2 3.44Å; S131-W150 WeakPolarHBondContact O-CZ3 3.17Å; S131-W150 WeakPolarHBondContact OG-CH2 3.41Å; S131-W150 WeakPolarHBondContact OG-CZ2 2.63Å; W150-P192 HydrophobicContact CB-CG 4.38Å; W150-P192 PolarHBondContact N-O 3.2Å; W150-C194 HydrophobicContact CB-CB 3.99Å; W150-P201 HydrophobicContact CE3-CB 3.84Å; W150-P201 HydrophobicContact CE3-CG 4.34Å; W150-P201 HydrophobicContact CH2-CB 3.77Å; W150-P201 HydrophobicContact CH2-CG 3.75Å; W150-P201 HydrophobicContact CZ3-CB 3.37Å; W150-P201 HydrophobicContact CZ3-CG 3.44Å; W150-P201 VanDerWaalsContact CZ3-CG 3.44Å; W150-A203 HydrophobicContact CB-CB 4.03Å; W150-A203 HydrophobicContact CG-CB 4.06Å
151	L	86.6	Confident	86.2	Confident	22 Å²	22	50.2 Å²	50.2	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	138.5	171.3	-69	170.4	0	0	0	109.9	V134 N153 L157 Q160	V134-L151 HydrophobicContact CG2-CD1 4.13Å; L151-N153 HydrophobicContact CD2-CB 4.32Å; L151-L157 WeakPolarHBondContact CD2-O 3.35Å; L151-Q160 HydrophobicContact CD1-CB 4.45Å; L151-Q160 HydrophobicContact CD1-CG 3.56Å
152	P	87.7	Confident	86.3	Confident	68 Å²	68	54.4 Å²	54.4	44%	0.442	31%	0.309	S	S	.	.	S	Bend	cis	-70.4	141.8	1.7	28.2	-33.8	0	0	0	113.3	L157 T158	P152-L157 WeakPolarHBondContact CA-O 3.3Å; P152-T158 HydrophobicContact CB-CG2 4.24Å
153	N	86.8	Confident	86.5	Confident	9 Å²	9	50.9 Å²	50.9	5%	0.048	29%	0.293	C	S	.	.			trans	-73.6	174.5	178.4	66.6	15.9	0	0	0	111.5	L151 V155 G156 L157 Y190 P192	L151-N153 HydrophobicContact CD2-CB 4.32Å; N153-V155 VanDerWaalsContact CG-CG2 3.49Å; N153-V155 WeakPolarHBondContact ND2-CG2 3.32Å; N153-V155 PolarHBondContact O-N 3.24Å; N153-V155 WeakPolarHBondContact OD1-CG2 3.45Å; N153-V155 PolarHBondContact OD1-N 3.08Å; N153-G156 PolarHBondContact O-N 3.02Å; N153-G156 PolarHBondContact OD1-N 2.93Å; N153-G156 VanDerWaalsContact OD1-N 3.13Å; N153-L157 PolarHBondContact N-O 3.26Å; N153-L157 PolarHBondContact OD1-N 2.92Å; N153-Y190 PolarHBondContact ND2-O 3.14Å; N153-P192 HydrophobicContact CB-CG 4.03Å
154	S	81.6	Confident	87.2	Confident	58 Å²	58	50.1 Å²	50.1	41%	0.406	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.5	-176.8	61.7	0	0	0	0	115	Q205	S154-Q205 PolarHBondContact OG-NE2 3.26Å
155	V	86.4	Confident	87.8	Confident	46 Å²	46	56.5 Å²	56.5	28%	0.279	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	5	173.7	-64.4	0	0	0	0	112.5	N153 L157 I189 Y190 E232	N153-V155 VanDerWaalsContact CG-CG2 3.49Å; N153-V155 WeakPolarHBondContact ND2-CG2 3.32Å; N153-V155 PolarHBondContact O-N 3.24Å; N153-V155 WeakPolarHBondContact OD1-CG2 3.45Å; N153-V155 PolarHBondContact OD1-N 3.08Å; V155-L157 HydrophobicContact CG2-CD1 3.92Å; V155-L157 HydrophobicContact CG2-CG 3.99Å; V155-I189 HydrophobicContact CG1-CG2 3.77Å; V155-Y190 HydrophobicContact CG2-CD1 3.84Å; V155-Y190 HydrophobicContact CG2-CE1 3.9Å; V155-E232 HydrophobicContact CG1-CB 4.06Å
156	G	85.7	Confident	88.3	Confident	52 Å²	52	55.2 Å²	55.2	54%	0.536	30%	0.299	S	S	.	.			trans	84.7	11.2	173.4	0	0	0	0	0	115.4	N153	N153-G156 PolarHBondContact O-N 3.02Å; N153-G156 PolarHBondContact OD1-N 2.93Å; N153-G156 VanDerWaalsContact OD1-N 3.13Å
157	L	90	Very high	88.6	Confident	26 Å²	26	54.2 Å²	54.2	14%	0.136	30%	0.295	C	S	.	.			trans	-81	130	176.7	-54.2	172.6	0	0	0	109.4	L151 P152 N153 V155 E162 A163 R166 Y190	L151-L157 WeakPolarHBondContact CD2-O 3.35Å; P152-L157 WeakPolarHBondContact CA-O 3.3Å; N153-L157 PolarHBondContact N-O 3.26Å; N153-L157 PolarHBondContact OD1-N 2.92Å; V155-L157 HydrophobicContact CG2-CD1 3.92Å; V155-L157 HydrophobicContact CG2-CG 3.99Å; L157-E162 HydrophobicContact CB-CB 4.33Å; L157-E162 HydrophobicContact CD2-CB 4.23Å; L157-A163 HydrophobicContact CD1-CB 4.06Å; L157-R166 HydrophobicContact CD1-CB 4.34Å; L157-R166 HydrophobicContact CD1-CG 3.88Å; L157-Y190 HydrophobicContact CD1-CD1 4.04Å; L157-Y190 HydrophobicContact CD1-CE1 4.32Å
158	T	87.4	Confident	88.7	Confident	87 Å²	87	53.7 Å²	53.7	53%	0.534	29%	0.288	S	S	.	.			trans	-95.7	-18	-171.2	57.7	0	0	0	0	113.1	P152	P152-T158 HydrophobicContact CB-CG2 4.24Å
159	T	90.9	Very high	88.6	Confident	49 Å²	49	56 Å²	56	30%	0.301	30%	0.303	S	S	.	.	S	Bend	trans	-123.6	152.9	-177.9	63.4	0	0	0	0	111.2	E161 E162 A163	T159-E161 VanDerWaalsContact C-N 3.27Å; T159-E161 PolarHBondContact O-N 3.44Å; T159-E162 WeakPolarHBondContact OG1-CB 3.46Å; T159-E162 WeakPolarHBondContact OG1-CG 3.4Å; T159-E162 PolarHBondContact OG1-N 3.14Å; T159-A163 PolarHBondContact O-N 3.11Å
160	Q	91.3	Very high	88.6	Confident	12 Å²	12	57.3 Å²	57.3	6%	0.056	31%	0.308	C	S	.	.	H	α-helix	trans	-69.4	-30	176.9	-71.7	-164.1	54.1	0	0	111.6	V134 P135 T149 L151 A163 A164 F191	V134-Q160 HydrophobicContact CG2-CG 4.48Å; V134-Q160 VanDerWaalsContact CG2-NE2 3.31Å; P135-Q160 PolarHBondContact O-NE2 3.15Å; P135-Q160 PolarHBondContact O-OE1 2.9Å; T149-Q160 HydrophobicContact CG2-CG 4.37Å; L151-Q160 HydrophobicContact CD1-CB 4.45Å; L151-Q160 HydrophobicContact CD1-CG 3.56Å; Q160-A163 PolarHBondContact O-N 2.8Å; Q160-A164 WeakPolarHBondContact O-CB 3.05Å; Q160-A164 PolarHBondContact O-N 3.48Å; Q160-F191 HydrophobicContact CB-CE1 4.14Å; Q160-F191 HydrophobicContact CG-CE1 4.21Å
161	E	90.9	Very high	88.8	Confident	127 Å²	127	62.3 Å²	62.3	59%	0.593	33%	0.327	S	S	*	.	H	α-helix	trans	-66.2	-40.9	179.3	-65.5	69.4	-153.9	0	0	111.2	T159 A164 K165	T159-E161 VanDerWaalsContact C-N 3.27Å; T159-E161 PolarHBondContact O-N 3.44Å; E161-A164 PolarHBondContact O-N 3.31Å; E161-K165 WeakPolarHBondContact O-CB 3.42Å; E161-K165 PolarHBondContact O-N 3.14Å
162	E	91.3	Very high	88.7	Confident	90 Å²	90	65.7 Å²	65.7	42%	0.421	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-42.4	173.2	-76	174.7	172	0	0	111.8	L157 T159 K165 R166	L157-E162 HydrophobicContact CB-CB 4.33Å; L157-E162 HydrophobicContact CD2-CB 4.23Å; T159-E162 WeakPolarHBondContact OG1-CB 3.46Å; T159-E162 WeakPolarHBondContact OG1-CG 3.4Å; T159-E162 PolarHBondContact OG1-N 3.14Å; E162-K165 PolarHBondContact O-N 3.22Å; E162-R166 PolarHBondContact O-N 3.23Å
163	A	91.5	Very high	88.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-41	175.7	0	0	0	0	0	112.4	L157 T159 Q160 R166 M167 F191	L157-A163 HydrophobicContact CD1-CB 4.06Å; T159-A163 PolarHBondContact O-N 3.11Å; Q160-A163 PolarHBondContact O-N 2.8Å; A163-R166 PolarHBondContact O-N 3.22Å; A163-M167 WeakPolarHBondContact O-CB 3.38Å; A163-M167 PolarHBondContact O-N 2.03Å; A163-F191 HydrophobicContact CB-CE1 4.01Å; A163-F191 HydrophobicContact CB-CE2 4.05Å; A163-F191 HydrophobicContact CB-CZ 3.68Å
164	A	91.1	Very high	88.7	Confident	20 Å²	20	64.7 Å²	64.7	17%	0.165	34%	0.343	C	S	.	.	H	α-helix	trans	-62.6	-42.2	176	0	0	0	0	0	111.7	E138 Q160 E161 R166 M167 N168 F191	E138-A164 WeakPolarHBondContact OE2-CB 3.39Å; Q160-A164 WeakPolarHBondContact O-CB 3.05Å; Q160-A164 PolarHBondContact O-N 3.48Å; E161-A164 PolarHBondContact O-N 3.31Å; A164-R166 VanDerWaalsContact C-N 3.32Å; A164-R166 PolarHBondContact O-N 3.41Å; A164-M167 WeakPolarHBondContact O-CB 3.46Å; A164-M167 PolarHBondContact O-N 2.99Å; A164-N168 WeakPolarHBondContact O-CB 3.3Å; A164-N168 PolarHBondContact O-N 2.81Å; A164-F191 HydrophobicContact CB-CZ 4.23Å
165	K	91.5	Very high	88.9	Confident	159 Å²	159	67.9 Å²	67.9	69%	0.691	36%	0.355	S	S	*	.	H	α-helix	trans	-59.2	-43.9	175.5	-170	179	-178.6	-179.3	0	111.5	E161 E162 N168	E161-K165 WeakPolarHBondContact O-CB 3.42Å; E161-K165 PolarHBondContact O-N 3.14Å; E162-K165 PolarHBondContact O-N 3.22Å; K165-N168 PolarHBondContact O-N 2.82Å
166	R	90.1	Very high	88.9	Confident	117 Å²	117	70.2 Å²	70.2	44%	0.442	37%	0.37	S	S	.	.	H	α-helix	trans	-68.8	-35.5	175.8	-66.9	-62.6	-167.4	142.5	6.4	112.8	L157 E162 A163 A164 N168 D169 Y170 Y190	L157-R166 HydrophobicContact CD1-CB 4.34Å; L157-R166 HydrophobicContact CD1-CG 3.88Å; E162-R166 PolarHBondContact O-N 3.23Å; A163-R166 PolarHBondContact O-N 3.22Å; A164-R166 VanDerWaalsContact C-N 3.32Å; A164-R166 PolarHBondContact O-N 3.41Å; R166-N168 VanDerWaalsContact C-N 3.33Å; R166-D169 PolarHBondContact O-N 3.41Å; R166-Y170 WeakPolarHBondContact O-CD2 3.43Å; R166-Y170 WeakPolarHBondContact O-CE2 3.07Å; R166-Y190 HydrophobicContact CB-CD1 4.05Å; R166-Y190 HydrophobicContact CB-CE1 3.61Å; R166-Y190 HydrophobicContact CG-CE1 4.3Å
167	M	89.3	Confident	89	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-63.2	-40.8	174.8	-176.1	62	66	0	0	111.7	E138 V140 A163 A164 D169 Y170 I174 L186 Y190 F191	E138-M167 HydrophobicContact CG-CG 4.38Å; V140-M167 HydrophobicContact CB-CG 4.26Å; V140-M167 HydrophobicContact CG1-CG 4.23Å; V140-M167 HydrophobicContact CG1-SD 4.34Å; A163-M167 WeakPolarHBondContact O-CB 3.38Å; A163-M167 PolarHBondContact O-N 2.03Å; A164-M167 WeakPolarHBondContact O-CB 3.46Å; A164-M167 PolarHBondContact O-N 2.99Å; M167-D169 PolarHBondContact O-N 3.13Å; M167-Y170 PolarHBondContact O-N 2.89Å; M167-I174 HydrophobicContact SD-CD1 4.28Å; M167-L186 HydrophobicContact CE-CB 3.85Å; M167-L186 HydrophobicContact SD-CB 3.75Å; M167-L186 HydrophobicContact SD-CD1 4.29Å; M167-Y190 HydrophobicContact CE-CD2 3.71Å; M167-Y190 HydrophobicContact CE-CG 4.14Å; M167-F191 HydrophobicContact CB-CE2 4.29Å; M167-F191 HydrophobicContact CE-CD2 3.94Å; M167-F191 HydrophobicContact CE-CE2 4.01Å
168	N	88.3	Confident	88.9	Confident	85 Å²	85	69.9 Å²	69.9	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-63.5	-26.2	-177.5	-170.3	57.6	0	0	0	112.9	A164 K165 R166 Y170 R171	A164-N168 WeakPolarHBondContact O-CB 3.3Å; A164-N168 PolarHBondContact O-N 2.81Å; K165-N168 PolarHBondContact O-N 2.82Å; R166-N168 VanDerWaalsContact C-N 3.33Å; N168-Y170 PolarHBondContact O-N 3.31Å; N168-R171 WeakPolarHBondContact O-CB 3.4Å; N168-R171 PolarHBondContact O-N 3.07Å; N168-R171 VanDerWaalsContact O-N 3.08Å; N168-R171 VanDerWaalsContact OD1-CD 3.3Å; N168-R171 WeakPolarHBondContact OD1-CD 3.49Å
169	D	88	Confident	89.1	Confident	113 Å²	113	66.2 Å²	66.2	60%	0.604	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-28.3	173.9	-64.3	-25.2	0	0	0	112.1	R166 M167	R166-D169 PolarHBondContact O-N 3.41Å; M167-D169 PolarHBondContact O-N 3.13Å
170	Y	89.6	Confident	89	Confident	27 Å²	27	70.4 Å²	70.4	11%	0.106	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	0.6	177.4	-57.8	-78.2	0	0	0	113.7	R166 M167 N168 S172 L173 I174 L186 Y190 P230 L233	R166-Y170 WeakPolarHBondContact O-CD2 3.43Å; R166-Y170 WeakPolarHBondContact O-CE2 3.07Å; M167-Y170 PolarHBondContact O-N 2.89Å; N168-Y170 PolarHBondContact O-N 3.31Å; Y170-S172 VanDerWaalsContact C-N 3.28Å; Y170-S172 PolarHBondContact O-N 3.2Å; Y170-L173 HydrophobicContact CD1-CD2 4.43Å; Y170-L173 WeakPolarHBondContact O-CA 3.49Å; Y170-L173 WeakPolarHBondContact O-CB 3.01Å; Y170-L173 PolarHBondContact O-N 3.47Å; Y170-I174 WeakPolarHBondContact O-CG1 3.36Å; Y170-I174 PolarHBondContact O-N 3.11Å; Y170-L186 HydrophobicContact CD1-CD2 4.36Å; Y170-L186 HydrophobicContact CD2-CD1 4.31Å; Y170-L186 HydrophobicContact CD2-CD2 3.99Å; Y170-L186 HydrophobicContact CE2-CD2 4.21Å; Y170-L186 HydrophobicContact CG-CD1 3.89Å; Y170-L186 HydrophobicContact CG-CD2 4.07Å; Y170-Y190 HydrophobicContact CD2-CE2 4.22Å; Y170-Y190 AromaticContact CE2-CE2 3.73Å; Y170-Y190 HydrophobicContact CE2-CE2 3.73Å; Y170-Y190 AromaticContact CE2-CZ 3.91Å; Y170-Y190 WeakPolarHBondContact CE2-OH 3.18Å; Y170-Y190 PolarHBondContact OH-OH 2.92Å; Y170-P230 HydrophobicContact CE1-CG 4.2Å; Y170-P230 WeakPolarHBondContact OH-CG 3.25Å; Y170-L233 HydrophobicContact CE1-CD1 4.02Å
171	R	88.5	Confident	89	Confident	141 Å²	141	70.4 Å²	70.4	53%	0.532	36%	0.362	S	S	.	.	H	α-helix	trans	-56.3	-41	-175.4	-172.6	170	-175.1	163	2.4	112.8	N168 I174 N175	N168-R171 WeakPolarHBondContact O-CB 3.4Å; N168-R171 PolarHBondContact O-N 3.07Å; N168-R171 VanDerWaalsContact O-N 3.08Å; N168-R171 VanDerWaalsContact OD1-CD 3.3Å; N168-R171 WeakPolarHBondContact OD1-CD 3.49Å; R171-I174 PolarHBondContact O-N 3.37Å; R171-N175 WeakPolarHBondContact O-CB 3.45Å; R171-N175 PolarHBondContact O-N 3.29Å; R171-N175 PolarHBondContact O-ND2 3.02Å
172	S	84.8	Confident	89.1	Confident	93 Å²	93	64.5 Å²	64.5	65%	0.65	34%	0.335	S	S	*	.	H	α-helix	trans	-63.7	-40.3	174.8	-60	0	0	0	0	112.1	Y170 N175 V176	Y170-S172 VanDerWaalsContact C-N 3.28Å; Y170-S172 PolarHBondContact O-N 3.2Å; S172-N175 PolarHBondContact O-N 3.44Å; S172-V176 VanDerWaalsContact O-CG2 3.29Å; S172-V176 WeakPolarHBondContact O-CG2 3.17Å; S172-V176 PolarHBondContact O-N 2.97Å
173	L	86.2	Confident	89.1	Confident	21 Å²	21	63.8 Å²	63.8	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-70.8	-36.3	179.4	-167.6	65.8	0	0	0	111.8	Y170 V176 G177 L182 C218 I221 M222	Y170-L173 HydrophobicContact CD1-CD2 4.43Å; Y170-L173 WeakPolarHBondContact O-CA 3.49Å; Y170-L173 WeakPolarHBondContact O-CB 3.01Å; Y170-L173 PolarHBondContact O-N 3.47Å; L173-V176 PolarHBondContact O-N 3.23Å; L173-G177 PolarHBondContact O-N 2.87Å; L173-L182 HydrophobicContact CB-CD2 4.21Å; L173-L182 HydrophobicContact CD2-CD2 3.98Å; L173-L182 HydrophobicContact CG-CD2 3.7Å; L173-C218 HydrophobicContact CD2-CB 4.45Å; L173-I221 HydrophobicContact CD1-CG2 4.06Å; L173-M222 HydrophobicContact CD1-CG 4.26Å; L173-M222 HydrophobicContact CD2-CG 3.95Å; L173-M222 HydrophobicContact CD2-SD 3.86Å
174	I	87.5	Confident	89.1	Confident	34 Å²	34	64.7 Å²	64.7	17%	0.174	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-45.3	172	-65.4	168.2	0	0	0	110.2	V140 M167 Y170 R171 V176 G177 L182 L186	V140-I174 HydrophobicContact CG1-CD1 3.82Å; M167-I174 HydrophobicContact SD-CD1 4.28Å; Y170-I174 WeakPolarHBondContact O-CG1 3.36Å; Y170-I174 PolarHBondContact O-N 3.11Å; R171-I174 PolarHBondContact O-N 3.37Å; I174-V176 VanDerWaalsContact C-N 3.33Å; I174-V176 PolarHBondContact O-N 3.43Å; I174-G177 PolarHBondContact O-N 2.93Å; I174-G177 VanDerWaalsContact O-N 3.09Å; I174-L182 HydrophobicContact CG1-CD2 4.13Å; I174-L182 HydrophobicContact CG1-CG 4.43Å; I174-L186 HydrophobicContact CD1-CD1 3.87Å; I174-L186 HydrophobicContact CG1-CD1 3.93Å
175	N	86.4	Confident	89.2	Confident	126 Å²	126	63.7 Å²	63.7	67%	0.674	33%	0.326	S	S	*	.	H	α-helix	trans	-67.5	-29.7	179.3	-71.2	-12.4	0	0	0	113.6	R171 S172 G177	R171-N175 WeakPolarHBondContact O-CB 3.45Å; R171-N175 PolarHBondContact O-N 3.29Å; R171-N175 PolarHBondContact O-ND2 3.02Å; S172-N175 PolarHBondContact O-N 3.44Å; N175-G177 PolarHBondContact O-N 3Å
176	V	87.3	Confident	89.3	Confident	95 Å²	95	56.1 Å²	56.1	58%	0.576	29%	0.293	S	S	*	.	H	α-helix	trans	-68	-26.8	173	168.9	0	0	0	0	111.3	S172 L173 I174 I221	S172-V176 VanDerWaalsContact O-CG2 3.29Å; S172-V176 WeakPolarHBondContact O-CG2 3.17Å; S172-V176 PolarHBondContact O-N 2.97Å; L173-V176 PolarHBondContact O-N 3.23Å; I174-V176 VanDerWaalsContact C-N 3.33Å; I174-V176 PolarHBondContact O-N 3.43Å; V176-I221 HydrophobicContact CG1-CD1 4.32Å
177	G	86	Confident	89.4	Confident	49 Å²	49	50.6 Å²	50.6	51%	0.505	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	34.5	175.4	0	0	0	0	0	114.1	L173 I174 N175 S179	L173-G177 PolarHBondContact O-N 2.87Å; I174-G177 PolarHBondContact O-N 2.93Å; I174-G177 VanDerWaalsContact O-N 3.09Å; N175-G177 PolarHBondContact O-N 3Å; G177-S179 PolarHBondContact O-N 3.46Å
178	C	89.8	Confident	89.5	Confident	22 Å²	22	50.5 Å²	50.5	15%	0.149	27%	0.272	C	S	.	.	S	Bend	trans	-56.8	-33.6	-178.1	56.6	0	0	0	0	113.7	L182 K217 C218 I221	C178-L182 VanDerWaalsContact SG-CD2 3.56Å; C178-K217 VanDerWaalsContact O-CB 3.26Å; C178-K217 WeakPolarHBondContact O-CB 3.29Å; C178-C218 HydrophobicContact CB-CB 3.92Å; C178-C218 WeakPolarHBondContact CB-SG 3.29Å; C178-C218 WeakPolarHBondContact SG-CB 3.36Å; C178-C218 CovalentContact SG-SG 2.03Å; C178-C218 PolarHBondContact SG-SG 3.34Å; C178-I221 HydrophobicContact CB-CD1 3.45Å; C178-I221 VanDerWaalsContact CB-CD1 3.45Å
179	S	90.8	Very high	89.6	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.07	25%	0.251	C	S	.	.			trans	-141.7	135.3	169.7	176.6	0	0	0	0	109	G177 Y181 L182	G177-S179 PolarHBondContact O-N 3.46Å; S179-Y181 PolarHBondContact O-N 3.04Å; S179-Y181 VanDerWaalsContact O-N 3.12Å; S179-Y181 PolarHBondContact OG-N 2.99Å; S179-L182 VanDerWaalsContact O-CB 3.31Å; S179-L182 WeakPolarHBondContact O-CB 3.38Å; S179-L182 PolarHBondContact O-N 2.03Å
180	Q	89.2	Confident	89.8	Confident	136 Å²	136	41.5 Å²	41.5	64%	0.636	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.1	173.4	64.7	-176.5	1.8	0	0	112.9	D254	Q180-D254 PolarHBondContact NE2-OD2 3.46Å
181	Y	91.4	Very high	89.9	Confident	13 Å²	13	40.2 Å²	40.2	5%	0.051	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-3.5	177.8	-57.9	-56.2	0	0	0	114	S179 K183 F184 F185 L210 Y213 P248 N250 Y251 D254	S179-Y181 PolarHBondContact O-N 3.04Å; S179-Y181 VanDerWaalsContact O-N 3.12Å; S179-Y181 PolarHBondContact OG-N 2.99Å; Y181-K183 PolarHBondContact O-N 3.41Å; Y181-F184 PolarHBondContact O-N 3.36Å; Y181-F185 VanDerWaalsContact O-CB 3.3Å; Y181-F185 WeakPolarHBondContact O-CB 3.46Å; Y181-F185 PolarHBondContact O-N 3Å; Y181-L210 HydrophobicContact CD2-CD1 4.48Å; Y181-L210 HydrophobicContact CG-CD1 4.1Å; Y181-Y213 AromaticContact CD2-CD1 3.8Å; Y181-Y213 HydrophobicContact CD2-CD1 3.8Å; Y181-Y213 AromaticContact CD2-CE1 3.54Å; Y181-Y213 HydrophobicContact CD2-CE1 3.54Å; Y181-Y213 HydrophobicContact CE2-CD1 4.46Å; Y181-Y213 AromaticContact CE2-CE1 3.96Å; Y181-Y213 HydrophobicContact CE2-CE1 3.96Å; Y181-P248 HydrophobicContact CD1-CB 3.95Å; Y181-P248 HydrophobicContact CD1-CG 3.54Å; Y181-P248 HydrophobicContact CE1-CB 3.84Å; Y181-P248 HydrophobicContact CE1-CG 3.94Å; Y181-P248 HydrophobicContact CG-CG 4.36Å; Y181-N250 PolarHBondContact OH-O 2.99Å; Y181-N250 VanDerWaalsContact OH-O 3.04Å; Y181-Y251 HydrophobicContact CD2-CD2 4.16Å; Y181-Y251 HydrophobicContact CE2-CD2 4.08Å; Y181-D254 HydrophobicContact CE2-CB 4.41Å; Y181-D254 WeakPolarHBondContact CE2-OD2 3.37Å; Y181-D254 PolarHBondContact OH-OD2 2.03Å
182	L	92.8	Very high	90	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.016	19%	0.194	C	C	.	.	H	α-helix	trans	-60.2	-47.3	-177.8	177	65.5	0	0	0	111.9	L173 I174 C178 S179 F184 F185 L186 V214	L173-L182 HydrophobicContact CB-CD2 4.21Å; L173-L182 HydrophobicContact CD2-CD2 3.98Å; L173-L182 HydrophobicContact CG-CD2 3.7Å; I174-L182 HydrophobicContact CG1-CD2 4.13Å; I174-L182 HydrophobicContact CG1-CG 4.43Å; C178-L182 VanDerWaalsContact SG-CD2 3.56Å; S179-L182 VanDerWaalsContact O-CB 3.31Å; S179-L182 WeakPolarHBondContact O-CB 3.38Å; S179-L182 PolarHBondContact O-N 2.03Å; L182-F184 VanDerWaalsContact C-N 3.35Å; L182-F184 PolarHBondContact O-N 3.48Å; L182-F185 PolarHBondContact O-N 2.78Å; L182-L186 HydrophobicContact CD1-CD1 3.82Å; L182-L186 HydrophobicContact CD1-CG 3.95Å; L182-L186 HydrophobicContact CD2-CD1 4.46Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.37Å; L182-L186 WeakPolarHBondContact O-CG 3.31Å; L182-L186 PolarHBondContact O-N 3.41Å; L182-V214 HydrophobicContact CB-CG1 4.19Å; L182-V214 HydrophobicContact CD1-CG1 3.55Å; L182-V214 HydrophobicContact CG-CG1 4.49Å
183	K	91.4	Very high	90.1	Very high	75 Å²	75	30.8 Å²	30.8	33%	0.326	17%	0.17	S	C	.	.	H	α-helix	trans	-56.7	-49.2	179.2	-177	-173.8	-178.6	-173.8	0	111.2	V140 H142 Y181 C187	V140-K183 HydrophobicContact CG1-CG 4.48Å; V140-K183 WeakPolarHBondContact O-CE 3.04Å; V140-K183 PolarHBondContact O-NZ 3.29Å; H142-K183 PolarHBondContact O-NZ 3.44Å; Y181-K183 PolarHBondContact O-N 3.41Å; K183-C187 WeakPolarHBondContact O-CB 3.1Å; K183-C187 PolarHBondContact O-N 3.31Å; K183-C187 VanDerWaalsContact O-N 3.09Å; K183-C187 PolarHBondContact O-SG 2.8Å
184	F	91.5	Very high	90	Very high	18 Å²	18	30 Å²	30	8%	0.079	17%	0.167	C	C	.	.	H	α-helix	trans	-61.8	-47.1	178	-177.6	-86.5	0	0	0	111.7	L144 Y181 L182 L186 C187 T188 L210 I246 P248	L144-F184 HydrophobicContact CD2-CD2 3.9Å; Y181-F184 PolarHBondContact O-N 3.36Å; L182-F184 VanDerWaalsContact C-N 3.35Å; L182-F184 PolarHBondContact O-N 3.48Å; F184-L186 PolarHBondContact O-N 2.94Å; F184-C187 PolarHBondContact O-N 3.49Å; F184-T188 HydrophobicContact CD1-CG2 3.98Å; F184-T188 HydrophobicContact CE1-CG2 3.64Å; F184-T188 HydrophobicContact CE2-CG2 4.5Å; F184-T188 HydrophobicContact CZ-CG2 3.95Å; F184-T188 WeakPolarHBondContact O-CG2 3.03Å; F184-T188 PolarHBondContact O-N 3.41Å; F184-T188 PolarHBondContact O-OG1 3.23Å; F184-L210 HydrophobicContact CD1-CD2 3.99Å; F184-L210 HydrophobicContact CE1-CD2 4.06Å; F184-I246 HydrophobicContact CE1-CG1 4.18Å; F184-I246 HydrophobicContact CZ-CD1 3.85Å; F184-I246 HydrophobicContact CZ-CG1 3.7Å; F184-P248 HydrophobicContact CB-CG 4.36Å; F184-P248 HydrophobicContact CD1-CG 3.54Å; F184-P248 HydrophobicContact CD2-CG 4.24Å; F184-P248 VanDerWaalsContact CE1-CD 3.44Å; F184-P248 HydrophobicContact CE1-CG 3.73Å; F184-P248 HydrophobicContact CE2-CG 4.41Å; F184-P248 HydrophobicContact CG-CG 3.8Å; F184-P248 HydrophobicContact CZ-CG 4.14Å
185	F	93.1	Very high	89.5	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.9	-43.3	-179.5	172.5	-105.7	0	0	0	112.9	Y181 L182 T188 I189 P206 C211 V214 W229 L233 L238	Y181-F185 VanDerWaalsContact O-CB 3.3Å; Y181-F185 WeakPolarHBondContact O-CB 3.46Å; Y181-F185 PolarHBondContact O-N 3Å; L182-F185 PolarHBondContact O-N 2.78Å; F185-T188 PolarHBondContact O-OG1 3.37Å; F185-I189 HydrophobicContact CD1-CD1 4.4Å; F185-I189 HydrophobicContact CD2-CD1 4.2Å; F185-I189 HydrophobicContact CE1-CD1 3.8Å; F185-I189 HydrophobicContact CE2-CD1 3.54Å; F185-I189 HydrophobicContact CZ-CD1 3.32Å; F185-I189 WeakPolarHBondContact O-CG1 3.25Å; F185-I189 PolarHBondContact O-N 2.87Å; F185-P206 HydrophobicContact CD2-CB 3.89Å; F185-P206 HydrophobicContact CD2-CG 3.9Å; F185-P206 HydrophobicContact CE2-CB 4.15Å; F185-P206 HydrophobicContact CE2-CG 3.8Å; F185-C211 HydrophobicContact CD2-CB 4.35Å; F185-C211 HydrophobicContact CE2-CB 3.5Å; F185-C211 HydrophobicContact CZ-CB 3.93Å; F185-C211 WeakPolarHBondContact CZ-SG 3.44Å; F185-V214 HydrophobicContact CB-CG2 4.05Å; F185-V214 HydrophobicContact CD1-CB 4.4Å; F185-V214 HydrophobicContact CD1-CG1 3.97Å; F185-V214 HydrophobicContact CG-CB 4.46Å; F185-V214 HydrophobicContact CG-CG1 4.4Å; F185-V214 HydrophobicContact CG-CG2 4.31Å; F185-W229 HydrophobicContact CE1-CH2 4.32Å; F185-W229 AromaticContact CE1-CZ2 3.95Å; F185-W229 HydrophobicContact CE1-CZ2 3.95Å; F185-W229 HydrophobicContact CZ-CZ2 4.42Å; F185-L233 HydrophobicContact CE1-CB 4.33Å; F185-L233 HydrophobicContact CE1-CD1 4.4Å; F185-L233 HydrophobicContact CE1-CD2 4.1Å; F185-L233 HydrophobicContact CZ-CB 4.43Å; F185-L233 HydrophobicContact CZ-CD2 4.43Å; F185-L238 HydrophobicContact CE2-CD1 3.99Å
186	L	93.2	Very high	88.7	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-66.9	-43	177	-68.9	170.8	0	0	0	111.1	M167 Y170 I174 L182 F184 T188 I189 Y190 L233	M167-L186 HydrophobicContact CE-CB 3.85Å; M167-L186 HydrophobicContact SD-CB 3.75Å; M167-L186 HydrophobicContact SD-CD1 4.29Å; Y170-L186 HydrophobicContact CD1-CD2 4.36Å; Y170-L186 HydrophobicContact CD2-CD1 4.31Å; Y170-L186 HydrophobicContact CD2-CD2 3.99Å; Y170-L186 HydrophobicContact CE2-CD2 4.21Å; Y170-L186 HydrophobicContact CG-CD1 3.89Å; Y170-L186 HydrophobicContact CG-CD2 4.07Å; I174-L186 HydrophobicContact CD1-CD1 3.87Å; I174-L186 HydrophobicContact CG1-CD1 3.93Å; L182-L186 HydrophobicContact CD1-CD1 3.82Å; L182-L186 HydrophobicContact CD1-CG 3.95Å; L182-L186 HydrophobicContact CD2-CD1 4.46Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.37Å; L182-L186 WeakPolarHBondContact O-CG 3.31Å; L182-L186 PolarHBondContact O-N 3.41Å; F184-L186 PolarHBondContact O-N 2.94Å; L186-T188 PolarHBondContact O-N 3.49Å; L186-I189 PolarHBondContact O-N 3.31Å; L186-Y190 HydrophobicContact CD2-CE2 4.13Å; L186-Y190 WeakPolarHBondContact O-CD2 3.42Å; L186-Y190 PolarHBondContact O-N 3.4Å; L186-L233 HydrophobicContact CD2-CD1 3.93Å; L186-L233 HydrophobicContact CD2-CD2 4.27Å
187	C	93	Very high	87.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.4	-37.7	179.4	-68.3	0	0	0	0	112.3	C141 L144 Y146 K183 F184 I189 F191	C141-C187 WeakPolarHBondContact CA-SG 3.49Å; C141-C187 HydrophobicContact CB-CB 3.88Å; C141-C187 WeakPolarHBondContact CB-SG 3.06Å; C141-C187 WeakPolarHBondContact SG-CB 3.38Å; C141-C187 CovalentContact SG-SG 2.04Å; C141-C187 PolarHBondContact SG-SG 2.82Å; L144-C187 HydrophobicContact CD1-CB 3.32Å; Y146-C187 VanDerWaalsContact OH-C 3.31Å; Y146-C187 PolarHBondContact OH-O 2.99Å; K183-C187 WeakPolarHBondContact O-CB 3.1Å; K183-C187 PolarHBondContact O-N 3.31Å; K183-C187 VanDerWaalsContact O-N 3.09Å; K183-C187 PolarHBondContact O-SG 2.8Å; F184-C187 PolarHBondContact O-N 3.49Å; C187-I189 PolarHBondContact O-N 3.22Å; C187-F191 CarbonylContact O-C 3.55Å; C187-F191 WeakPolarHBondContact O-CA 3.46Å; C187-F191 WeakPolarHBondContact O-CB 3.37Å; C187-F191 PolarHBondContact O-N 2.95Å
188	T	90.5	Very high	86.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-69	-16.3	176.1	52.9	0	0	0	0	114	Y146 F184 F185 L186 P192 I246	Y146-T188 HydrophobicContact CE1-CG2 4.13Å; Y146-T188 PolarHBondContact OH-N 2.69Å; F184-T188 HydrophobicContact CD1-CG2 3.98Å; F184-T188 HydrophobicContact CE1-CG2 3.64Å; F184-T188 HydrophobicContact CE2-CG2 4.5Å; F184-T188 HydrophobicContact CZ-CG2 3.95Å; F184-T188 WeakPolarHBondContact O-CG2 3.03Å; F184-T188 PolarHBondContact O-N 3.41Å; F184-T188 PolarHBondContact O-OG1 3.23Å; F185-T188 PolarHBondContact O-OG1 3.37Å; L186-T188 PolarHBondContact O-N 3.49Å; T188-P192 WeakPolarHBondContact O-CA 3.23Å; T188-I246 HydrophobicContact CG2-CD1 4.24Å; T188-I246 HydrophobicContact CG2-CG2 3.69Å
189	I	91.5	Very high	85	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.015	21%	0.209	C	C	.	.	H	α-helix	trans	-90.7	-50.4	175	-68.5	175.7	0	0	0	111.4	V155 F185 L186 C187 P206 L233	V155-I189 HydrophobicContact CG1-CG2 3.77Å; F185-I189 HydrophobicContact CD1-CD1 4.4Å; F185-I189 HydrophobicContact CD2-CD1 4.2Å; F185-I189 HydrophobicContact CE1-CD1 3.8Å; F185-I189 HydrophobicContact CE2-CD1 3.54Å; F185-I189 HydrophobicContact CZ-CD1 3.32Å; F185-I189 WeakPolarHBondContact O-CG1 3.25Å; F185-I189 PolarHBondContact O-N 2.87Å; L186-I189 PolarHBondContact O-N 3.31Å; C187-I189 PolarHBondContact O-N 3.22Å; I189-P206 HydrophobicContact CD1-CG 4.02Å; I189-P206 HydrophobicContact CG1-CG 3.67Å; I189-L233 HydrophobicContact CD1-CD2 3.43Å; I189-L233 VanDerWaalsContact CD1-CD2 3.43Å; I189-L233 HydrophobicContact CG2-CD2 4.12Å
190	Y	92.3	Very high	83.3	Confident	6 Å²	6	42 Å²	42	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-84.8	-29.3	-175.4	-70	-68.8	0	0	0	113.3	N153 V155 L157 R166 M167 Y170 L186	N153-Y190 PolarHBondContact ND2-O 3.14Å; V155-Y190 HydrophobicContact CG2-CD1 3.84Å; V155-Y190 HydrophobicContact CG2-CE1 3.9Å; L157-Y190 HydrophobicContact CD1-CD1 4.04Å; L157-Y190 HydrophobicContact CD1-CE1 4.32Å; R166-Y190 HydrophobicContact CB-CD1 4.05Å; R166-Y190 HydrophobicContact CB-CE1 3.61Å; R166-Y190 HydrophobicContact CG-CE1 4.3Å; M167-Y190 HydrophobicContact CE-CD2 3.71Å; M167-Y190 HydrophobicContact CE-CG 4.14Å; Y170-Y190 HydrophobicContact CD2-CE2 4.22Å; Y170-Y190 AromaticContact CE2-CE2 3.73Å; Y170-Y190 HydrophobicContact CE2-CE2 3.73Å; Y170-Y190 AromaticContact CE2-CZ 3.91Å; Y170-Y190 WeakPolarHBondContact CE2-OH 3.18Å; Y170-Y190 PolarHBondContact OH-OH 2.92Å; L186-Y190 HydrophobicContact CD2-CE2 4.13Å; L186-Y190 WeakPolarHBondContact O-CD2 3.42Å; L186-Y190 PolarHBondContact O-N 3.4Å
191	F	91.8	Very high	81.8	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-130.3	61.2	179.4	-61.5	-90.3	0	0	0	109.9	I136 E138 C141 Y146 T149 Q160 A163 A164 M167 C187	I136-F191 HydrophobicContact CD1-CB 4.44Å; I136-F191 HydrophobicContact CG2-CD1 4.12Å; I136-F191 HydrophobicContact CG2-CG 4.49Å; E138-F191 HydrophobicContact CB-CD1 4.49Å; E138-F191 HydrophobicContact CB-CE1 3.76Å; E138-F191 HydrophobicContact CB-CE2 3.81Å; E138-F191 HydrophobicContact CB-CZ 3.37Å; E138-F191 HydrophobicContact CG-CE2 3.79Å; E138-F191 HydrophobicContact CG-CZ 3.79Å; C141-F191 HydrophobicContact CB-CD2 4.43Å; C141-F191 VanDerWaalsContact SG-CD2 3.57Å; Y146-F191 WeakPolarHBondContact CE2-O 3.19Å; Y146-F191 PolarHBondContact OH-O 3.37Å; T149-F191 HydrophobicContact CG2-CD1 4.27Å; T149-F191 WeakPolarHBondContact OG1-CA 3.07Å; T149-F191 PolarHBondContact OG1-O 3.49Å; Q160-F191 HydrophobicContact CB-CE1 4.14Å; Q160-F191 HydrophobicContact CG-CE1 4.21Å; A163-F191 HydrophobicContact CB-CE1 4.01Å; A163-F191 HydrophobicContact CB-CE2 4.05Å; A163-F191 HydrophobicContact CB-CZ 3.68Å; A164-F191 HydrophobicContact CB-CZ 4.23Å; M167-F191 HydrophobicContact CB-CE2 4.29Å; M167-F191 HydrophobicContact CE-CD2 3.94Å; M167-F191 HydrophobicContact CE-CE2 4.01Å; C187-F191 CarbonylContact O-C 3.55Å; C187-F191 WeakPolarHBondContact O-CA 3.46Å; C187-F191 WeakPolarHBondContact O-CB 3.37Å; C187-F191 PolarHBondContact O-N 2.95Å
192	P	90	Very high	80.6	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.013	24%	0.235	C	C	.	.			trans	-58.8	145.7	-175.3	27.3	-35.6	0	0	0	111.1	T149 W150 N153 T188 A203	T149-P192 WeakPolarHBondContact CA-O 3.25Å; T149-P192 WeakPolarHBondContact CB-O 3.37Å; T149-P192 WeakPolarHBondContact OG1-CD 3.39Å; T149-P192 PolarHBondContact OG1-O 3.23Å; W150-P192 HydrophobicContact CB-CG 4.38Å; W150-P192 PolarHBondContact N-O 3.2Å; N153-P192 HydrophobicContact CB-CG 4.03Å; T188-P192 WeakPolarHBondContact O-CA 3.23Å; P192-A203 HydrophobicContact CB-CB 4.17Å; P192-A203 HydrophobicContact CG-CB 4.31Å
193	M	86	Confident	79.6	Confident	33 Å²	33	40.6 Å²	40.6	16%	0.163	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-59.9	141.4	-179.8	65	171.2	-91	0	0	111.4	Y146 T195 L204 I246	Y146-M193 HydrophobicContact CD1-CB 3.85Å; Y146-M193 HydrophobicContact CD2-CB 3.67Å; Y146-M193 HydrophobicContact CE1-CB 4.28Å; Y146-M193 HydrophobicContact CE2-CB 4.12Å; Y146-M193 HydrophobicContact CG-CB 3.52Å; M193-T195 HydrophobicContact CE-CG2 4.02Å; M193-L204 HydrophobicContact CE-CD1 3.64Å; M193-L204 HydrophobicContact CG-CB 4.05Å; M193-L204 HydrophobicContact CG-CD1 4.16Å; M193-L204 HydrophobicContact SD-CB 4.16Å; M193-L204 HydrophobicContact SD-CD1 3.83Å; M193-L204 HydrophobicContact SD-CG 4.41Å; M193-I246 HydrophobicContact CG-CD1 4.36Å; M193-I246 HydrophobicContact SD-CD1 3.69Å
194	C	84	Confident	79.1	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.034	24%	0.243	C	C	.	.			trans	-129.4	141.3	168	176.1	0	0	0	0	109.2	C133 H148 T149 W150	C133-C194 WeakPolarHBondContact CA-SG 3.49Å; C133-C194 HydrophobicContact CB-CB 4.13Å; C133-C194 WeakPolarHBondContact CB-SG 3.41Å; C133-C194 WeakPolarHBondContact SG-CB 3.37Å; C133-C194 CovalentContact SG-SG 2.02Å; C133-C194 PolarHBondContact SG-SG 3.02Å; H148-C194 PolarHBondContact O-N 3.09Å; T149-C194 VanDerWaalsContact C-CB 3.47Å; W150-C194 HydrophobicContact CB-CB 3.99Å
195	T	76.7	Confident	78.9	Confident	44 Å²	44	40.3 Å²	40.3	27%	0.27	25%	0.253	S	S	.	.			trans	-118.3	118	173.9	49.2	0	0	0	0	108.4	M193 A197 L198	M193-T195 HydrophobicContact CE-CG2 4.02Å; T195-A197 PolarHBondContact O-N 3.31Å; T195-L198 PolarHBondContact O-N 2.85Å; T195-L198 VanDerWaalsContact OG1-CD1 3.22Å; T195-L198 WeakPolarHBondContact OG1-CD1 3.4Å
196	P	70.1	Confident	78.7	Confident	84 Å²	84	40.3 Å²	40.3	55%	0.545	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-17.3	177.6	-20.8	30.6	0	0	0	113.3	C133	C133-P196 HydrophobicContact CB-CG 4.43Å
197	A	63.2	Low	78.6	Confident	99 Å²	99	40.5 Å²	40.5	82%	0.818	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-10.9	-178.3	0	0	0	0	0	114.2	T195	T195-A197 PolarHBondContact O-N 3.31Å
198	L	62.4	Low	78.6	Confident	96 Å²	96	42.6 Å²	42.6	50%	0.503	26%	0.264	S	S	.	.	S	Bend	trans	-105.9	121.6	178.9	-81.6	165.2	0	0	0	109.4	T195 P200 P201	T195-L198 PolarHBondContact O-N 2.85Å; T195-L198 VanDerWaalsContact OG1-CD1 3.22Å; T195-L198 WeakPolarHBondContact OG1-CD1 3.4Å; L198-P200 CarbonylContact O-C 3.13Å; L198-P201 VanDerWaalsContact O-CA 3.25Å; L198-P201 WeakPolarHBondContact O-CA 3.02Å; L198-P201 WeakPolarHBondContact O-CD 3.42Å; L198-P201 WeakPolarHBondContact O-CG 3.07Å
199	N	59.3	Low	78.6	Confident	153 Å²	153	44.5 Å²	44.5	82%	0.818	27%	0.274	S	S	*	.	S	Bend	trans	-113.5	114.9	171.7	-81.6	-21.9	0	0	0	109
200	P	56.1	Low	78.6	Confident	113 Å²	113	44.3 Å²	44.3	73%	0.734	27%	0.273	S	S	*	.	S	Bend	cis	-74.7	149.6	-3.5	31.2	-33.5	0	0	0	111.7	L198 A202	L198-P200 CarbonylContact O-C 3.13Å; P200-A202 PolarHBondContact O-N 3.2Å
201	P	58	Low	78.7	Confident	30 Å²	30	44 Å²	44	20%	0.195	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-65.1	128.3	177.1	-18.7	31.7	0	0	0	110	W150 L198	W150-P201 HydrophobicContact CE3-CB 3.84Å; W150-P201 HydrophobicContact CE3-CG 4.34Å; W150-P201 HydrophobicContact CH2-CB 3.77Å; W150-P201 HydrophobicContact CH2-CG 3.75Å; W150-P201 HydrophobicContact CZ3-CB 3.37Å; W150-P201 HydrophobicContact CZ3-CG 3.44Å; W150-P201 VanDerWaalsContact CZ3-CG 3.44Å; L198-P201 VanDerWaalsContact O-CA 3.25Å; L198-P201 WeakPolarHBondContact O-CA 3.02Å; L198-P201 WeakPolarHBondContact O-CD 3.42Å; L198-P201 WeakPolarHBondContact O-CG 3.07Å
202	A	64.7	Low	78.8	Confident	47 Å²	47	48.7 Å²	48.7	39%	0.388	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-99.3	123.9	178	0	0	0	0	0	110.4	P200 L204	P200-A202 PolarHBondContact O-N 3.2Å; A202-L204 PolarHBondContact O-N 2.92Å
203	A	73.6	Confident	78.8	Confident	45 Å²	45	50.4 Å²	50.4	37%	0.372	30%	0.296	S	S	.	.			trans	-82	108.7	168.2	0	0	0	0	0	109.4	W150 P192	W150-A203 HydrophobicContact CB-CB 4.03Å; W150-A203 HydrophobicContact CG-CB 4.06Å; P192-A203 HydrophobicContact CB-CB 4.17Å; P192-A203 HydrophobicContact CG-CB 4.31Å
204	L	79.9	Confident	79.2	Confident	26 Å²	26	48.8 Å²	48.8	14%	0.136	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-80.9	130.5	176.2	-79.5	92.7	0	0	0	111.3	M193 A202 M244 I246	M193-L204 HydrophobicContact CE-CD1 3.64Å; M193-L204 HydrophobicContact CG-CB 4.05Å; M193-L204 HydrophobicContact CG-CD1 4.16Å; M193-L204 HydrophobicContact SD-CB 4.16Å; M193-L204 HydrophobicContact SD-CD1 3.83Å; M193-L204 HydrophobicContact SD-CG 4.41Å; A202-L204 PolarHBondContact O-N 2.92Å; L204-M244 HydrophobicContact CD2-CG 3.71Å; L204-M244 HydrophobicContact CD2-SD 4.32Å; L204-M244 HydrophobicContact CG-CG 4.41Å; L204-I246 HydrophobicContact CB-CB 4.22Å; L204-I246 HydrophobicContact CB-CG2 4.22Å; L204-I246 HydrophobicContact CD2-CB 4.47Å
205	Q	87	Confident	79.7	Confident	60 Å²	60	49.7 Å²	49.7	28%	0.28	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-88.1	154	172.1	-68.5	-164.7	-50.7	0	0	112	S154 L238 P239 C245 I246	S154-Q205 PolarHBondContact OG-NE2 3.26Å; Q205-L238 HydrophobicContact CB-CD2 4.02Å; Q205-P239 HydrophobicContact CB-CG 4.27Å; Q205-C245 WeakPolarHBondContact O-CA 2.97Å; Q205-I246 WeakPolarHBondContact O-CG2 3.34Å; Q205-I246 PolarHBondContact O-N 3.25Å
206	P	89.9	Confident	80.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-63.1	146.5	175.5	23	-30.7	0	0	0	112.3	F185 I189 L210 L238 I246	F185-P206 HydrophobicContact CD2-CB 3.89Å; F185-P206 HydrophobicContact CD2-CG 3.9Å; F185-P206 HydrophobicContact CE2-CB 4.15Å; F185-P206 HydrophobicContact CE2-CG 3.8Å; I189-P206 HydrophobicContact CD1-CG 4.02Å; I189-P206 HydrophobicContact CG1-CG 3.67Å; P206-L210 HydrophobicContact CB-CD2 4.15Å; P206-L238 HydrophobicContact CG-CD1 3.97Å; P206-L238 HydrophobicContact CG-CD2 3.94Å; P206-I246 VanDerWaalsContact CA-O 3.32Å; P206-I246 WeakPolarHBondContact CA-O 3.34Å
207	C	91.6	Very high	81.4	Confident	4 Å²	4	50.4 Å²	50.4	3%	0.027	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-62.9	142.9	176.3	-58.1	0	0	0	0	112	N209 L210 C211 C245 I246 Q247	C207-N209 VanDerWaalsContact C-N 3.26Å; C207-N209 PolarHBondContact O-N 3.37Å; C207-L210 HydrophobicContact CB-CB 4.44Å; C207-L210 WeakPolarHBondContact O-CB 3.38Å; C207-L210 PolarHBondContact O-N 3Å; C207-L210 VanDerWaalsContact O-N 3.14Å; C207-C211 PolarHBondContact O-N 3.39Å; C207-C211 VanDerWaalsContact O-N 3.14Å; C207-C245 WeakPolarHBondContact CA-SG 3.47Å; C207-C245 HydrophobicContact CB-CB 3.91Å; C207-C245 WeakPolarHBondContact CB-SG 3.48Å; C207-C245 WeakPolarHBondContact SG-CB 3.36Å; C207-C245 CovalentContact SG-SG 2.03Å; C207-C245 PolarHBondContact SG-SG 3.42Å; C207-I246 PolarHBondContact N-O 3.45Å; C207-I246 VanDerWaalsContact N-O 3.11Å; C207-Q247 HydrophobicContact CB-CB 4.37Å
208	Q	92.3	Very high	82.8	Confident	44 Å²	44	45.7 Å²	45.7	21%	0.206	25%	0.252	C	S	.	.	H	α-helix	trans	-55	-39	179.2	173.7	165.1	57	0	0	113	C211 R212 C235 L238 P239	Q208-C211 WeakPolarHBondContact O-CB 3.22Å; Q208-C211 PolarHBondContact O-N 3.24Å; Q208-R212 WeakPolarHBondContact O-CG 3.25Å; Q208-R212 PolarHBondContact O-N 2.64Å; Q208-C235 WeakPolarHBondContact CG-O 3.47Å; Q208-C235 PolarHBondContact NE2-O 3.04Å; Q208-L238 HydrophobicContact CB-CB 4.37Å; Q208-P239 VanDerWaalsContact CB-O 3.32Å; Q208-P239 WeakPolarHBondContact CB-O 3.49Å; Q208-P239 PolarHBondContact N-O 3.49Å
209	N	90.5	Very high	84.2	Confident	40 Å²	40	43 Å²	43	21%	0.214	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-40.7	179.9	-72.4	-14.5	0	0	0	112.1	C207 C211 R212 Y213 E241 Y251	C207-N209 VanDerWaalsContact C-N 3.26Å; C207-N209 PolarHBondContact O-N 3.37Å; N209-C211 VanDerWaalsContact C-N 3.32Å; N209-C211 PolarHBondContact O-N 2.98Å; N209-R212 PolarHBondContact O-N 2.67Å; N209-Y213 PolarHBondContact O-N 2.86Å; N209-E241 PolarHBondContact ND2-OE1 3.23Å; N209-Y251 HydrophobicContact CB-CE1 4.07Å; N209-Y251 WeakPolarHBondContact CB-OH 3.41Å; N209-Y251 PolarHBondContact O-OH 3.04Å
210	L	91.4	Very high	85.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.3	-45.8	173	179.5	68	0	0	0	111.1	Y181 F184 P206 C207 R212 Y213 V214 Q247 P248 Y251	Y181-L210 HydrophobicContact CD2-CD1 4.48Å; Y181-L210 HydrophobicContact CG-CD1 4.1Å; F184-L210 HydrophobicContact CD1-CD2 3.99Å; F184-L210 HydrophobicContact CE1-CD2 4.06Å; P206-L210 HydrophobicContact CB-CD2 4.15Å; C207-L210 HydrophobicContact CB-CB 4.44Å; C207-L210 WeakPolarHBondContact O-CB 3.38Å; C207-L210 PolarHBondContact O-N 3Å; C207-L210 VanDerWaalsContact O-N 3.14Å; L210-R212 PolarHBondContact O-N 2.98Å; L210-Y213 PolarHBondContact O-N 3.21Å; L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 3.41Å; L210-Q247 HydrophobicContact CD2-CB 4.35Å; L210-P248 HydrophobicContact CD1-CG 4.16Å; L210-P248 HydrophobicContact CD2-CG 4.44Å; L210-Y251 HydrophobicContact CD1-CD2 3.57Å; L210-Y251 HydrophobicContact CD1-CE2 3.99Å; L210-Y251 HydrophobicContact CD1-CG 3.97Å
211	C	94.1	Very high	87.2	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.9	-48	175.8	-177	0	0	0	0	111.7	F185 C207 Q208 N209 Y213 V214 Q215 L233 C235 L238	F185-C211 HydrophobicContact CD2-CB 4.35Å; F185-C211 HydrophobicContact CE2-CB 3.5Å; F185-C211 HydrophobicContact CZ-CB 3.93Å; F185-C211 WeakPolarHBondContact CZ-SG 3.44Å; C207-C211 PolarHBondContact O-N 3.39Å; C207-C211 VanDerWaalsContact O-N 3.14Å; Q208-C211 WeakPolarHBondContact O-CB 3.22Å; Q208-C211 PolarHBondContact O-N 3.24Å; N209-C211 VanDerWaalsContact C-N 3.32Å; N209-C211 PolarHBondContact O-N 2.98Å; C211-Y213 VanDerWaalsContact C-N 3.26Å; C211-Y213 PolarHBondContact O-N 3.39Å; C211-V214 PolarHBondContact O-N 2.95Å; C211-Q215 WeakPolarHBondContact O-CB 3.34Å; C211-Q215 PolarHBondContact O-N 3.39Å; C211-L233 PolarHBondContact SG-O 3.4Å; C211-L233 VanDerWaalsContact SG-O 3.41Å; C211-C235 HydrophobicContact CB-CB 3.64Å; C211-C235 WeakPolarHBondContact CB-SG 3.5Å; C211-C235 PolarHBondContact O-SG 2.93Å; C211-C235 VanDerWaalsContact O-SG 3.41Å; C211-C235 WeakPolarHBondContact SG-CA 3.11Å; C211-C235 WeakPolarHBondContact SG-CB 3.1Å; C211-C235 CovalentContact SG-SG 2.03Å; C211-C235 PolarHBondContact SG-SG 2.69Å; C211-L238 HydrophobicContact CB-CD1 3.49Å; C211-L238 VanDerWaalsContact CB-CD1 3.49Å
212	R	93.8	Very high	88.6	Confident	98 Å²	98	36.1 Å²	36.1	37%	0.37	20%	0.195	S	C	.	.	H	α-helix	trans	-60.3	-36.9	179.5	-71.1	-62.1	-171.3	-173.7	5	112.8	Q208 N209 L210 S216 C235	Q208-R212 WeakPolarHBondContact O-CG 3.25Å; Q208-R212 PolarHBondContact O-N 2.64Å; N209-R212 PolarHBondContact O-N 2.67Å; L210-R212 PolarHBondContact O-N 2.98Å; R212-S216 WeakPolarHBondContact O-CB 3.19Å; R212-S216 PolarHBondContact O-N 3.45Å; R212-C235 HydrophobicContact CG-CB 4.08Å; R212-C235 PolarHBondContact N-SG 3.09Å
213	Y	91.2	Very high	89.7	Confident	37 Å²	37	39.6 Å²	39.6	15%	0.145	20%	0.202	C	C	.	.	H	α-helix	trans	-68.2	-46.4	176.1	-178.5	-87.5	0	0	0	112.2	Y181 N209 L210 C211 Q215 S216 K217 Y251	Y181-Y213 AromaticContact CD2-CD1 3.8Å; Y181-Y213 HydrophobicContact CD2-CD1 3.8Å; Y181-Y213 AromaticContact CD2-CE1 3.54Å; Y181-Y213 HydrophobicContact CD2-CE1 3.54Å; Y181-Y213 HydrophobicContact CE2-CD1 4.46Å; Y181-Y213 AromaticContact CE2-CE1 3.96Å; Y181-Y213 HydrophobicContact CE2-CE1 3.96Å; N209-Y213 PolarHBondContact O-N 2.86Å; L210-Y213 PolarHBondContact O-N 3.21Å; C211-Y213 VanDerWaalsContact C-N 3.26Å; C211-Y213 PolarHBondContact O-N 3.39Å; Y213-Q215 VanDerWaalsContact C-N 3.33Å; Y213-S216 PolarHBondContact O-N 3.24Å; Y213-S216 PolarHBondContact O-OG 3.11Å; Y213-K217 HydrophobicContact CE1-CG 4.45Å; Y213-K217 PolarHBondContact O-N 2.65Å; Y213-Y251 HydrophobicContact CD1-CE2 4.23Å; Y213-Y251 HydrophobicContact CD2-CE2 4.2Å; Y213-Y251 AromaticContact CG-CE2 3.76Å; Y213-Y251 HydrophobicContact CG-CE2 3.76Å
214	V	93.4	Very high	90.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-43.1	176.1	175.4	0	0	0	0	110.3	L182 F185 L210 C211 S216 K217 C218 W229	L182-V214 HydrophobicContact CB-CG1 4.19Å; L182-V214 HydrophobicContact CD1-CG1 3.55Å; L182-V214 HydrophobicContact CG-CG1 4.49Å; F185-V214 HydrophobicContact CB-CG2 4.05Å; F185-V214 HydrophobicContact CD1-CB 4.4Å; F185-V214 HydrophobicContact CD1-CG1 3.97Å; F185-V214 HydrophobicContact CG-CB 4.46Å; F185-V214 HydrophobicContact CG-CG1 4.4Å; F185-V214 HydrophobicContact CG-CG2 4.31Å; L210-V214 WeakPolarHBondContact O-CG2 3.38Å; L210-V214 PolarHBondContact O-N 3.41Å; C211-V214 PolarHBondContact O-N 2.95Å; V214-S216 PolarHBondContact O-N 3.31Å; V214-K217 PolarHBondContact O-N 3.43Å; V214-C218 VanDerWaalsContact O-CB 3.25Å; V214-C218 WeakPolarHBondContact O-CB 3.29Å; V214-C218 PolarHBondContact O-N 2.78Å; V214-C218 PolarHBondContact O-SG 3.37Å; V214-C218 VanDerWaalsContact O-SG 3.41Å; V214-W229 HydrophobicContact CG1-CH2 4.19Å
215	Q	94	Very high	90.4	Very high	23 Å²	23	47.1 Å²	47.1	11%	0.107	24%	0.236	C	C	.	.	H	α-helix	trans	-57.7	-47.7	175.9	-176.8	178	24.8	0	0	111.4	C211 Y213 K217 C218 E219 W229 C235	C211-Q215 WeakPolarHBondContact O-CB 3.34Å; C211-Q215 PolarHBondContact O-N 3.39Å; Y213-Q215 VanDerWaalsContact C-N 3.33Å; Q215-K217 VanDerWaalsContact C-N 3.27Å; Q215-K217 PolarHBondContact O-N 2.91Å; Q215-C218 PolarHBondContact O-N 3.03Å; Q215-E219 VanDerWaalsContact CD-OE2 3.31Å; Q215-E219 HydrophobicContact CG-CB 4.13Å; Q215-E219 WeakPolarHBondContact CG-OE2 3.48Å; Q215-E219 PolarHBondContact NE2-OE2 3.4Å; Q215-E219 WeakPolarHBondContact O-CB 3.19Å; Q215-E219 PolarHBondContact O-N 3.14Å; Q215-W229 HydrophobicContact CB-CD2 4.49Å; Q215-W229 HydrophobicContact CB-CH2 4.31Å; Q215-W229 HydrophobicContact CB-CZ2 4.06Å; Q215-W229 HydrophobicContact CG-CD2 3.98Å; Q215-W229 HydrophobicContact CG-CE3 4.34Å; Q215-W229 HydrophobicContact CG-CG 4.31Å; Q215-W229 HydrophobicContact CG-CZ2 4.42Å; Q215-C235 PolarHBondContact OE1-SG 3.05Å
216	S	93	Very high	90.3	Very high	66 Å²	66	49.4 Å²	49.4	46%	0.462	26%	0.259	S	S	.	.	H	α-helix	trans	-63.1	-30.8	-176.9	73.5	0	0	0	0	113.7	R212 Y213 V214 P220	R212-S216 WeakPolarHBondContact O-CB 3.19Å; R212-S216 PolarHBondContact O-N 3.45Å; Y213-S216 PolarHBondContact O-N 3.24Å; Y213-S216 PolarHBondContact O-OG 3.11Å; V214-S216 PolarHBondContact O-N 3.31Å; S216-P220 WeakPolarHBondContact O-CD 3.27Å; S216-P220 WeakPolarHBondContact O-CG 3.4Å
217	K	90	Very high	90	Very high	78 Å²	78	55.7 Å²	55.7	34%	0.339	29%	0.286	S	S	.	.	H	α-helix	trans	-87.7	-35.6	178.2	-57.7	-70.3	179.7	-170.6	0	113.2	C178 Y213 V214 Q215 E258	C178-K217 VanDerWaalsContact O-CB 3.26Å; C178-K217 WeakPolarHBondContact O-CB 3.29Å; Y213-K217 HydrophobicContact CE1-CG 4.45Å; Y213-K217 PolarHBondContact O-N 2.65Å; V214-K217 PolarHBondContact O-N 3.43Å; Q215-K217 VanDerWaalsContact C-N 3.27Å; Q215-K217 PolarHBondContact O-N 2.91Å; K217-E258 IonicContact NZ-OE1 3.09Å; K217-E258 PolarHBondContact NZ-OE1 2.87Å
218	C	92.3	Very high	89.9	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-98.6	-29.7	-171	-61.7	0	0	0	0	114	L173 C178 V214 Q215 I221 M222 W229	L173-C218 HydrophobicContact CD2-CB 4.45Å; C178-C218 HydrophobicContact CB-CB 3.92Å; C178-C218 WeakPolarHBondContact CB-SG 3.29Å; C178-C218 WeakPolarHBondContact SG-CB 3.36Å; C178-C218 CovalentContact SG-SG 2.03Å; C178-C218 PolarHBondContact SG-SG 3.34Å; V214-C218 VanDerWaalsContact O-CB 3.25Å; V214-C218 WeakPolarHBondContact O-CB 3.29Å; V214-C218 PolarHBondContact O-N 2.78Å; V214-C218 PolarHBondContact O-SG 3.37Å; V214-C218 VanDerWaalsContact O-SG 3.41Å; Q215-C218 PolarHBondContact O-N 3.03Å; C218-I221 PolarHBondContact O-N 2.91Å; C218-M222 PolarHBondContact O-N 3.09Å; C218-W229 HydrophobicContact CB-CZ3 4.11Å
219	E	92.4	Very high	89.8	Confident	39 Å²	39	59.4 Å²	59.4	18%	0.182	31%	0.31	C	S	.	.	H	α-helix	trans	-60.1	-40.5	177.2	-175.5	177.9	168.8	0	0	113.2	Q215 I221 M222 K223 W229	Q215-E219 VanDerWaalsContact CD-OE2 3.31Å; Q215-E219 HydrophobicContact CG-CB 4.13Å; Q215-E219 WeakPolarHBondContact CG-OE2 3.48Å; Q215-E219 PolarHBondContact NE2-OE2 3.4Å; Q215-E219 WeakPolarHBondContact O-CB 3.19Å; Q215-E219 PolarHBondContact O-N 3.14Å; E219-I221 PolarHBondContact O-N 3.47Å; E219-M222 PolarHBondContact O-N 3.35Å; E219-K223 HydrophobicContact CG-CD 4.11Å; E219-K223 HydrophobicContact CG-CG 4.29Å; E219-K223 WeakPolarHBondContact O-CB 3.38Å; E219-K223 WeakPolarHBondContact O-CG 3.26Å; E219-K223 PolarHBondContact O-N 3.19Å; E219-K223 WeakPolarHBondContact OE1-CE 3.41Å; E219-K223 IonicContact OE1-NZ 2.64Å; E219-K223 PolarHBondContact OE1-NZ 2.53Å; E219-W229 HydrophobicContact CB-CE3 4.1Å; E219-W229 HydrophobicContact CG-CB 4.21Å
220	P	90.4	Very high	89.8	Confident	77 Å²	77	58.6 Å²	58.6	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-59.6	-35.5	175.8	-24.6	35.2	0	0	0	113.3	S216 S224	S216-P220 WeakPolarHBondContact O-CD 3.27Å; S216-P220 WeakPolarHBondContact O-CG 3.4Å; P220-S224 PolarHBondContact O-N 2.97Å
221	I	87.3	Confident	89.7	Confident	51 Å²	51	65.5 Å²	65.5	26%	0.262	34%	0.342	S	S	.	.	H	α-helix	trans	-74.2	-40.2	177.9	-66	164.6	0	0	0	110.3	L173 V176 C178 C218 E219 K223 S224 F225	L173-I221 HydrophobicContact CD1-CG2 4.06Å; V176-I221 HydrophobicContact CG1-CD1 4.32Å; C178-I221 HydrophobicContact CB-CD1 3.45Å; C178-I221 VanDerWaalsContact CB-CD1 3.45Å; C218-I221 PolarHBondContact O-N 2.91Å; E219-I221 PolarHBondContact O-N 3.47Å; I221-K223 VanDerWaalsContact C-N 3.34Å; I221-K223 PolarHBondContact O-N 3.24Å; I221-S224 PolarHBondContact O-N 3.47Å; I221-S224 PolarHBondContact O-OG 2.66Å; I221-F225 HydrophobicContact CG2-CE2 4.36Å; I221-F225 VanDerWaalsContact O-CD2 3.27Å; I221-F225 WeakPolarHBondContact O-CD2 3.15Å
222	M	87.6	Confident	89.3	Confident	23 Å²	23	70 Å²	70	11%	0.113	36%	0.363	C	S	.	.	H	α-helix	trans	-63.8	-42.5	174.3	-68.9	-174.6	64.2	0	0	111.7	L173 C218 E219 S224 F225 S226 F227 P228 W229 P230	L173-M222 HydrophobicContact CD1-CG 4.26Å; L173-M222 HydrophobicContact CD2-CG 3.95Å; L173-M222 HydrophobicContact CD2-SD 3.86Å; C218-M222 PolarHBondContact O-N 3.09Å; E219-M222 PolarHBondContact O-N 3.35Å; M222-S224 VanDerWaalsContact C-N 3.31Å; M222-S224 PolarHBondContact O-N 3.43Å; M222-F225 CarbonylContact O-C 3.46Å; M222-F225 PolarHBondContact O-N 3.41Å; M222-F225 VanDerWaalsContact O-N 3.14Å; M222-S226 PolarHBondContact O-N 3.03Å; M222-F227 CarbonylContact C-O 3.59Å; M222-F227 HydrophobicContact CB-CB 4.37Å; M222-F227 WeakPolarHBondContact CB-O 3.36Å; M222-F227 HydrophobicContact CE-CB 4.15Å; M222-F227 PolarHBondContact O-N 3.36Å; M222-P228 WeakPolarHBondContact CE-O 3.15Å; M222-W229 HydrophobicContact SD-CE3 3.85Å; M222-W229 HydrophobicContact SD-CZ3 4.06Å; M222-P230 HydrophobicContact CE-CG 4.15Å
223	K	89	Confident	89.1	Confident	121 Å²	121	65.5 Å²	65.5	53%	0.526	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-33.6	177	-77.2	-177.6	177.6	168.8	0	112.9	E219 I221 F225 S226 F227	E219-K223 HydrophobicContact CG-CD 4.11Å; E219-K223 HydrophobicContact CG-CG 4.29Å; E219-K223 WeakPolarHBondContact O-CB 3.38Å; E219-K223 WeakPolarHBondContact O-CG 3.26Å; E219-K223 PolarHBondContact O-N 3.19Å; E219-K223 WeakPolarHBondContact OE1-CE 3.41Å; E219-K223 IonicContact OE1-NZ 2.64Å; E219-K223 PolarHBondContact OE1-NZ 2.53Å; I221-K223 VanDerWaalsContact C-N 3.34Å; I221-K223 PolarHBondContact O-N 3.24Å; K223-F225 PolarHBondContact O-N 3.04Å; K223-S226 PolarHBondContact O-N 3.29Å; K223-F227 PolarHBondContact N-O 3.12Å
224	S	84.4	Confident	89.1	Confident	82 Å²	82	66.7 Å²	66.7	57%	0.573	36%	0.355	S	S	*	.	H	α-helix	trans	-65.1	-23.3	177.1	71.9	0	0	0	0	112.9	P220 I221 M222	P220-S224 PolarHBondContact O-N 2.97Å; I221-S224 PolarHBondContact O-N 3.47Å; I221-S224 PolarHBondContact O-OG 2.66Å; M222-S224 VanDerWaalsContact C-N 3.31Å; M222-S224 PolarHBondContact O-N 3.43Å
225	F	84.1	Confident	89.1	Confident	146 Å²	146	66.7 Å²	66.7	64%	0.64	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	16.7	172.3	-64.7	-76.2	0	0	0	113.5	I221 M222 K223 F227	I221-F225 HydrophobicContact CG2-CE2 4.36Å; I221-F225 VanDerWaalsContact O-CD2 3.27Å; I221-F225 WeakPolarHBondContact O-CD2 3.15Å; M222-F225 CarbonylContact O-C 3.46Å; M222-F225 PolarHBondContact O-N 3.41Å; M222-F225 VanDerWaalsContact O-N 3.14Å; K223-F225 PolarHBondContact O-N 3.04Å; F225-F227 VanDerWaalsContact C-N 3.31Å; F225-F227 HydrophobicContact CB-CD2 3.82Å; F225-F227 HydrophobicContact CB-CE2 4.1Å; F225-F227 VanDerWaalsContact O-CD2 3.23Å; F225-F227 WeakPolarHBondContact O-CD2 3.32Å; F225-F227 WeakPolarHBondContact O-CE2 3.5Å; F225-F227 PolarHBondContact O-N 3.27Å
226	S	84.3	Confident	88.9	Confident	109 Å²	109	73 Å²	73	76%	0.762	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.9	25.1	-179.6	-53.5	0	0	0	0	115.8	M222 K223	M222-S226 PolarHBondContact O-N 3.03Å; K223-S226 PolarHBondContact O-N 3.29Å
227	F	84.1	Confident	88.6	Confident	131 Å²	131	73.5 Å²	73.5	58%	0.575	39%	0.386	S	S	*	.			trans	-104.1	121.9	173.1	-64	-74	0	0	0	110.7	M222 K223 F225	M222-F227 CarbonylContact C-O 3.59Å; M222-F227 HydrophobicContact CB-CB 4.37Å; M222-F227 WeakPolarHBondContact CB-O 3.36Å; M222-F227 HydrophobicContact CE-CB 4.15Å; M222-F227 PolarHBondContact O-N 3.36Å; K223-F227 PolarHBondContact N-O 3.12Å; F225-F227 VanDerWaalsContact C-N 3.31Å; F225-F227 HydrophobicContact CB-CD2 3.82Å; F225-F227 HydrophobicContact CB-CE2 4.1Å; F225-F227 VanDerWaalsContact O-CD2 3.23Å; F225-F227 WeakPolarHBondContact O-CD2 3.32Å; F225-F227 WeakPolarHBondContact O-CE2 3.5Å; F225-F227 PolarHBondContact O-N 3.27Å
228	P	89.4	Confident	88.6	Confident	96 Å²	96	70.5 Å²	70.5	62%	0.623	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-73	160.8	173.6	31.2	-34.1	0	0	0	111.4	M222 P230	M222-P228 WeakPolarHBondContact CE-O 3.15Å; P228-P230 WeakPolarHBondContact O-CD 3.5Å
229	W	89.7	Confident	88.3	Confident	30 Å²	30	72.1 Å²	72.1	11%	0.114	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-63.5	125	173	-171.4	-99.3	0	0	0	110.2	F185 V214 Q215 C218 E219 M222 L233	F185-W229 HydrophobicContact CE1-CH2 4.32Å; F185-W229 AromaticContact CE1-CZ2 3.95Å; F185-W229 HydrophobicContact CE1-CZ2 3.95Å; F185-W229 HydrophobicContact CZ-CZ2 4.42Å; V214-W229 HydrophobicContact CG1-CH2 4.19Å; Q215-W229 HydrophobicContact CB-CD2 4.49Å; Q215-W229 HydrophobicContact CB-CH2 4.31Å; Q215-W229 HydrophobicContact CB-CZ2 4.06Å; Q215-W229 HydrophobicContact CG-CD2 3.98Å; Q215-W229 HydrophobicContact CG-CE3 4.34Å; Q215-W229 HydrophobicContact CG-CG 4.31Å; Q215-W229 HydrophobicContact CG-CZ2 4.42Å; C218-W229 HydrophobicContact CB-CZ3 4.11Å; E219-W229 HydrophobicContact CB-CE3 4.1Å; E219-W229 HydrophobicContact CG-CB 4.21Å; M222-W229 HydrophobicContact SD-CE3 3.85Å; M222-W229 HydrophobicContact SD-CZ3 4.06Å; W229-L233 HydrophobicContact CZ2-CB 3.88Å; W229-L233 HydrophobicContact CZ2-CD1 4.25Å; W229-L233 PolarHBondContact NE1-O 3.2Å
230	P	89.9	Confident	87.7	Confident	23 Å²	23	72.9 Å²	72.9	15%	0.149	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-62	147.1	-173.9	-24.2	34.5	0	0	0	113.5	Y170 M222 P228 E232 L233	Y170-P230 HydrophobicContact CE1-CG 4.2Å; Y170-P230 WeakPolarHBondContact OH-CG 3.25Å; M222-P230 HydrophobicContact CE-CG 4.15Å; P228-P230 WeakPolarHBondContact O-CD 3.5Å; P230-E232 VanDerWaalsContact C-N 3.27Å; P230-E232 WeakPolarHBondContact CB-OE2 3.09Å; P230-E232 PolarHBondContact O-N 3.19Å; P230-L233 HydrophobicContact CB-CD1 4.4Å; P230-L233 HydrophobicContact CB-CG 4.28Å; P230-L233 HydrophobicContact CG-CD1 4.14Å; P230-L233 PolarHBondContact O-N 3.39Å; P230-L233 VanDerWaalsContact O-N 3.17Å
231	I	89	Confident	86.4	Confident	146 Å²	146	74.5 Å²	74.5	75%	0.749	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-67.9	-33.6	-176.6	-58.7	168.5	0	0	0	110.3	L233 N234	I231-L233 PolarHBondContact O-N 2.98Å; I231-N234 WeakPolarHBondContact O-CB 3.32Å; I231-N234 PolarHBondContact O-N 3.36Å; I231-N234 VanDerWaalsContact O-N 3.16Å
232	E	85.9	Confident	85.3	Confident	94 Å²	94	78 Å²	78	44%	0.439	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-64.9	-22.3	177.4	-55.7	84.5	171.8	0	0	112.5	V155 P230	V155-E232 HydrophobicContact CG1-CB 4.06Å; P230-E232 VanDerWaalsContact C-N 3.27Å; P230-E232 WeakPolarHBondContact CB-OE2 3.09Å; P230-E232 PolarHBondContact O-N 3.19Å
233	L	90.2	Very high	84.3	Confident	3 Å²	3	78.4 Å²	78.4	2%	0.016	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-103.9	14.6	179.1	-56	-177.8	0	0	0	112.2	Y170 F185 L186 I189 C211 W229 P230 I231 C235	Y170-L233 HydrophobicContact CE1-CD1 4.02Å; F185-L233 HydrophobicContact CE1-CB 4.33Å; F185-L233 HydrophobicContact CE1-CD1 4.4Å; F185-L233 HydrophobicContact CE1-CD2 4.1Å; F185-L233 HydrophobicContact CZ-CB 4.43Å; F185-L233 HydrophobicContact CZ-CD2 4.43Å; L186-L233 HydrophobicContact CD2-CD1 3.93Å; L186-L233 HydrophobicContact CD2-CD2 4.27Å; I189-L233 HydrophobicContact CD1-CD2 3.43Å; I189-L233 VanDerWaalsContact CD1-CD2 3.43Å; I189-L233 HydrophobicContact CG2-CD2 4.12Å; C211-L233 PolarHBondContact SG-O 3.4Å; C211-L233 VanDerWaalsContact SG-O 3.41Å; W229-L233 HydrophobicContact CZ2-CB 3.88Å; W229-L233 HydrophobicContact CZ2-CD1 4.25Å; W229-L233 PolarHBondContact NE1-O 3.2Å; P230-L233 HydrophobicContact CB-CD1 4.4Å; P230-L233 HydrophobicContact CB-CG 4.28Å; P230-L233 HydrophobicContact CG-CD1 4.14Å; P230-L233 PolarHBondContact O-N 3.39Å; P230-L233 VanDerWaalsContact O-N 3.17Å; I231-L233 PolarHBondContact O-N 2.98Å; L233-C235 PolarHBondContact O-N 3.35Å; L233-C235 VanDerWaalsContact O-N 3.12Å
234	N	91	Very high	83.8	Confident	62 Å²	62	80.2 Å²	80.2	33%	0.332	45%	0.447	S	S	.	.			trans	-64.2	113.5	-176	-177.5	-1.6	0	0	0	111.7	I231 K236 S237	I231-N234 WeakPolarHBondContact O-CB 3.32Å; I231-N234 PolarHBondContact O-N 3.36Å; I231-N234 VanDerWaalsContact O-N 3.16Å; N234-K236 PolarHBondContact O-N 3.26Å; N234-K236 PolarHBondContact OD1-N 3.13Å; N234-K236 VanDerWaalsContact OD1-N 3.15Å; N234-S237 PolarHBondContact O-N 2.81Å; N234-S237 PolarHBondContact O-OG 2.96Å
235	C	92.5	Very high	83.9	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-61.2	-14.4	-176.6	-52.8	0	0	0	0	115	Q208 C211 R212 Q215 L233 S237	Q208-C235 WeakPolarHBondContact CG-O 3.47Å; Q208-C235 PolarHBondContact NE2-O 3.04Å; C211-C235 HydrophobicContact CB-CB 3.64Å; C211-C235 WeakPolarHBondContact CB-SG 3.5Å; C211-C235 PolarHBondContact O-SG 2.93Å; C211-C235 VanDerWaalsContact O-SG 3.41Å; C211-C235 WeakPolarHBondContact SG-CA 3.11Å; C211-C235 WeakPolarHBondContact SG-CB 3.1Å; C211-C235 CovalentContact SG-SG 2.03Å; C211-C235 PolarHBondContact SG-SG 2.69Å; R212-C235 HydrophobicContact CG-CB 4.08Å; R212-C235 PolarHBondContact N-SG 3.09Å; Q215-C235 PolarHBondContact OE1-SG 3.05Å; L233-C235 PolarHBondContact O-N 3.35Å; L233-C235 VanDerWaalsContact O-N 3.12Å; C235-S237 VanDerWaalsContact C-N 3.34Å
236	K	90.3	Very high	84	Confident	155 Å²	155	71.9 Å²	71.9	67%	0.674	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-73.3	-22.7	176.3	-67.5	-173.3	179.7	-177.9	0	113.6	N234 L238	N234-K236 PolarHBondContact O-N 3.26Å; N234-K236 PolarHBondContact OD1-N 3.13Å; N234-K236 VanDerWaalsContact OD1-N 3.15Å; K236-L238 VanDerWaalsContact C-N 3.34Å
237	S	87.5	Confident	84.1	Confident	77 Å²	77	69 Å²	69	54%	0.538	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-87.8	-1.3	-179.6	59.9	0	0	0	0	113.9	N234 C235	N234-S237 PolarHBondContact O-N 2.81Å; N234-S237 PolarHBondContact O-OG 2.96Å; C235-S237 VanDerWaalsContact C-N 3.34Å
238	L	89.1	Confident	84	Confident	15 Å²	15	63.4 Å²	63.4	8%	0.079	36%	0.355	C	S	.	.	S	Bend	trans	-96.7	150.7	-177.2	-66.7	173.9	0	0	0	111.8	F185 Q205 P206 Q208 C211 K236	F185-L238 HydrophobicContact CE2-CD1 3.99Å; Q205-L238 HydrophobicContact CB-CD2 4.02Å; P206-L238 HydrophobicContact CG-CD1 3.97Å; P206-L238 HydrophobicContact CG-CD2 3.94Å; Q208-L238 HydrophobicContact CB-CB 4.37Å; C211-L238 HydrophobicContact CB-CD1 3.49Å; C211-L238 VanDerWaalsContact CB-CD1 3.49Å; K236-L238 VanDerWaalsContact C-N 3.34Å
239	P	87.1	Confident	83.3	Confident	35 Å²	35	65.9 Å²	65.9	23%	0.227	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-61.9	136.6	178.6	24.7	-34.6	0	0	0	112.5	Q205 Q208 C245	Q205-P239 HydrophobicContact CB-CG 4.27Å; Q208-P239 VanDerWaalsContact CB-O 3.32Å; Q208-P239 WeakPolarHBondContact CB-O 3.49Å; Q208-P239 PolarHBondContact N-O 3.49Å; P239-C245 HydrophobicContact CB-CB 4.19Å; P239-C245 HydrophobicContact CG-CB 3.57Å
240	S	78.8	Confident	82.4	Confident	55 Å²	55	67.9 Å²	67.9	39%	0.385	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-75.8	171.6	170.7	-169.3	0	0	0	0	111.1	S242 G243	S240-S242 PolarHBondContact O-N 3.34Å; S240-G243 PolarHBondContact O-N 3.02Å
241	E	64.2	Low	81.7	Confident	110 Å²	110	67.2 Å²	67.2	51%	0.514	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-16.1	-175.6	-75.3	178.4	178.2	0	0	114.5	N209 K255	N209-E241 PolarHBondContact ND2-OE1 3.23Å; E241-K255 IonicContact OE1-NZ 2.8Å; E241-K255 PolarHBondContact OE1-NZ 3.23Å
242	S	63.2	Low	80.9	Confident	124 Å²	124	63.3 Å²	63.3	87%	0.867	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-12.3	174.2	51.9	0	0	0	0	114.8	S240	S240-S242 PolarHBondContact O-N 3.34Å
243	G	67.6	Low	79.7	Confident	33 Å²	33	59.4 Å²	59.4	34%	0.34	33%	0.328	S	S	.	.	S	Bend	trans	-100.4	157.6	177.4	0	0	0	0	0	112.8	S240 C245	S240-G243 PolarHBondContact O-N 3.02Å; G243-C245 PolarHBondContact O-N 3.34Å
244	M	77.2	Confident	78.4	Confident	159 Å²	159	61.4 Å²	61.4	78%	0.783	34%	0.339	S	S	*	.			trans	-69.5	103.2	171.8	-169.8	-179.1	-63.7	0	0	109.2	L204	L204-M244 HydrophobicContact CD2-CG 3.71Å; L204-M244 HydrophobicContact CD2-SD 4.32Å; L204-M244 HydrophobicContact CG-CG 4.41Å
245	C	87.1	Confident	77.1	Confident	28 Å²	28	62 Å²	62	19%	0.189	34%	0.339	C	S	.	.			trans	-133.3	157.9	-178.1	66.3	0	0	0	0	110.7	Q205 C207 P239 G243	Q205-C245 WeakPolarHBondContact O-CA 2.97Å; C207-C245 WeakPolarHBondContact CA-SG 3.47Å; C207-C245 HydrophobicContact CB-CB 3.91Å; C207-C245 WeakPolarHBondContact CB-SG 3.48Å; C207-C245 WeakPolarHBondContact SG-CB 3.36Å; C207-C245 CovalentContact SG-SG 2.03Å; C207-C245 PolarHBondContact SG-SG 3.42Å; P239-C245 HydrophobicContact CB-CB 4.19Å; P239-C245 HydrophobicContact CG-CB 3.57Å; G243-C245 PolarHBondContact O-N 3.34Å
246	I	86.4	Confident	75.2	Confident	24 Å²	24	66.9 Å²	66.9	12%	0.123	36%	0.362	C	S	.	.	B	Isolated β-bridge	trans	-100	132.3	179.7	-174.2	168.8	0	0	0	111.1	Y146 F184 T188 M193 L204 Q205 P206 C207	Y146-I246 HydrophobicContact CD1-CD1 4.32Å; Y146-I246 HydrophobicContact CE1-CD1 4.26Å; F184-I246 HydrophobicContact CE1-CG1 4.18Å; F184-I246 HydrophobicContact CZ-CD1 3.85Å; F184-I246 HydrophobicContact CZ-CG1 3.7Å; T188-I246 HydrophobicContact CG2-CD1 4.24Å; T188-I246 HydrophobicContact CG2-CG2 3.69Å; M193-I246 HydrophobicContact CG-CD1 4.36Å; M193-I246 HydrophobicContact SD-CD1 3.69Å; L204-I246 HydrophobicContact CB-CB 4.22Å; L204-I246 HydrophobicContact CB-CG2 4.22Å; L204-I246 HydrophobicContact CD2-CB 4.47Å; Q205-I246 WeakPolarHBondContact O-CG2 3.34Å; Q205-I246 PolarHBondContact O-N 3.25Å; P206-I246 VanDerWaalsContact CA-O 3.32Å; P206-I246 WeakPolarHBondContact CA-O 3.34Å; C207-I246 PolarHBondContact N-O 3.45Å; C207-I246 VanDerWaalsContact N-O 3.11Å
247	Q	86.1	Confident	73.2	Confident	50 Å²	50	60.9 Å²	60.9	23%	0.234	34%	0.344	C	S	.	.			trans	-140.5	151.8	170.1	62.9	-178.4	31.2	0	0	111	C207 L210 Y251 D252	C207-Q247 HydrophobicContact CB-CB 4.37Å; L210-Q247 HydrophobicContact CD2-CB 4.35Å; Q247-Y251 HydrophobicContact CB-CD1 4.49Å; Q247-D252 VanDerWaalsContact NE2-CG 3.32Å; Q247-D252 PolarHBondContact NE2-OD1 3.21Å; Q247-D252 PolarHBondContact NE2-OD2 3.35Å
248	P	82.7	Confident	71.2	Confident	12 Å²	12	60.2 Å²	60.2	8%	0.078	33%	0.332	C	S	.	.			trans	-60.5	140.2	173.6	-16.9	28.2	0	0	0	110.3	Y181 F184 L210 N250 Y251	Y181-P248 HydrophobicContact CD1-CB 3.95Å; Y181-P248 HydrophobicContact CD1-CG 3.54Å; Y181-P248 HydrophobicContact CE1-CB 3.84Å; Y181-P248 HydrophobicContact CE1-CG 3.94Å; Y181-P248 HydrophobicContact CG-CG 4.36Å; F184-P248 HydrophobicContact CB-CG 4.36Å; F184-P248 HydrophobicContact CD1-CG 3.54Å; F184-P248 HydrophobicContact CD2-CG 4.24Å; F184-P248 VanDerWaalsContact CE1-CD 3.44Å; F184-P248 HydrophobicContact CE1-CG 3.73Å; F184-P248 HydrophobicContact CE2-CG 4.41Å; F184-P248 HydrophobicContact CG-CG 3.8Å; F184-P248 HydrophobicContact CZ-CG 4.14Å; L210-P248 HydrophobicContact CD1-CG 4.16Å; L210-P248 HydrophobicContact CD2-CG 4.44Å; P248-N250 PolarHBondContact O-N 3.33Å; P248-Y251 VanDerWaalsContact O-CB 3.29Å; P248-Y251 WeakPolarHBondContact O-CB 3.06Å; P248-Y251 PolarHBondContact O-N 3.35Å
249	Q	74.2	Confident	69	Low	148 Å²	148	65.1 Å²	65.1	69%	0.692	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.5	179.3	-66.6	176.5	8.2	0	0	113.3
250	N	71	Confident	66.7	Low	72 Å²	72	69.9 Å²	69.9	39%	0.385	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-8.7	179.7	-63	-12.1	0	0	0	114.1	Y181 P248 D252 L253	Y181-N250 PolarHBondContact OH-O 2.99Å; Y181-N250 VanDerWaalsContact OH-O 3.04Å; P248-N250 PolarHBondContact O-N 3.33Å; N250-D252 VanDerWaalsContact C-N 3.33Å; N250-D252 PolarHBondContact O-N 3.03Å; N250-L253 WeakPolarHBondContact O-CB 3.41Å; N250-L253 PolarHBondContact O-N 3.28Å
251	Y	75.8	Confident	64.8	Low	9 Å²	9	72.1 Å²	72.1	4%	0.035	40%	0.395	C	S	.	.	H	α-helix	trans	-61.9	-40.1	-175.2	175.7	-107.9	0	0	0	112.5	Y181 N209 L210 Y213 Q247 P248 L253 D254 K255	Y181-Y251 HydrophobicContact CD2-CD2 4.16Å; Y181-Y251 HydrophobicContact CE2-CD2 4.08Å; N209-Y251 HydrophobicContact CB-CE1 4.07Å; N209-Y251 WeakPolarHBondContact CB-OH 3.41Å; N209-Y251 PolarHBondContact O-OH 3.04Å; L210-Y251 HydrophobicContact CD1-CD2 3.57Å; L210-Y251 HydrophobicContact CD1-CE2 3.99Å; L210-Y251 HydrophobicContact CD1-CG 3.97Å; Y213-Y251 HydrophobicContact CD1-CE2 4.23Å; Y213-Y251 HydrophobicContact CD2-CE2 4.2Å; Y213-Y251 AromaticContact CG-CE2 3.76Å; Y213-Y251 HydrophobicContact CG-CE2 3.76Å; Q247-Y251 HydrophobicContact CB-CD1 4.49Å; P248-Y251 VanDerWaalsContact O-CB 3.29Å; P248-Y251 WeakPolarHBondContact O-CB 3.06Å; P248-Y251 PolarHBondContact O-N 3.35Å; Y251-L253 VanDerWaalsContact C-N 3.25Å; Y251-L253 PolarHBondContact O-N 2.83Å; Y251-D254 PolarHBondContact O-N 3.48Å; Y251-K255 PolarHBondContact O-N 3.26Å
252	D	71.1	Confident	63.5	Low	65 Å²	65	74.6 Å²	74.6	35%	0.348	41%	0.407	S	S	.	.	H	α-helix	trans	-65.8	-26.8	-179.8	-61.8	-46.1	0	0	0	112.9	Q247 N250	Q247-D252 VanDerWaalsContact NE2-CG 3.32Å; Q247-D252 PolarHBondContact NE2-OD1 3.21Å; Q247-D252 PolarHBondContact NE2-OD2 3.35Å; N250-D252 VanDerWaalsContact C-N 3.33Å; N250-D252 PolarHBondContact O-N 3.03Å
253	L	61.4	Low	62.1	Low	11 Å²	11	71.3 Å²	71.3	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-74.1	-29.5	178.1	-79.2	158.8	0	0	0	113.8	N250 Y251 T435 Q459 K461	N250-L253 WeakPolarHBondContact O-CB 3.41Å; N250-L253 PolarHBondContact O-N 3.28Å; Y251-L253 VanDerWaalsContact C-N 3.25Å; Y251-L253 PolarHBondContact O-N 2.83Å; L253-T435 HydrophobicContact CD1-CG2 3.44Å; L253-T435 VanDerWaalsContact CD1-CG2 3.44Å; L253-Q459 HydrophobicContact CD2-CB 3.76Å; L253-Q459 HydrophobicContact CD2-CG 3.52Å; L253-Q459 HydrophobicContact CG-CG 4.39Å; L253-K461 PolarHBondContact O-NZ 3.47Å
254	D	62.1	Low	60.4	Low	45 Å²	45	76 Å²	76	24%	0.241	41%	0.408	C	S	.	.	H	α-helix	trans	-86.7	-33.4	179.5	-71.9	-19.8	0	0	0	111.7	Q180 Y181 Y251 Q256 G257 E258	Q180-D254 PolarHBondContact NE2-OD2 3.46Å; Y181-D254 HydrophobicContact CE2-CB 4.41Å; Y181-D254 WeakPolarHBondContact CE2-OD2 3.37Å; Y181-D254 PolarHBondContact OH-OD2 2.03Å; Y251-D254 PolarHBondContact O-N 3.48Å; D254-Q256 PolarHBondContact O-N 3.22Å; D254-G257 PolarHBondContact O-N 2.83Å; D254-G257 VanDerWaalsContact O-N 3.1Å; D254-E258 PolarHBondContact O-N 2.93Å
255	K	63.4	Low	58.6	Low	74 Å²	74	73 Å²	73	32%	0.322	40%	0.4	S	S	.	.	H	α-helix	trans	-55.7	-35.5	172	-165.6	-179.6	-178.7	-172.2	0	111.3	E241 Y251 I259	E241-K255 IonicContact OE1-NZ 2.8Å; E241-K255 PolarHBondContact OE1-NZ 3.23Å; Y251-K255 PolarHBondContact O-N 3.26Å; K255-I259 WeakPolarHBondContact O-CG1 3.39Å
256	Q	53.6	Low	56.2	Low	103 Å²	103	77.4 Å²	77.4	48%	0.481	43%	0.432	S	S	.	.	H	α-helix	trans	-79.1	-24.8	178.3	-68.1	178.6	0.7	0	0	114.2	D254 I260	D254-Q256 PolarHBondContact O-N 3.22Å; Q256-I260 WeakPolarHBondContact O-CG1 3.4Å
257	G	47.5	Very low	54.2	Low	29 Å²	29	84.6 Å²	84.6	30%	0.299	46%	0.464	S	S	.	.	H	α-helix	trans	-75.9	-28.3	177	0	0	0	0	0	113.9	D254 S261	D254-G257 PolarHBondContact O-N 2.83Å; D254-G257 VanDerWaalsContact O-N 3.1Å; G257-S261 PolarHBondContact O-N 2.91Å; G257-S261 PolarHBondContact O-OG 2.66Å; G257-S261 VanDerWaalsContact O-OG 3.06Å
258	E	46	Very low	51.8	Low	63 Å²	63	84.2 Å²	84.2	29%	0.294	47%	0.47	S	S	.	.	H	α-helix	trans	-77.4	-29.3	177.6	-143.8	160.8	-152.5	0	0	111.7	K217 D254 I260 S261 Q262	K217-E258 IonicContact NZ-OE1 3.09Å; K217-E258 PolarHBondContact NZ-OE1 2.87Å; D254-E258 PolarHBondContact O-N 2.93Å; E258-I260 VanDerWaalsContact C-N 3.32Å; E258-I260 PolarHBondContact O-N 2.77Å; E258-S261 PolarHBondContact O-N 2.97Å; E258-Q262 PolarHBondContact O-N 2.86Å
259	I	43.3	Very low	49.9	Very low	118 Å²	118	91.9 Å²	91.9	61%	0.605	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-31.6	173.4	-62.1	170	0	0	0	111.5	K255 S261	K255-I259 WeakPolarHBondContact O-CG1 3.39Å; I259-S261 VanDerWaalsContact C-N 3.29Å; I259-S261 PolarHBondContact O-N 3.02Å
260	I	37.7	Very low	48.5	Very low	135 Å²	135	87.7 Å²	87.7	69%	0.692	50%	0.501	S	S	*	.	H	α-helix	trans	-77.6	-17.4	176.3	-62.9	171.1	0	0	0	111.7	Q256 E258	Q256-I260 WeakPolarHBondContact O-CG1 3.4Å; E258-I260 VanDerWaalsContact C-N 3.32Å; E258-I260 PolarHBondContact O-N 2.77Å
261	S	38.5	Very low	47.1	Very low	102 Å²	102	87 Å²	87	71%	0.713	51%	0.505	S	S	*	.	H	α-helix	trans	-97.4	-5.5	-179.3	-55.9	0	0	0	0	114.1	G257 E258 I259	G257-S261 PolarHBondContact O-N 2.91Å; G257-S261 PolarHBondContact O-OG 2.66Å; G257-S261 VanDerWaalsContact O-OG 3.06Å; E258-S261 PolarHBondContact O-N 2.97Å; I259-S261 VanDerWaalsContact C-N 3.29Å; I259-S261 PolarHBondContact O-N 3.02Å
262	Q	38	Very low	45.4	Very low	163 Å²	163	93.4 Å²	93.4	76%	0.762	54%	0.539	S	S	*	.	S	Bend	trans	-112.7	10.4	-178.5	-69.9	-174.4	-14.5	0	0	113.7	E258	E258-Q262 PolarHBondContact O-N 2.86Å
263	G	33.9	Very low	44.2	Very low	54 Å²	54	94.1 Å²	94.1	56%	0.557	55%	0.554	S	S	*	*			trans	-116.7	14.2	-169.3	0	0	0	0	0	117.5	P265	G263-P265 WeakPolarHBondContact O-CD 3.45Å
264	I	32.3	Very low	43.6	Very low	133 Å²	133	100.3 Å²	100.3	68%	0.682	59%	0.587	S	S	*	*			trans	-113.8	98.1	175.7	-53.4	-179.5	0	0	0	109.6
265	P	39.3	Very low	42.6	Very low	95 Å²	95	104.2 Å²	104.2	62%	0.617	61%	0.607	S	S	*	*			trans	-63.3	142.4	176.5	-18.7	31.2	0	0	0	111.9	G263 E267	G263-P265 WeakPolarHBondContact O-CD 3.45Å; P265-E267 PolarHBondContact O-N 2.75Å
266	S	36.6	Very low	41.4	Very low	121 Å²	121	107.2 Å²	107.2	85%	0.846	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	15.9	-173.2	44.9	0	0	0	0	116.9
267	E	43.8	Very low	41	Very low	174 Å²	174	108.9 Å²	108.9	81%	0.813	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.7	-4.5	-173.3	-71.2	172.1	157.4	0	0	113.4	P265	P265-E267 PolarHBondContact O-N 2.75Å
268	A	35.3	Very low	40.8	Very low	43 Å²	43	112.6 Å²	112.6	36%	0.355	66%	0.659	S	S	.	*	S	Bend	trans	-90.9	-8.8	-177	0	0	0	0	0	115.1	G270	A268-G270 PolarHBondContact O-N 3.35Å
269	H	43.8	Very low	40.5	Very low	172 Å²	172	116.2 Å²	116.2	80%	0.796	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-14.3	-175.6	-81.4	-148.8	0	0	0	114.4
270	G	43.7	Very low	40.7	Very low	60 Å²	60	113.3 Å²	113.3	62%	0.619	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-21.1	-176.4	0	0	0	0	0	115.8	A268	A268-G270 PolarHBondContact O-N 3.35Å
271	A	42.2	Very low	41.2	Very low	58 Å²	58	113.4 Å²	113.4	48%	0.479	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.8	-18.7	-170.9	0	0	0	0	0	114.3
272	I	39.2	Very low	41.2	Very low	143 Å²	143	115.2 Å²	115.2	73%	0.733	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-16.4	-177.5	-62	174.1	0	0	0	112	N274	I272-N274 VanDerWaalsContact C-N 3.34Å; I272-N274 PolarHBondContact O-N 3.1Å
273	A	47	Very low	41.4	Very low	80 Å²	80	112.3 Å²	112.3	66%	0.661	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-7.6	-178.7	0	0	0	0	0	115
274	N	48	Very low	41.9	Very low	141 Å²	141	112.1 Å²	112.1	75%	0.754	65%	0.648	S	S	*	*	S	Bend	trans	-134.5	2.8	-168.7	-76	-37.4	0	0	0	116.3	I272	I272-N274 VanDerWaalsContact C-N 3.34Å; I272-N274 PolarHBondContact O-N 3.1Å
275	L	40.9	Very low	42.6	Very low	128 Å²	128	112.4 Å²	112.4	67%	0.67	65%	0.646	S	S	*	*	S	Bend	trans	-124.7	-12.1	-163.5	-81.1	168.5	0	0	0	119
276	L	39.1	Very low	42.9	Very low	137 Å²	137	113.9 Å²	113.9	72%	0.717	65%	0.645	S	S	*	*			trans	-144.8	99.1	174	-82	106.8	0	0	0	113.4	D278	L276-D278 PolarHBondContact O-N 3.24Å; L276-D278 VanDerWaalsContact O-N 3.11Å
277	P	44	Very low	43	Very low	137 Å²	137	111.5 Å²	111.5	89%	0.89	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-1	168.7	-13.9	28.7	0	0	0	114.3
278	D	43.3	Very low	42.9	Very low	107 Å²	107	105.5 Å²	105.5	57%	0.572	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	4.3	-172	-108.2	-8.1	0	0	0	115.3	L276 G280 E281	L276-D278 PolarHBondContact O-N 3.24Å; L276-D278 VanDerWaalsContact O-N 3.11Å; D278-G280 PolarHBondContact O-N 3.33Å; D278-E281 PolarHBondContact O-N 3.19Å
279	F	40.3	Very low	43.4	Very low	139 Å²	139	110.5 Å²	110.5	61%	0.61	62%	0.624	S	S	*	*	H	α-helix	trans	-65.6	-9.8	175.3	-149.8	-100.9	0	0	0	113.1	E281	F279-E281 VanDerWaalsContact C-N 3.32Å
280	G	48.6	Very low	43.1	Very low	57 Å²	57	108.8 Å²	108.8	59%	0.588	62%	0.621	S	S	*	*	H	α-helix	trans	-69.2	-23.3	170	0	0	0	0	0	114.3	D278 A284	D278-G280 PolarHBondContact O-N 3.33Å; G280-A284 PolarHBondContact O-N 3.47Å
281	E	47.5	Very low	42.8	Very low	137 Å²	137	112.6 Å²	112.6	64%	0.64	62%	0.622	S	S	*	*	H	α-helix	trans	-85.5	-27.8	-178.1	-152.7	174.5	-168	0	0	112.2	D278 F279 A284 H285	D278-E281 PolarHBondContact O-N 3.19Å; F279-E281 VanDerWaalsContact C-N 3.32Å; E281-A284 WeakPolarHBondContact O-CB 3.39Å; E281-A284 PolarHBondContact O-N 3.12Å; E281-H285 PolarHBondContact O-N 3.38Å
282	F	37.2	Very low	42.6	Very low	141 Å²	141	117.3 Å²	117.3	62%	0.618	63%	0.634	S	S	*	*	H	α-helix	trans	-74.1	-34.1	174.9	-168.9	-104.6	0	0	0	112.7	A284 H285 Q286	F282-A284 VanDerWaalsContact C-N 3.31Å; F282-H285 PolarHBondContact O-N 2.75Å; F282-Q286 PolarHBondContact O-N 3.48Å
283	L	42.2	Very low	42.2	Very low	102 Å²	102	118.3 Å²	118.3	53%	0.534	64%	0.641	S	S	.	*	H	α-helix	trans	-72.2	-25	170.5	-71.3	171.2	0	0	0	112.3	S287	L283-S287 PolarHBondContact O-N 3.15Å
284	A	45.7	Very low	41.5	Very low	49 Å²	49	119.7 Å²	119.7	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-69.8	-35.8	171.4	0	0	0	0	0	112	G280 E281 F282 Q286 S287 A288	G280-A284 PolarHBondContact O-N 3.47Å; E281-A284 WeakPolarHBondContact O-CB 3.39Å; E281-A284 PolarHBondContact O-N 3.12Å; F282-A284 VanDerWaalsContact C-N 3.31Å; A284-Q286 VanDerWaalsContact C-N 3.34Å; A284-Q286 PolarHBondContact O-N 3.21Å; A284-S287 PolarHBondContact O-N 3.46Å; A284-S287 PolarHBondContact O-OG 2.97Å; A284-A288 PolarHBondContact O-N 2.88Å
285	H	47.6	Very low	40.7	Very low	139 Å²	139	119.9 Å²	119.9	64%	0.644	64%	0.642	S	S	*	*	H	α-helix	trans	-73.1	-23	179.7	-140	-53.2	0	0	0	114	E281 F282	E281-H285 PolarHBondContact O-N 3.38Å; F282-H285 PolarHBondContact O-N 2.75Å
286	Q	44.3	Very low	40.2	Very low	127 Å²	127	122.2 Å²	122.2	59%	0.593	65%	0.649	S	S	*	*	H	α-helix	trans	-82.5	-18.9	173.9	-143.2	172.2	26.1	0	0	112.8	F282 A284	F282-Q286 PolarHBondContact O-N 3.48Å; A284-Q286 VanDerWaalsContact C-N 3.34Å; A284-Q286 PolarHBondContact O-N 3.21Å
287	S	40	Very low	39.8	Very low	70 Å²	70	122.6 Å²	122.6	49%	0.49	66%	0.657	S	S	.	*	H	α-helix	trans	-82	-18.8	171.3	73.4	0	0	0	0	113.9	L283 A284	L283-S287 PolarHBondContact O-N 3.15Å; A284-S287 PolarHBondContact O-N 3.46Å; A284-S287 PolarHBondContact O-OG 2.97Å
288	A	40.4	Very low	39	Very low	48 Å²	48	123.3 Å²	123.3	40%	0.397	65%	0.654	S	S	.	*	H	α-helix	trans	-84.7	-22	179.5	0	0	0	0	0	114.6	A284	A284-A288 PolarHBondContact O-N 2.88Å
289	Q	45.7	Very low	38.5	Very low	149 Å²	149	125.7 Å²	125.7	70%	0.696	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-15.7	174.4	-89	-178.1	-24.6	0	0	113.9
290	N	37.2	Very low	38.1	Very low	135 Å²	135	125.2 Å²	125.2	72%	0.722	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	7.4	175.1	-80.1	-29.2	0	0	0	113.9
291	Q	39.3	Very low	37.2	Very low	141 Å²	141	132.2 Å²	132.2	66%	0.659	70%	0.698	S	S	*	*	S	Bend	trans	-112.6	3.1	175.7	-81.5	-178.1	-23.4	0	0	114.4
292	Q	37.1	Very low	36.5	Very low	156 Å²	156	129 Å²	129	73%	0.729	70%	0.7	S	S	*	*	S	Bend	trans	-102.2	-1.9	174.8	-78	-177.6	-40.8	0	0	114.3
293	L	31.5	Very low	36	Very low	165 Å²	165	131.8 Å²	131.8	86%	0.864	71%	0.712	S	S	*	*	S	Bend	trans	-107.6	30.6	175.2	-152.8	75.6	0	0	0	112.8
294	T	31.7	Very low	35.5	Very low	108 Å²	108	135 Å²	135	66%	0.663	73%	0.728	S	S	*	*	S	Bend	trans	-142.1	7.1	175.9	48	0	0	0	0	114.5
295	N	30.7	Very low	34.6	Very low	145 Å²	145	137.1 Å²	137.1	78%	0.775	74%	0.74	S	S	*	*	S	Bend	trans	-131.4	31	-176.3	-79.7	-19.6	0	0	0	114.1
296	Q	30.4	Very low	33.9	Very low	178 Å²	178	138.3 Å²	138.3	83%	0.832	75%	0.75	S	S	*	*	S	Bend	trans	-143.3	48.1	-178.4	-133.2	174.6	13.3	0	0	113.3
297	T	30.7	Very low	33.4	Very low	144 Å²	144	140 Å²	140	88%	0.883	76%	0.762	S	S	*	*			trans	-153.7	55.7	161.4	12.9	0	0	0	0	110.2
298	D	28.4	Very low	32.8	Very low	153 Å²	153	143.4 Å²	143.4	82%	0.818	78%	0.775	S	S	*	*	S	Bend	trans	-132.5	130.2	159.1	-96.3	-32.2	0	0	0	106.5
299	N	31.3	Very low	32.3	Very low	157 Å²	157	148.1 Å²	148.1	84%	0.84	79%	0.793	S	S	*	*			trans	87.7	74.2	179.6	-52.4	-37.4	0	0	0	118.2
300	S	31.8	Very low	31.7	Very low	129 Å²	129	147.5 Å²	147.5	90%	0.902	80%	0.795	S	S	*	*			trans	-162.4	94.9	132.3	-88.9	0	0	0	0	111.5
301	H	30.3	Very low	31.5	Very low	204 Å²	204	150.4 Å²	150.4	94%	0.944	80%	0.804	S	S	*	*			trans	-59	128.1	155.7	-92.8	-106.9	0	0	0	109.7
302	G	32.7	Very low	31.2	Very low	68 Å²	68	146.7 Å²	146.7	70%	0.701	79%	0.793	S	S	*	*			trans	168.8	66.4	173.8	0	0	0	0	0	116.8
303	K	27.6	Very low	31	Very low	200 Å²	200	141 Å²	141	87%	0.87	78%	0.777	S	S	*	*			trans	38	95.6	137.7	-159.7	-176.9	-164.8	-179.3	0	117.2
304	I	30.9	Very low	30.9	Very low	170 Å²	170	139.7 Å²	139.7	87%	0.872	77%	0.77	S	S	*	*			trans	-144.2	105.6	134.9	-83.3	130.8	0	0	0	107.2
305	S	28.1	Very low	30.8	Very low	94 Å²	94	141.2 Å²	141.2	66%	0.657	77%	0.771	S	S	*	*			trans	-66.8	135.8	160.6	48.3	0	0	0	0	109.8
306	L	31	Very low	31.1	Very low	163 Å²	163	140.8 Å²	140.8	85%	0.853	76%	0.763	S	S	*	*				167.1	136.3	128.7	-89.6	154.6	0	0	0	111
307	I	34.2	Very low	31.2	Very low	163 Å²	163	136.9 Å²	136.9	84%	0.836	74%	0.744	S	S	*	*			trans	103.3	84.5	164.3	-52.5	163	0	0	0	115.2
308	D	28.9	Very low	31.4	Very low	142 Å²	142	136.5 Å²	136.5	76%	0.759	73%	0.732	S	S	*	*			trans	-44.3	159.7	148	-92.7	-47.1	0	0	0	113.9
309	N	29.6	Very low	31.8	Very low	146 Å²	146	134.1 Å²	134.1	78%	0.781	72%	0.718	S	S	*	*			trans	91	83.2	168.8	-55.6	-33.6	0	0	0	117
310	N	33	Very low	32	Very low	136 Å²	136	130.3 Å²	130.3	73%	0.727	70%	0.697	S	S	*	*			trans	-172.3	36.3	140	-98.5	-24.5	0	0	0	116.8	S312 G313	N310-S312 PolarHBondContact O-N 2.82Å; N310-G313 PolarHBondContact O-N 3.11Å
311	Q	33	Very low	32.3	Very low	196 Å²	196	128.9 Å²	128.9	92%	0.916	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-3.4	168.5	-96.4	179.7	-10	0	0	114.3
312	S	32.2	Very low	32.9	Very low	63 Å²	63	123.5 Å²	123.5	44%	0.441	65%	0.648	S	S	.	*	H	α-helix	trans	-80.7	-15.6	173.8	82.4	0	0	0	0	114.4	N310 K316	N310-S312 PolarHBondContact O-N 2.82Å; S312-K316 WeakPolarHBondContact O-CG 3.45Å; S312-K316 PolarHBondContact O-N 2.71Å
313	G	33.1	Very low	33.2	Very low	37 Å²	37	123.3 Å²	123.3	38%	0.381	64%	0.636	S	S	.	*	H	α-helix	trans	-78.9	-37.9	-173.7	0	0	0	0	0	114.8	N310 K316 H317	N310-G313 PolarHBondContact O-N 3.11Å; G313-K316 PolarHBondContact O-N 2.79Å; G313-H317 PolarHBondContact O-N 2.9Å
314	L	28.8	Very low	33.9	Very low	137 Å²	137	119.3 Å²	119.3	72%	0.717	62%	0.618	S	S	*	*	H	α-helix	trans	-75.1	-31.2	-178.9	-163	68.8	0	0	0	111.9	H317 H318	L314-H317 PolarHBondContact O-N 3.45Å; L314-H318 PolarHBondContact O-N 2.86Å
315	M	31.2	Very low	34.6	Very low	140 Å²	140	113.7 Å²	113.7	69%	0.69	59%	0.59	S	S	*	*	H	α-helix	trans	-69.2	-37.7	171.8	-135	-176.3	-174.1	0	0	111.3	H317 H318 I319	M315-H317 VanDerWaalsContact C-N 3.32Å; M315-H317 PolarHBondContact O-N 2.92Å; M315-H318 PolarHBondContact O-N 3.15Å; M315-I319 WeakPolarHBondContact O-CD1 3.45Å; M315-I319 WeakPolarHBondContact O-CG1 3.42Å; M315-I319 PolarHBondContact O-N 3.03Å
316	K	35.1	Very low	35.2	Very low	137 Å²	137	117 Å²	117	60%	0.596	60%	0.595	S	S	*	*	H	α-helix	trans	-63.9	-33.3	174.8	-81.3	174.9	179.3	176	0	113	S312 G313 I319 L320	S312-K316 WeakPolarHBondContact O-CG 3.45Å; S312-K316 PolarHBondContact O-N 2.71Å; G313-K316 PolarHBondContact O-N 2.79Å; K316-I319 PolarHBondContact O-N 3.35Å; K316-L320 WeakPolarHBondContact O-CB 3.36Å; K316-L320 PolarHBondContact O-N 3.46Å
317	H	34.4	Very low	35.9	Very low	96 Å²	96	113.7 Å²	113.7	44%	0.444	59%	0.591	S	S	.	*	H	α-helix	trans	-69.6	-35.6	178	-134.8	-75.2	0	0	0	112.7	G313 L314 M315 H321	G313-H317 PolarHBondContact O-N 2.9Å; L314-H317 PolarHBondContact O-N 3.45Å; M315-H317 VanDerWaalsContact C-N 3.32Å; M315-H317 PolarHBondContact O-N 2.92Å; H317-H321 PolarHBondContact O-N 3.5Å
318	H	35	Very low	36.9	Very low	136 Å²	136	108.1 Å²	108.1	63%	0.63	57%	0.566	S	S	*	*	H	α-helix	trans	-73.6	-32.4	171.7	-85.2	-77.7	0	0	0	113.1	L314 M315 R322	L314-H318 PolarHBondContact O-N 2.86Å; M315-H318 PolarHBondContact O-N 3.15Å; H318-R322 PolarHBondContact O-N 3.29Å
319	I	36.5	Very low	38.9	Very low	102 Å²	102	107.2 Å²	107.2	52%	0.523	56%	0.556	S	S	.	*	H	α-helix	trans	-69.7	-36.8	176.1	-67.4	162.8	0	0	0	111.2	M315 K316 R322 S323	M315-I319 WeakPolarHBondContact O-CD1 3.45Å; M315-I319 WeakPolarHBondContact O-CG1 3.42Å; M315-I319 PolarHBondContact O-N 3.03Å; K316-I319 PolarHBondContact O-N 3.35Å; I319-R322 WeakPolarHBondContact O-CB 3Å; I319-R322 PolarHBondContact O-N 3.32Å; I319-S323 PolarHBondContact O-N 2.9Å; I319-S323 VanDerWaalsContact O-N 3.13Å; I319-S323 PolarHBondContact O-OG 3.06Å
320	L	34.8	Very low	41.3	Very low	77 Å²	77	100.7 Å²	100.7	40%	0.403	52%	0.522	S	S	.	.	H	α-helix	trans	-69.7	-30.9	178.5	-142.9	91.9	0	0	0	113.1	K316 R322 S323	K316-L320 WeakPolarHBondContact O-CB 3.36Å; K316-L320 PolarHBondContact O-N 3.46Å; L320-R322 VanDerWaalsContact C-N 3.31Å; L320-S323 PolarHBondContact O-OG 3.21Å
321	H	38.8	Very low	43.8	Very low	100 Å²	100	97.2 Å²	97.2	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-71.6	-29.5	173.7	-158.7	-86.1	0	0	0	111.8	H317 L325	H317-H321 PolarHBondContact O-N 3.5Å; H321-L325 WeakPolarHBondContact O-CD1 3.06Å; H321-L325 PolarHBondContact O-N 3.08Å
322	R	41.6	Very low	46.2	Very low	91 Å²	91	89.8 Å²	89.8	34%	0.343	47%	0.467	S	S	.	.	H	α-helix	trans	-77.9	-36.5	-179.4	-157.9	172.7	-152.9	-145.5	-3	113.1	H318 I319 L320 Q326 A698 K699 Q700	H318-R322 PolarHBondContact O-N 3.29Å; I319-R322 WeakPolarHBondContact O-CB 3Å; I319-R322 PolarHBondContact O-N 3.32Å; L320-R322 VanDerWaalsContact C-N 3.31Å; R322-Q326 PolarHBondContact O-N 3.24Å; R322-A698 PolarHBondContact NH2-O 3.08Å; R322-A698 VanDerWaalsContact NH2-O 3.15Å; R322-K699 PolarHBondContact NH2-O 3Å; R322-Q700 PolarHBondContact NH2-O 2.87Å
323	S	39.5	Very low	48.7	Very low	64 Å²	64	86.9 Å²	86.9	45%	0.448	45%	0.446	S	S	.	.	H	α-helix	trans	-74.2	-31.6	-179.3	59.7	0	0	0	0	113.5	I319 L320	I319-S323 PolarHBondContact O-N 2.9Å; I319-S323 VanDerWaalsContact O-N 3.13Å; I319-S323 PolarHBondContact O-OG 3.06Å; L320-S323 PolarHBondContact O-OG 3.21Å
324	K	42.1	Very low	51.2	Low	115 Å²	115	86.6 Å²	86.6	50%	0.5	44%	0.435	S	S	.	.	H	α-helix	trans	-77.5	-28	173.4	-86.1	-177.3	-178	175.1	0	113.8	Q326 A327 S439	K324-Q326 VanDerWaalsContact C-N 3.34Å; K324-A327 PolarHBondContact O-N 3.38Å; K324-S439 PolarHBondContact NZ-O 3.3Å
325	L	45.2	Very low	53.7	Low	52 Å²	52	80.1 Å²	80.1	27%	0.272	40%	0.401	S	S	.	.	H	α-helix	trans	-71.3	-27.5	170.7	-103.5	102.2	0	0	0	112.8	H321 A327 S328 V332	H321-L325 WeakPolarHBondContact O-CD1 3.06Å; H321-L325 PolarHBondContact O-N 3.08Å; L325-A327 PolarHBondContact O-N 3.46Å; L325-S328 CarbonylContact O-C 3.54Å; L325-S328 PolarHBondContact O-N 3.21Å; L325-S328 PolarHBondContact O-OG 3.4Å; L325-V332 HydrophobicContact CD2-CB 3.88Å; L325-V332 HydrophobicContact CD2-CG2 4.29Å
326	Q	41	Very low	56.2	Low	164 Å²	164	76.5 Å²	76.5	77%	0.766	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.4	174.4	-84.3	178.4	-88.7	0	0	114	R322 K324 S328	R322-Q326 PolarHBondContact O-N 3.24Å; K324-Q326 VanDerWaalsContact C-N 3.34Å; Q326-S328 VanDerWaalsContact C-N 3.32Å
327	A	45.9	Very low	58.2	Low	93 Å²	93	71.6 Å²	71.6	77%	0.769	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-7.4	170.5	0	0	0	0	0	113	K324 L325	K324-A327 PolarHBondContact O-N 3.38Å; L325-A327 PolarHBondContact O-N 3.46Å
328	S	55.7	Low	59.9	Low	46 Å²	46	73 Å²	73	32%	0.322	37%	0.367	S	S	.	.	S	Bend	trans	-116.3	124.5	175.4	58	0	0	0	0	110	L325 Q326 C330	L325-S328 CarbonylContact O-C 3.54Å; L325-S328 PolarHBondContact O-N 3.21Å; L325-S328 PolarHBondContact O-OG 3.4Å; Q326-S328 VanDerWaalsContact C-N 3.32Å; S328-C330 PolarHBondContact O-N 2.96Å
329	K	71	Confident	61	Low	123 Å²	123	68.8 Å²	68.8	54%	0.535	35%	0.352	S	S	.	.	S	Bend	trans	-63.7	-9.9	-178.2	-68.2	-177.4	-168.7	167.5	0	115.2	D344 I346	K329-D344 WeakPolarHBondContact CE-OD1 3.47Å; K329-D344 WeakPolarHBondContact CE-OD2 3.47Å; K329-D344 PolarHBondContact NZ-O 3.42Å; K329-D344 IonicContact NZ-OD1 2.67Å; K329-D344 PolarHBondContact NZ-OD1 3.22Å; K329-D344 IonicContact NZ-OD2 2.87Å; K329-D344 PolarHBondContact NZ-OD2 3.49Å; K329-I346 HydrophobicContact CB-CB 4.48Å; K329-I346 HydrophobicContact CB-CD1 3.81Å; K329-I346 HydrophobicContact CB-CG2 4.33Å; K329-I346 HydrophobicContact CD-CD1 3.85Å; K329-I346 HydrophobicContact CG-CD1 3.73Å
330	C	80.6	Confident	61.7	Low	10 Å²	10	67.9 Å²	67.9	7%	0.068	35%	0.346	C	S	.	.	S	Bend	trans	-82.5	145.7	179.4	-55.5	0	0	0	0	112	S328 E334 C348	S328-C330 PolarHBondContact O-N 2.96Å; C330-E334 HydrophobicContact CB-CB 4.12Å; C330-C348 WeakPolarHBondContact CA-SG 3.31Å; C330-C348 HydrophobicContact CB-CB 3.82Å; C330-C348 WeakPolarHBondContact CB-SG 3.39Å; C330-C348 WeakPolarHBondContact SG-CB 3.34Å; C330-C348 CovalentContact SG-SG 2.03Å; C330-C348 PolarHBondContact SG-SG 2.03Å
331	Y	84.3	Confident	62.5	Low	62 Å²	62	70.6 Å²	70.6	24%	0.243	36%	0.357	C	S	.	.			trans	-74.2	161.1	174.7	-58.6	-63.4	0	0	0	112.2	V333 E334 D695 A698	Y331-V333 PolarHBondContact O-N 3.06Å; Y331-V333 VanDerWaalsContact O-N 3.11Å; Y331-E334 WeakPolarHBondContact CD2-OE2 3.32Å; Y331-E334 PolarHBondContact N-OE2 3.12Å; Y331-E334 WeakPolarHBondContact O-CA 3.17Å; Y331-E334 WeakPolarHBondContact O-CB 3.45Å; Y331-E334 PolarHBondContact O-N 3.08Å; Y331-D695 WeakPolarHBondContact OH-CB 3.5Å; Y331-A698 HydrophobicContact CD1-CB 3.3Å; Y331-A698 HydrophobicContact CE1-CB 3.58Å; Y331-A698 HydrophobicContact CG-CB 4.31Å
332	V	82.8	Confident	63	Low	41 Å²	41	68 Å²	68	25%	0.248	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-23.8	177.8	68.6	0	0	0	0	113.8	L325 E334 R351 L704	L325-V332 HydrophobicContact CD2-CB 3.88Å; L325-V332 HydrophobicContact CD2-CG2 4.29Å; V332-E334 VanDerWaalsContact C-N 3.27Å; V332-R351 PolarHBondContact O-NH1 2.8Å; V332-L704 HydrophobicContact CG1-CB 4.22Å; V332-L704 HydrophobicContact CG1-CD2 3.95Å; V332-L704 HydrophobicContact CG1-CG 3.72Å
333	V	84.5	Confident	63.5	Low	1 Å²	1	70.6 Å²	70.6	1%	0.006	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.3	174.7	69.6	0	0	0	0	112.4	Y331 R351 A354 L356 L704	Y331-V333 PolarHBondContact O-N 3.06Å; Y331-V333 VanDerWaalsContact O-N 3.11Å; V333-R351 WeakPolarHBondContact O-CB 3.23Å; V333-R351 WeakPolarHBondContact O-CG 3.32Å; V333-R351 PolarHBondContact O-N 3.5Å; V333-A354 HydrophobicContact CG2-CB 3.45Å; V333-A354 VanDerWaalsContact CG2-CB 3.45Å; V333-L356 HydrophobicContact CB-CD1 4.38Å; V333-L356 HydrophobicContact CG1-CD1 3.85Å; V333-L356 HydrophobicContact CG1-CD2 4.06Å; V333-L356 HydrophobicContact CG2-CB 4.4Å; V333-L356 HydrophobicContact CG2-CD1 4.14Å; V333-L356 HydrophobicContact CG2-CD2 4.48Å; V333-L704 HydrophobicContact CB-CD1 4.14Å; V333-L704 HydrophobicContact CB-CG 4.41Å; V333-L704 HydrophobicContact CG1-CD1 4.13Å; V333-L704 HydrophobicContact CG1-CD2 4.12Å; V333-L704 HydrophobicContact CG1-CG 4.45Å
334	E	86.4	Confident	64.3	Low	31 Å²	31	72.2 Å²	72.2	15%	0.145	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	155.6	-179.2	-61.5	175.5	156.3	0	0	111.1	C330 Y331 V332 C348 A349 R350 R351	C330-E334 HydrophobicContact CB-CB 4.12Å; Y331-E334 WeakPolarHBondContact CD2-OE2 3.32Å; Y331-E334 PolarHBondContact N-OE2 3.12Å; Y331-E334 WeakPolarHBondContact O-CA 3.17Å; Y331-E334 WeakPolarHBondContact O-CB 3.45Å; Y331-E334 PolarHBondContact O-N 3.08Å; V332-E334 VanDerWaalsContact C-N 3.27Å; E334-C348 HydrophobicContact CB-CB 4.09Å; E334-A349 CarbonylContact C-O 3.37Å; E334-A349 VanDerWaalsContact CA-O 3.23Å; E334-A349 WeakPolarHBondContact CA-O 3.44Å; E334-R350 HydrophobicContact CG-CG 4.25Å; E334-R351 PolarHBondContact O-NH1 3.1Å
335	I	82.1	Confident	65.3	Low	1 Å²	1	71.5 Å²	71.5	1%	0.005	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	127.8	175.9	-55.3	-169.6	0	0	0	106.4	L337 C348 A349 R351 K432 E434 V464 F466	I335-L337 PolarHBondContact O-N 3.48Å; I335-L337 VanDerWaalsContact O-N 3.15Å; I335-C348 CarbonylContact O-C 3.58Å; I335-C348 WeakPolarHBondContact O-CA 3.49Å; I335-A349 PolarHBondContact N-O 3.26Å; I335-A349 PolarHBondContact O-N 3.18Å; I335-R351 HydrophobicContact CD1-CG 3.96Å; I335-R351 HydrophobicContact CG1-CG 3.82Å; I335-K432 HydrophobicContact CG2-CD 4.06Å; I335-E434 WeakPolarHBondContact CG2-OE1 3.42Å; I335-V464 HydrophobicContact CD1-CB 3.73Å; I335-V464 HydrophobicContact CD1-CG1 3.3Å; I335-V464 HydrophobicContact CG1-CG1 4.29Å; I335-F466 HydrophobicContact CD1-CB 3.93Å
336	L	83	Confident	66.5	Low	64 Å²	64	71 Å²	71	34%	0.335	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	111.5	171.3	179.5	65.5	0	0	0	108.6	I346 K432	L336-I346 HydrophobicContact CD1-CB 4.48Å; L336-I346 HydrophobicContact CD1-CG2 3.3Å; L336-K432 PolarHBondContact O-NZ 3.04Å
337	L	77.3	Confident	68.3	Low	35 Å²	35	66.4 Å²	66.4	18%	0.183	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-52.2	177.1	-70.4	-172.8	0	0	0	110.5	I335 T347 A349 K432 F466 T469	I335-L337 PolarHBondContact O-N 3.48Å; I335-L337 VanDerWaalsContact O-N 3.15Å; L337-T347 PolarHBondContact N-O 2.88Å; L337-A349 HydrophobicContact CD1-CB 3.6Å; L337-A349 HydrophobicContact CD2-CB 3.86Å; L337-A349 HydrophobicContact CG-CB 3.6Å; L337-K432 PolarHBondContact O-NZ 2.72Å; L337-F466 HydrophobicContact CD1-CE2 4.35Å; L337-F466 HydrophobicContact CD2-CD1 4.23Å; L337-F466 HydrophobicContact CD2-CD2 3.92Å; L337-F466 HydrophobicContact CD2-CE1 4.14Å; L337-F466 HydrophobicContact CD2-CE2 3.79Å; L337-F466 HydrophobicContact CD2-CG 4.13Å; L337-F466 HydrophobicContact CD2-CZ 3.9Å; L337-T469 WeakPolarHBondContact CD1-OG1 3.38Å
338	Y	69.7	Low	70.2	Confident	126 Å²	126	63.8 Å²	63.8	49%	0.494	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	140.9	179.4	-178.6	-109.2	0	0	0	109.5	E340 T347	Y338-E340 HydrophobicContact CD1-CB 4.35Å; Y338-E340 HydrophobicContact CE1-CB 3.59Å; Y338-E340 HydrophobicContact CE1-CG 4Å; Y338-T347 WeakPolarHBondContact CB-OG1 3.47Å; Y338-T347 PolarHBondContact N-OG1 3.02Å; Y338-T347 PolarHBondContact O-N 3.25Å; Y338-T347 PolarHBondContact O-OG1 3.31Å
339	S	57.4	Low	71.7	Confident	47 Å²	47	61.6 Å²	61.6	33%	0.329	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	113.9	170.9	179	0	0	0	0	107.6
340	E	53.2	Low	72.6	Confident	83 Å²	83	56.8 Å²	56.8	39%	0.388	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	103	172.3	-154.4	170.1	176.4	0	0	109.2	Y338 A342 H343 D344 N345	Y338-E340 HydrophobicContact CD1-CB 4.35Å; Y338-E340 HydrophobicContact CE1-CB 3.59Å; Y338-E340 HydrophobicContact CE1-CG 4Å; E340-A342 HydrophobicContact CG-CB 4.39Å; E340-A342 PolarHBondContact O-N 3.02Å; E340-H343 PolarHBondContact O-N 3.22Å; E340-D344 PolarHBondContact O-N 3.02Å; E340-N345 PolarHBondContact N-O 3Å
341	Q	51.1	Low	73.1	Confident	134 Å²	134	57.9 Å²	57.9	63%	0.626	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.1	178.7	-83	159	-52.5	0	0	113.5	G143	G143-Q341 PolarHBondContact O-OE1 2.92Å; G143-Q341 VanDerWaalsContact O-OE1 3.13Å
342	A	49.6	Very low	73.4	Confident	46 Å²	46	55.1 Å²	55.1	38%	0.38	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-20.3	-178.3	0	0	0	0	0	114.5	E340	E340-A342 HydrophobicContact CG-CB 4.39Å; E340-A342 PolarHBondContact O-N 3.02Å
343	H	52.3	Low	73.6	Confident	145 Å²	145	57.6 Å²	57.6	67%	0.671	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.8	8.3	-178.4	-93.9	25.5	0	0	0	114.1	E340 N345	E340-H343 PolarHBondContact O-N 3.22Å; H343-N345 HydrophobicContact CB-CB 4.41Å; H343-N345 PolarHBondContact O-N 3.41Å
344	D	54.9	Low	73.6	Confident	97 Å²	97	57.7 Å²	57.7	52%	0.519	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	24	-177.3	-158.9	12.2	0	0	0	112.9	K329 E340 I346	K329-D344 WeakPolarHBondContact CE-OD1 3.47Å; K329-D344 WeakPolarHBondContact CE-OD2 3.47Å; K329-D344 PolarHBondContact NZ-O 3.42Å; K329-D344 IonicContact NZ-OD1 2.67Å; K329-D344 PolarHBondContact NZ-OD1 3.22Å; K329-D344 IonicContact NZ-OD2 2.87Å; K329-D344 PolarHBondContact NZ-OD2 3.49Å; E340-D344 PolarHBondContact O-N 3.02Å; D344-I346 PolarHBondContact O-N 2.62Å
345	N	62.9	Low	73.8	Confident	100 Å²	100	59 Å²	59	54%	0.535	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	96.6	178.2	-82.2	-17.1	0	0	0	108.2	E340 H343	E340-N345 PolarHBondContact N-O 3Å; H343-N345 HydrophobicContact CB-CB 4.41Å; H343-N345 PolarHBondContact O-N 3.41Å
346	I	71.2	Confident	74.1	Confident	41 Å²	41	59 Å²	59	21%	0.21	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.4	179.2	-66.2	177.8	0	0	0	107.6	K329 L336 D344	K329-I346 HydrophobicContact CB-CB 4.48Å; K329-I346 HydrophobicContact CB-CD1 3.81Å; K329-I346 HydrophobicContact CB-CG2 4.33Å; K329-I346 HydrophobicContact CD-CD1 3.85Å; K329-I346 HydrophobicContact CG-CD1 3.73Å; L336-I346 HydrophobicContact CD1-CB 4.48Å; L336-I346 HydrophobicContact CD1-CG2 3.3Å; D344-I346 PolarHBondContact O-N 2.62Å
347	T	79.4	Confident	74.5	Confident	69 Å²	69	56.5 Å²	56.5	42%	0.423	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.8	172.7	59.9	0	0	0	0	110.1	L337 Y338	L337-T347 PolarHBondContact N-O 2.88Å; Y338-T347 WeakPolarHBondContact CB-OG1 3.47Å; Y338-T347 PolarHBondContact N-OG1 3.02Å; Y338-T347 PolarHBondContact O-N 3.25Å; Y338-T347 PolarHBondContact O-OG1 3.31Å
348	C	84.6	Confident	75.2	Confident	38 Å²	38	55.4 Å²	55.4	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	142.9	-179.3	-49	0	0	0	0	109.3	C330 E334 I335	C330-C348 WeakPolarHBondContact CA-SG 3.31Å; C330-C348 HydrophobicContact CB-CB 3.82Å; C330-C348 WeakPolarHBondContact CB-SG 3.39Å; C330-C348 WeakPolarHBondContact SG-CB 3.34Å; C330-C348 CovalentContact SG-SG 2.03Å; C330-C348 PolarHBondContact SG-SG 2.03Å; E334-C348 HydrophobicContact CB-CB 4.09Å; I335-C348 CarbonylContact O-C 3.58Å; I335-C348 WeakPolarHBondContact O-CA 3.49Å
349	A	88	Confident	76.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	140.8	171.3	0	0	0	0	0	110.7	E334 I335 L337 F466 T469	E334-A349 CarbonylContact C-O 3.37Å; E334-A349 VanDerWaalsContact CA-O 3.23Å; E334-A349 WeakPolarHBondContact CA-O 3.44Å; I335-A349 PolarHBondContact N-O 3.26Å; I335-A349 PolarHBondContact O-N 3.18Å; L337-A349 HydrophobicContact CD1-CB 3.6Å; L337-A349 HydrophobicContact CD2-CB 3.86Å; L337-A349 HydrophobicContact CG-CB 3.6Å; A349-F466 HydrophobicContact CB-CB 4.02Å; A349-F466 HydrophobicContact CB-CD2 3.76Å; A349-F466 HydrophobicContact CB-CG 4.2Å; A349-T469 HydrophobicContact CB-CG2 3.6Å
350	R	90	Very high	77.5	Confident	21 Å²	21	54.5 Å²	54.5	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	144.4	179.2	-63.5	173.7	-175.9	155	7.3	110.5	E334 C352 L356 F466 L467 M691	E334-R350 HydrophobicContact CG-CG 4.25Å; R350-C352 PolarHBondContact O-N 3.34Å; R350-L356 HydrophobicContact CG-CD2 4.34Å; R350-F466 CarbonylContact O-C 3.51Å; R350-F466 VanDerWaalsContact O-CA 3.31Å; R350-F466 WeakPolarHBondContact O-CA 3.31Å; R350-F466 WeakPolarHBondContact O-CB 3.35Å; R350-L467 PolarHBondContact O-N 3.06Å; R350-M691 VanDerWaalsContact NH2-CE 3.35Å; R350-M691 PolarHBondContact NH2-SD 3.09Å
351	R	90.4	Very high	79.2	Confident	34 Å²	34	56 Å²	56	13%	0.128	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-59.1	135.6	169.5	-80.3	178.3	174.2	75.5	-8.7	110.6	V332 V333 E334 I335 N353 A354 V464 T465 E706	V332-R351 PolarHBondContact O-NH1 2.8Å; V333-R351 WeakPolarHBondContact O-CB 3.23Å; V333-R351 WeakPolarHBondContact O-CG 3.32Å; V333-R351 PolarHBondContact O-N 3.5Å; E334-R351 PolarHBondContact O-NH1 3.1Å; I335-R351 HydrophobicContact CD1-CG 3.96Å; I335-R351 HydrophobicContact CG1-CG 3.82Å; R351-N353 PolarHBondContact O-N 3.11Å; R351-A354 HydrophobicContact CB-CB 3.83Å; R351-A354 PolarHBondContact O-N 2.79Å; R351-V464 HydrophobicContact CG-CG1 4.43Å; R351-T465 WeakPolarHBondContact CA-O 3.4Å; R351-E706 VanDerWaalsContact CD-CG 3.49Å; R351-E706 VanDerWaalsContact CD-O 3.32Å; R351-E706 WeakPolarHBondContact CD-O 3.37Å; R351-E706 VanDerWaalsContact CZ-CG 3.4Å; R351-E706 IonicContact CZ-OE1 2.79Å; R351-E706 IonicContact NE-OE1 2.99Å; R351-E706 PolarHBondContact NE-OE1 3.06Å; R351-E706 IonicContact NH2-OE1 2.75Å; R351-E706 PolarHBondContact NH2-OE1 2.89Å
352	C	91.4	Very high	81	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.027	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-40.5	-170.7	-156.3	0	0	0	0	112.6	R350 A354 C429 T465	R350-C352 PolarHBondContact O-N 3.34Å; C352-A354 VanDerWaalsContact C-N 3.35Å; C352-C429 HydrophobicContact CB-CB 3.6Å; C352-C429 WeakPolarHBondContact CB-SG 3.22Å; C352-C429 WeakPolarHBondContact SG-CA 3.44Å; C352-C429 WeakPolarHBondContact SG-CB 3.41Å; C352-C429 CovalentContact SG-SG 2Å; C352-C429 PolarHBondContact SG-SG 3.35Å; C352-T465 PolarHBondContact N-O 3.48Å
353	N	85.6	Confident	83.1	Confident	93 Å²	93	50.8 Å²	50.8	50%	0.497	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	7.3	-177.8	-68	-34.1	0	0	0	113.5	R351	R351-N353 PolarHBondContact O-N 3.11Å
354	A	86.3	Confident	85	Confident	3 Å²	3	52.1 Å²	52.1	3%	0.025	26%	0.26	C	S	.	.			trans	-74.7	144.1	177.8	0	0	0	0	0	112	V333 R351 C352 L356 K363 Y707	V333-A354 HydrophobicContact CG2-CB 3.45Å; V333-A354 VanDerWaalsContact CG2-CB 3.45Å; R351-A354 HydrophobicContact CB-CB 3.83Å; R351-A354 PolarHBondContact O-N 2.79Å; C352-A354 VanDerWaalsContact C-N 3.35Å; A354-L356 PolarHBondContact O-N 2.91Å; A354-K363 PolarHBondContact O-NZ 2.99Å; A354-Y707 CarbonylContact C-O 3.52Å; A354-Y707 WeakPolarHBondContact CA-O 3.4Å
355	H	89.5	Confident	86.8	Confident	58 Å²	58	52.2 Å²	52.2	27%	0.269	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-98.2	70.7	175.3	-60.9	-63.7	0	0	0	109.8	Y358 Y707 T709 W711	H355-Y358 WeakPolarHBondContact CA-O 3.34Å; H355-Y358 WeakPolarHBondContact CB-O 3.33Å; H355-Y707 PolarHBondContact N-O 3.47Å; H355-T709 PolarHBondContact O-N 3.25Å; H355-W711 PolarHBondContact O-NE1 2.95Å; H355-W711 VanDerWaalsContact O-NE1 3.07Å
356	L	89	Confident	88.3	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.231	C	C	.	.	S	Bend	trans	-81.7	-62.5	-170.9	-177.1	58.3	0	0	0	111	V333 R350 A354 E547 L694 L704 T709	V333-L356 HydrophobicContact CB-CD1 4.38Å; V333-L356 HydrophobicContact CG1-CD1 3.85Å; V333-L356 HydrophobicContact CG1-CD2 4.06Å; V333-L356 HydrophobicContact CG2-CB 4.4Å; V333-L356 HydrophobicContact CG2-CD1 4.14Å; V333-L356 HydrophobicContact CG2-CD2 4.48Å; R350-L356 HydrophobicContact CG-CD2 4.34Å; A354-L356 PolarHBondContact O-N 2.91Å; L356-E547 PolarHBondContact N-OE1 2.82Å; L356-L694 HydrophobicContact CD1-CD2 3.42Å; L356-L694 VanDerWaalsContact CD1-CD2 3.42Å; L356-L694 HydrophobicContact CD2-CD1 3.86Å; L356-L694 HydrophobicContact CD2-CD2 4.04Å; L356-L694 HydrophobicContact CG-CD1 4.47Å; L356-L694 HydrophobicContact CG-CD2 3.74Å; L356-L704 HydrophobicContact CD1-CD1 3.61Å; L356-T709 PolarHBondContact O-OG1 2.87Å
357	F	90.5	Very high	89.4	Confident	10 Å²	10	48.1 Å²	48.1	4%	0.044	24%	0.235	C	C	.	.	S	Bend	trans	-96.8	-21	177.9	-66.1	-59.8	0	0	0	113.5	E547 W690 M691 L694 W711 F723 P724	F357-E547 WeakPolarHBondContact CB-OE2 3.49Å; F357-E547 WeakPolarHBondContact CD2-OE2 3.47Å; F357-E547 PolarHBondContact N-OE1 3.09Å; F357-E547 PolarHBondContact N-OE2 3.27Å; F357-E547 VanDerWaalsContact N-OE2 3.09Å; F357-W690 HydrophobicContact CE1-CB 4.04Å; F357-W690 HydrophobicContact CZ-CB 4.27Å; F357-M691 HydrophobicContact CE2-CE 4.04Å; F357-M691 HydrophobicContact CZ-CE 3.55Å; F357-L694 HydrophobicContact CD1-CD2 4.46Å; F357-L694 HydrophobicContact CE1-CD1 4.05Å; F357-L694 HydrophobicContact CE1-CD2 3.69Å; F357-L694 HydrophobicContact CE1-CG 3.75Å; F357-L694 HydrophobicContact CE2-CD1 4.14Å; F357-L694 HydrophobicContact CZ-CD1 3.4Å; F357-L694 VanDerWaalsContact CZ-CD1 3.4Å; F357-L694 HydrophobicContact CZ-CD2 3.9Å; F357-L694 HydrophobicContact CZ-CG 3.64Å; F357-W711 WeakPolarHBondContact O-CH2 3.31Å; F357-F723 HydrophobicContact CD1-CD1 4.02Å; F357-P724 HydrophobicContact CB-CG 3.58Å; F357-P724 HydrophobicContact CD1-CG 4.01Å; F357-P724 HydrophobicContact CD2-CG 4.45Å; F357-P724 HydrophobicContact CG-CG 3.78Å
358	Y	91.6	Very high	90.1	Very high	12 Å²	12	49.4 Å²	49.4	5%	0.047	24%	0.238	C	C	.	.	S	Bend	trans	-133.4	139.3	-170.9	-52.5	-73.4	0	0	0	112.8	H355 E362 K363 E547 L548 P724 V726 N729	H355-Y358 WeakPolarHBondContact CA-O 3.34Å; H355-Y358 WeakPolarHBondContact CB-O 3.33Å; Y358-E362 WeakPolarHBondContact CA-OE2 3.17Å; Y358-K363 WeakPolarHBondContact O-CE 3.41Å; Y358-E547 HydrophobicContact CD2-CB 4.4Å; Y358-L548 HydrophobicContact CD1-CD1 3.87Å; Y358-L548 HydrophobicContact CD2-CB 3.72Å; Y358-L548 HydrophobicContact CD2-CD1 4.12Å; Y358-L548 HydrophobicContact CD2-CG 4.43Å; Y358-L548 HydrophobicContact CE1-CB 4.48Å; Y358-L548 HydrophobicContact CE1-CD1 4.22Å; Y358-L548 HydrophobicContact CE1-CD2 4.05Å; Y358-L548 HydrophobicContact CE1-CG 4.49Å; Y358-L548 HydrophobicContact CE2-CB 3.54Å; Y358-L548 HydrophobicContact CE2-CD1 4.49Å; Y358-L548 HydrophobicContact CE2-CD2 4.48Å; Y358-L548 HydrophobicContact CE2-CG 4.38Å; Y358-L548 HydrophobicContact CG-CB 4.25Å; Y358-L548 HydrophobicContact CG-CD1 3.75Å; Y358-L548 HydrophobicContact CG-CG 4.49Å; Y358-P724 HydrophobicContact CE1-CB 4.37Å; Y358-P724 HydrophobicContact CE1-CG 3.95Å; Y358-P724 WeakPolarHBondContact CE1-O 3.28Å; Y358-P724 HydrophobicContact CE2-CG 4.19Å; Y358-P724 WeakPolarHBondContact OH-CB 3.44Å; Y358-P724 WeakPolarHBondContact OH-CG 3.46Å; Y358-V726 HydrophobicContact CD1-CG2 3.34Å; Y358-V726 HydrophobicContact CE1-CG2 3.59Å; Y358-V726 HydrophobicContact CG-CG2 4.5Å; Y358-N729 PolarHBondContact OH-ND2 3.46Å
359	K	88.4	Confident	90.6	Very high	80 Å²	80	50 Å²	50	35%	0.348	24%	0.235	S	C	.	.			trans	-69.5	155.2	174.8	-65.6	178.1	-178.6	178.5	0	111.1	I361 E362 K363 W711	K359-I361 VanDerWaalsContact C-N 3.26Å; K359-I361 HydrophobicContact CB-CG2 4.09Å; K359-I361 PolarHBondContact O-N 3.11Å; K359-E362 HydrophobicContact CB-CG 4.18Å; K359-E362 PolarHBondContact N-OE2 3.15Å; K359-E362 PolarHBondContact O-N 3.41Å; K359-E362 VanDerWaalsContact O-N 3.16Å; K359-K363 PolarHBondContact O-N 3.49Å; K359-K363 VanDerWaalsContact O-N 3.14Å; K359-W711 HydrophobicContact CG-CD2 3.89Å; K359-W711 HydrophobicContact CG-CE3 4.28Å; K359-W711 HydrophobicContact CG-CG 4.04Å
360	P	87.8	Confident	91	Very high	74 Å²	74	50.4 Å²	50.4	48%	0.481	24%	0.237	S	C	.	.	H	α-helix	trans	-57.1	-37.8	176.9	19.4	-31.5	0	0	0	113.3	E362 K363 R364	P360-E362 VanDerWaalsContact C-N 3.35Å; P360-E362 PolarHBondContact O-N 3.1Å; P360-K363 PolarHBondContact O-N 3.45Å; P360-R364 PolarHBondContact O-N 3.32Å
361	I	88	Confident	91.3	Very high	116 Å²	116	52.5 Å²	52.5	60%	0.595	25%	0.25	S	C	*	.	H	α-helix	trans	-64.7	-38.4	178.6	-171.7	59.9	0	0	0	112.3	K359 R364 F365	K359-I361 VanDerWaalsContact C-N 3.26Å; K359-I361 HydrophobicContact CB-CG2 4.09Å; K359-I361 PolarHBondContact O-N 3.11Å; I361-R364 PolarHBondContact O-N 3.03Å; I361-F365 WeakPolarHBondContact O-CB 3.41Å; I361-F365 PolarHBondContact O-N 2.87Å
362	E	90.8	Very high	91.6	Very high	57 Å²	57	54.4 Å²	54.4	27%	0.266	26%	0.264	S	S	.	.	H	α-helix	trans	-68.2	-42.2	178.1	-66	165.7	169.3	0	0	110.9	Y358 K359 P360 R364 F365 A366 V726	Y358-E362 WeakPolarHBondContact CA-OE2 3.17Å; K359-E362 HydrophobicContact CB-CG 4.18Å; K359-E362 PolarHBondContact N-OE2 3.15Å; K359-E362 PolarHBondContact O-N 3.41Å; K359-E362 VanDerWaalsContact O-N 3.16Å; P360-E362 VanDerWaalsContact C-N 3.35Å; P360-E362 PolarHBondContact O-N 3.1Å; E362-R364 VanDerWaalsContact C-N 3.34Å; E362-R364 PolarHBondContact O-N 3.16Å; E362-F365 PolarHBondContact O-N 2.81Å; E362-A366 WeakPolarHBondContact O-CB 3.23Å; E362-A366 PolarHBondContact O-N 3.32Å; E362-V726 HydrophobicContact CB-CG1 4.5Å; E362-V726 HydrophobicContact CB-CG2 4Å; E362-V726 HydrophobicContact CG-CG2 4.14Å
363	K	92.7	Very high	91.9	Very high	13 Å²	13	57 Å²	57	6%	0.057	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-41.1	173.9	-64.9	-176.9	-177.8	-171.3	0	111.8	A354 Y358 K359 P360 N367 E547 L548	A354-K363 PolarHBondContact O-NZ 2.99Å; Y358-K363 WeakPolarHBondContact O-CE 3.41Å; K359-K363 PolarHBondContact O-N 3.49Å; K359-K363 VanDerWaalsContact O-N 3.14Å; P360-K363 PolarHBondContact O-N 3.45Å; K363-N367 PolarHBondContact O-N 3.2Å; K363-N367 VanDerWaalsContact O-N 3.12Å; K363-E547 WeakPolarHBondContact CE-O 3.4Å; K363-E547 WeakPolarHBondContact CE-OE1 3.37Å; K363-E547 IonicContact NZ-OE1 2.77Å; K363-E547 PolarHBondContact NZ-OE1 3.33Å; K363-L548 HydrophobicContact CG-CD1 4.36Å
364	R	92.3	Very high	92.5	Very high	173 Å²	173	52.6 Å²	52.6	65%	0.653	25%	0.25	S	S	*	.	H	α-helix	trans	-66.6	-43.6	176.1	-173.5	177.7	-178.2	-179.2	0.9	111.6	P360 I361 E362 N367 I368	P360-R364 PolarHBondContact O-N 3.32Å; I361-R364 PolarHBondContact O-N 3.03Å; E362-R364 VanDerWaalsContact C-N 3.34Å; E362-R364 PolarHBondContact O-N 3.16Å; R364-N367 PolarHBondContact O-N 3.44Å; R364-I368 HydrophobicContact CG-CD1 4.21Å; R364-I368 WeakPolarHBondContact O-CG1 3.3Å; R364-I368 PolarHBondContact O-N 3.4Å; R364-I368 VanDerWaalsContact O-N 3.17Å
365	F	93.3	Very high	93	Very high	98 Å²	98	56.7 Å²	56.7	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-59.7	-46.6	175.7	178.2	-99.6	0	0	0	111.3	I361 E362 N367 I368 W369 M730	I361-F365 WeakPolarHBondContact O-CB 3.41Å; I361-F365 PolarHBondContact O-N 2.87Å; E362-F365 PolarHBondContact O-N 2.81Å; F365-N367 VanDerWaalsContact C-N 3.34Å; F365-N367 PolarHBondContact O-N 3.04Å; F365-I368 PolarHBondContact O-N 3.45Å; F365-W369 HydrophobicContact CE1-CE3 4.4Å; F365-W369 AromaticContact CZ-CE3 3.92Å; F365-W369 HydrophobicContact CZ-CE3 3.92Å; F365-W369 HydrophobicContact CZ-CZ3 4.45Å; F365-W369 WeakPolarHBondContact O-CB 3.34Å; F365-W369 PolarHBondContact O-N 3.48Å; F365-M730 HydrophobicContact CE1-CG 4.27Å
366	A	94.2	Very high	93.4	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.4	-47.9	176.2	0	0	0	0	0	112	E362 I368 W369 M370 L548 M730	E362-A366 WeakPolarHBondContact O-CB 3.23Å; E362-A366 PolarHBondContact O-N 3.32Å; A366-I368 PolarHBondContact O-N 2.84Å; A366-W369 PolarHBondContact O-N 3.39Å; A366-M370 WeakPolarHBondContact O-CE 3.39Å; A366-M370 WeakPolarHBondContact O-CG 3.28Å; A366-M370 PolarHBondContact O-N 3.29Å; A366-L548 HydrophobicContact CB-CD1 3.98Å; A366-L548 HydrophobicContact CB-CG 4.06Å; A366-M730 HydrophobicContact CB-CE 3.35Å; A366-M730 HydrophobicContact CB-SD 3.88Å
367	N	92.9	Very high	93.7	Very high	55 Å²	55	57.9 Å²	57.9	29%	0.294	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-45.5	178.3	-76.3	-10.6	0	0	0	113	K363 R364 F365 M370 L371 R424 T549	K363-N367 PolarHBondContact O-N 3.2Å; K363-N367 VanDerWaalsContact O-N 3.12Å; R364-N367 PolarHBondContact O-N 3.44Å; F365-N367 VanDerWaalsContact C-N 3.34Å; F365-N367 PolarHBondContact O-N 3.04Å; N367-M370 VanDerWaalsContact OD1-CE 3.3Å; N367-M370 WeakPolarHBondContact OD1-CE 3.44Å; N367-L371 WeakPolarHBondContact O-CB 3.48Å; N367-L371 PolarHBondContact O-N 3.2Å; N367-R424 PolarHBondContact ND2-NH1 3.11Å; N367-T549 PolarHBondContact OD1-O 2.64Å
368	I	94.9	Very high	94	Very high	96 Å²	96	59.6 Å²	59.6	49%	0.492	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-45.9	178.2	-64.6	166.2	0	0	0	110.4	R364 F365 A366 M370 L371 V372	R364-I368 HydrophobicContact CG-CD1 4.21Å; R364-I368 WeakPolarHBondContact O-CG1 3.3Å; R364-I368 PolarHBondContact O-N 3.4Å; R364-I368 VanDerWaalsContact O-N 3.17Å; F365-I368 PolarHBondContact O-N 3.45Å; A366-I368 PolarHBondContact O-N 2.84Å; I368-M370 PolarHBondContact O-N 3.41Å; I368-L371 PolarHBondContact O-N 3.43Å; I368-V372 HydrophobicContact CG2-CG2 4.37Å; I368-V372 WeakPolarHBondContact O-CG2 3.49Å; I368-V372 PolarHBondContact O-N 2.92Å
369	W	95.7	Very high	94.2	Very high	52 Å²	52	61.7 Å²	61.7	20%	0.197	31%	0.308	C	S	.	.	H	α-helix	trans	-56.5	-51	179.5	-179.5	-96.8	0	0	0	112	M80 F365 A366 L371 V372 W373 M730 F734	M80-W369 HydrophobicContact CE-CH2 4.35Å; F365-W369 HydrophobicContact CE1-CE3 4.4Å; F365-W369 AromaticContact CZ-CE3 3.92Å; F365-W369 HydrophobicContact CZ-CE3 3.92Å; F365-W369 HydrophobicContact CZ-CZ3 4.45Å; F365-W369 WeakPolarHBondContact O-CB 3.34Å; F365-W369 PolarHBondContact O-N 3.48Å; A366-W369 PolarHBondContact O-N 3.39Å; W369-L371 PolarHBondContact O-N 3.38Å; W369-V372 PolarHBondContact O-N 2.91Å; W369-W373 AromaticContact CD1-CD1 3.97Å; W369-W373 AromaticContact CD2-CD1 3.82Å; W369-W373 AromaticContact CD2-NE1 3.65Å; W369-W373 AromaticContact CE2-CD1 3.56Å; W369-W373 AromaticContact CE2-NE1 3.28Å; W369-W373 VanDerWaalsContact CE2-NE1 3.28Å; W369-W373 AromaticContact CE3-NE1 3.93Å; W369-W373 AromaticContact CH2-NE1 3.58Å; W369-W373 AromaticContact CZ2-CD1 3.98Å; W369-W373 AromaticContact CZ2-NE1 3.25Å; W369-W373 VanDerWaalsContact CZ2-NE1 3.25Å; W369-W373 AromaticContact CZ3-NE1 3.9Å; W369-W373 AromaticContact NE1-CD1 3.65Å; W369-W373 AromaticContact NE1-NE1 3.86Å; W369-W373 PolarHBondContact O-N 3.47Å; W369-M730 HydrophobicContact CB-SD 4.04Å; W369-M730 VanDerWaalsContact CD1-SD 3.52Å; W369-M730 HydrophobicContact CG-SD 3.88Å; W369-M730 PolarHBondContact NE1-O 3.48Å; W369-F734 HydrophobicContact CZ2-CB 4.1Å; W369-F734 HydrophobicContact CZ2-CG 4.4Å
370	M	94.9	Very high	94.5	Very high	7 Å²	7	58.6 Å²	58.6	3%	0.034	30%	0.296	C	S	.	.	H	α-helix	trans	-59.5	-45.2	178.4	-66.7	-174.6	-69.5	0	0	112	A366 N367 I368 W373 A374 F416 T549 L551 I733	A366-M370 WeakPolarHBondContact O-CE 3.39Å; A366-M370 WeakPolarHBondContact O-CG 3.28Å; A366-M370 PolarHBondContact O-N 3.29Å; N367-M370 VanDerWaalsContact OD1-CE 3.3Å; N367-M370 WeakPolarHBondContact OD1-CE 3.44Å; I368-M370 PolarHBondContact O-N 3.41Å; M370-W373 PolarHBondContact O-N 2.79Å; M370-A374 WeakPolarHBondContact O-CB 3.19Å; M370-A374 PolarHBondContact O-N 3.1Å; M370-F416 HydrophobicContact CB-CD1 4.31Å; M370-F416 HydrophobicContact SD-CD1 4.23Å; M370-F416 HydrophobicContact SD-CE1 4.31Å; M370-T549 HydrophobicContact CE-CG2 3.67Å; M370-T549 HydrophobicContact SD-CG2 3.4Å; M370-T549 WeakPolarHBondContact SD-CG2 3.41Å; M370-L551 HydrophobicContact SD-CD1 3.8Å; M370-I733 HydrophobicContact CG-CD1 3.6Å; M370-I733 HydrophobicContact CG-CG2 4.1Å; M370-I733 HydrophobicContact SD-CD1 3.6Å; M370-I733 VanDerWaalsContact SD-CD1 3.6Å
371	L	96.6	Very high	94.9	Very high	66 Å²	66	55 Å²	55	35%	0.346	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-45.1	-177.5	-178.5	63.3	0	0	0	111.9	N367 I368 W369 A374 I375 I417 A420	N367-L371 WeakPolarHBondContact O-CB 3.48Å; N367-L371 PolarHBondContact O-N 3.2Å; I368-L371 PolarHBondContact O-N 3.43Å; W369-L371 PolarHBondContact O-N 3.38Å; L371-A374 PolarHBondContact O-N 3.22Å; L371-I375 HydrophobicContact CD1-CD1 3.93Å; L371-I375 HydrophobicContact CD1-CG1 4.27Å; L371-I375 HydrophobicContact CG-CD1 3.91Å; L371-I375 WeakPolarHBondContact O-CG1 3.48Å; L371-I375 PolarHBondContact O-N 3.25Å; L371-I417 HydrophobicContact CD1-CG1 4.4Å; L371-A420 HydrophobicContact CD1-CB 3.97Å
372	V	97.5	Very high	95.2	Very high	73 Å²	73	50.7 Å²	50.7	44%	0.442	26%	0.255	S	S	.	.	H	α-helix	trans	-59.5	-50.7	179.4	170	0	0	0	0	110.7	I368 W369 A374 I375 L376	I368-V372 HydrophobicContact CG2-CG2 4.37Å; I368-V372 WeakPolarHBondContact O-CG2 3.49Å; I368-V372 PolarHBondContact O-N 2.92Å; W369-V372 PolarHBondContact O-N 2.91Å; V372-A374 VanDerWaalsContact C-N 3.35Å; V372-A374 PolarHBondContact O-N 3.44Å; V372-I375 PolarHBondContact O-N 3.2Å; V372-L376 HydrophobicContact CG1-CD1 4.29Å; V372-L376 WeakPolarHBondContact O-CG 3.5Å; V372-L376 PolarHBondContact O-N 3.19Å
373	W	97.5	Very high	95.2	Very high	59 Å²	59	49.2 Å²	49.2	22%	0.223	25%	0.248	C	C	.	.	H	α-helix	trans	-68.8	-33.9	-179	-72.2	115.1	0	0	0	112.8	W369 M370 L376 C377 F734 L737 I741	W369-W373 AromaticContact CD1-CD1 3.97Å; W369-W373 AromaticContact CD2-CD1 3.82Å; W369-W373 AromaticContact CD2-NE1 3.65Å; W369-W373 AromaticContact CE2-CD1 3.56Å; W369-W373 AromaticContact CE2-NE1 3.28Å; W369-W373 VanDerWaalsContact CE2-NE1 3.28Å; W369-W373 AromaticContact CE3-NE1 3.93Å; W369-W373 AromaticContact CH2-NE1 3.58Å; W369-W373 AromaticContact CZ2-CD1 3.98Å; W369-W373 AromaticContact CZ2-NE1 3.25Å; W369-W373 VanDerWaalsContact CZ2-NE1 3.25Å; W369-W373 AromaticContact CZ3-NE1 3.9Å; W369-W373 AromaticContact NE1-CD1 3.65Å; W369-W373 AromaticContact NE1-NE1 3.86Å; W369-W373 PolarHBondContact O-N 3.47Å; M370-W373 PolarHBondContact O-N 2.79Å; W373-L376 HydrophobicContact CE3-CD1 3.96Å; W373-L376 HydrophobicContact CZ3-CD1 4.02Å; W373-C377 VanDerWaalsContact O-CB 3.27Å; W373-C377 WeakPolarHBondContact O-CB 3.21Å; W373-C377 PolarHBondContact O-N 2.97Å; W373-F734 AromaticContact CD2-CD2 3.79Å; W373-F734 HydrophobicContact CD2-CD2 3.79Å; W373-F734 HydrophobicContact CD2-CE2 4.21Å; W373-F734 AromaticContact CE2-CD2 3.52Å; W373-F734 AromaticContact CE2-CE2 3.89Å; W373-F734 HydrophobicContact CE3-CD2 4.12Å; W373-F734 HydrophobicContact CE3-CE2 4.14Å; W373-F734 HydrophobicContact CG-CD2 4.37Å; W373-F734 HydrophobicContact CH2-CD2 4.02Å; W373-F734 AromaticContact CH2-CE2 3.48Å; W373-F734 HydrophobicContact CH2-CE2 3.48Å; W373-F734 VanDerWaalsContact CH2-CE2 3.48Å; W373-F734 AromaticContact CZ2-CD2 3.65Å; W373-F734 HydrophobicContact CZ2-CD2 3.65Å; W373-F734 AromaticContact CZ2-CE2 3.52Å; W373-F734 HydrophobicContact CZ2-CE2 3.52Å; W373-F734 HydrophobicContact CZ3-CD2 4.23Å; W373-F734 AromaticContact CZ3-CE2 3.8Å; W373-F734 HydrophobicContact CZ3-CE2 3.8Å; W373-F734 AromaticContact NE1-CD2 3.92Å; W373-L737 HydrophobicContact CB-CB 4.43Å; W373-L737 HydrophobicContact CB-CD1 3.55Å; W373-I741 HydrophobicContact CE3-CD1 3.72Å; W373-I741 HydrophobicContact CZ3-CD1 3.95Å
374	A	97.7	Very high	95.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.8	-50.9	174.2	0	0	0	0	0	110.6	M370 L371 V372 L376 C377 L378 S413 F416 I417	M370-A374 WeakPolarHBondContact O-CB 3.19Å; M370-A374 PolarHBondContact O-N 3.1Å; L371-A374 PolarHBondContact O-N 3.22Å; V372-A374 VanDerWaalsContact C-N 3.35Å; V372-A374 PolarHBondContact O-N 3.44Å; A374-L376 VanDerWaalsContact C-N 3.3Å; A374-L376 PolarHBondContact O-N 3.18Å; A374-C377 PolarHBondContact O-N 3.28Å; A374-C377 VanDerWaalsContact O-N 3.1Å; A374-L378 WeakPolarHBondContact O-CB 3.4Å; A374-L378 PolarHBondContact O-N 3.4Å; A374-S413 WeakPolarHBondContact CA-OG 3.46Å; A374-S413 WeakPolarHBondContact CB-OG 3.36Å; A374-S413 PolarHBondContact O-OG 3.45Å; A374-F416 HydrophobicContact CB-CB 3.81Å; A374-F416 HydrophobicContact CB-CG 4.49Å; A374-I417 HydrophobicContact CB-CD1 4.39Å; A374-I417 HydrophobicContact CB-CG1 4.04Å
375	I	97.9	Very high	95.1	Very high	90 Å²	90	41.9 Å²	41.9	46%	0.462	22%	0.222	S	C	.	.	H	α-helix	trans	-57.5	-43.9	179.6	-67.7	166.9	0	0	0	111.6	L371 V372 L378 A379 I417	L371-I375 HydrophobicContact CD1-CD1 3.93Å; L371-I375 HydrophobicContact CD1-CG1 4.27Å; L371-I375 HydrophobicContact CG-CD1 3.91Å; L371-I375 WeakPolarHBondContact O-CG1 3.48Å; L371-I375 PolarHBondContact O-N 3.25Å; V372-I375 PolarHBondContact O-N 3.2Å; I375-L378 PolarHBondContact O-N 3.27Å; I375-A379 WeakPolarHBondContact O-CB 3.47Å; I375-A379 PolarHBondContact O-N 2.9Å; I375-I417 HydrophobicContact CG1-CD1 4.33Å
376	L	96.5	Very high	94.9	Very high	85 Å²	85	40.8 Å²	40.8	45%	0.445	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-43.1	176.9	-68.8	175.7	0	0	0	112.4	V372 W373 A374 S380 I741	V372-L376 HydrophobicContact CG1-CD1 4.29Å; V372-L376 WeakPolarHBondContact O-CG 3.5Å; V372-L376 PolarHBondContact O-N 3.19Å; W373-L376 HydrophobicContact CE3-CD1 3.96Å; W373-L376 HydrophobicContact CZ3-CD1 4.02Å; A374-L376 VanDerWaalsContact C-N 3.3Å; A374-L376 PolarHBondContact O-N 3.18Å; L376-S380 WeakPolarHBondContact O-CB 3.45Å; L376-S380 PolarHBondContact O-N 3.11Å; L376-S380 VanDerWaalsContact O-N 3.12Å; L376-I741 HydrophobicContact CB-CD1 4.03Å
377	C	97.1	Very high	94.6	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-48.5	176.9	-176	0	0	0	0	111.6	W373 A374 A379 S380 C381 L737 I741	W373-C377 VanDerWaalsContact O-CB 3.27Å; W373-C377 WeakPolarHBondContact O-CB 3.21Å; W373-C377 PolarHBondContact O-N 2.97Å; A374-C377 PolarHBondContact O-N 3.28Å; A374-C377 VanDerWaalsContact O-N 3.1Å; C377-A379 PolarHBondContact O-N 2.91Å; C377-S380 PolarHBondContact O-N 3.49Å; C377-C381 WeakPolarHBondContact O-CB 3.41Å; C377-C381 PolarHBondContact O-N 2.96Å; C377-C381 PolarHBondContact O-SG 2.6Å; C377-L737 HydrophobicContact CB-CB 4.28Å; C377-L737 HydrophobicContact CB-CD2 4.03Å; C377-I741 HydrophobicContact CB-CD1 4.49Å; C377-I741 HydrophobicContact CB-CG1 4.03Å
378	L	96.9	Very high	94.5	Very high	46 Å²	46	39.2 Å²	39.2	24%	0.241	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-45.7	179.7	-174.4	133.6	0	0	0	111.6	A374 I375 C381 A382 F410 T414 I417	A374-L378 WeakPolarHBondContact O-CB 3.4Å; A374-L378 PolarHBondContact O-N 3.4Å; I375-L378 PolarHBondContact O-N 3.27Å; L378-C381 PolarHBondContact O-N 3Å; L378-A382 VanDerWaalsContact O-CB 3.22Å; L378-A382 WeakPolarHBondContact O-CB 3.34Å; L378-A382 PolarHBondContact O-N 3.27Å; L378-F410 HydrophobicContact CD1-CD2 4.47Å; L378-F410 HydrophobicContact CD1-CE2 4.25Å; L378-F410 HydrophobicContact CD2-CE2 4.4Å; L378-F410 HydrophobicContact CG-CD2 4.12Å; L378-F410 HydrophobicContact CG-CE2 4.01Å; L378-T414 WeakPolarHBondContact CD1-OG1 3.49Å; L378-I417 HydrophobicContact CB-CD1 4.24Å; L378-I417 HydrophobicContact CD1-CD1 3.82Å; L378-I417 HydrophobicContact CG-CD1 4.48Å
379	A	95.4	Very high	94.2	Very high	56 Å²	56	38.8 Å²	38.8	46%	0.463	21%	0.208	S	C	.	.	H	α-helix	trans	-61.9	-45.9	177.8	0	0	0	0	0	112.3	I375 C377 C381 A382 M383	I375-A379 WeakPolarHBondContact O-CB 3.47Å; I375-A379 PolarHBondContact O-N 2.9Å; C377-A379 PolarHBondContact O-N 2.91Å; A379-C381 PolarHBondContact O-N 3.07Å; A379-A382 PolarHBondContact O-N 3.13Å; A379-M383 WeakPolarHBondContact O-CB 3.48Å; A379-M383 PolarHBondContact O-N 3.41Å; A379-M383 VanDerWaalsContact O-N 3.11Å
380	S	94.9	Very high	93.8	Very high	14 Å²	14	40.5 Å²	40.5	10%	0.098	22%	0.221	C	C	.	.	H	α-helix	trans	-61.7	-43.8	177.4	-170.1	0	0	0	0	112	L376 C377 T384 I741 G744	L376-S380 WeakPolarHBondContact O-CB 3.45Å; L376-S380 PolarHBondContact O-N 3.11Å; L376-S380 VanDerWaalsContact O-N 3.12Å; C377-S380 PolarHBondContact O-N 3.49Å; S380-T384 PolarHBondContact O-N 3.2Å; S380-T384 VanDerWaalsContact O-N 3.15Å; S380-T384 PolarHBondContact O-OG1 2.99Å; S380-I741 PolarHBondContact OG-O 3.21Å; S380-I741 VanDerWaalsContact OG-O 3.06Å; S380-G744 VanDerWaalsContact OG-CA 3.31Å; S380-G744 WeakPolarHBondContact OG-CA 3.4Å
381	C	95.1	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.7	-42.8	179.4	-65.9	0	0	0	0	112.2	C377 L378 A379 M383 T384 M385 S406 F410	C377-C381 WeakPolarHBondContact O-CB 3.41Å; C377-C381 PolarHBondContact O-N 2.96Å; C377-C381 PolarHBondContact O-SG 2.6Å; L378-C381 PolarHBondContact O-N 3Å; A379-C381 PolarHBondContact O-N 3.07Å; C381-M383 VanDerWaalsContact C-N 3.33Å; C381-M383 PolarHBondContact O-N 2.75Å; C381-T384 WeakPolarHBondContact O-CA 3.27Å; C381-T384 VanDerWaalsContact O-CB 3.29Å; C381-T384 WeakPolarHBondContact O-CB 3.43Å; C381-T384 PolarHBondContact O-N 3.15Å; C381-T384 VanDerWaalsContact O-N 3.08Å; C381-M385 WeakPolarHBondContact O-CG 3.31Å; C381-M385 PolarHBondContact O-N 2.85Å; C381-S406 WeakPolarHBondContact CB-O 3.11Å; C381-F410 HydrophobicContact CB-CB 3.9Å; C381-F410 HydrophobicContact CB-CD2 4.49Å
382	A	94.3	Very high	92.8	Very high	25 Å²	25	42.8 Å²	42.8	21%	0.207	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-45.7	177.1	0	0	0	0	0	111.3	L378 A379 T384 M385 I386 F410	L378-A382 VanDerWaalsContact O-CB 3.22Å; L378-A382 WeakPolarHBondContact O-CB 3.34Å; L378-A382 PolarHBondContact O-N 3.27Å; A379-A382 PolarHBondContact O-N 3.13Å; A382-T384 VanDerWaalsContact C-N 3.29Å; A382-T384 PolarHBondContact O-N 3.04Å; A382-M385 PolarHBondContact O-N 3.45Å; A382-I386 VanDerWaalsContact O-CG1 3.28Å; A382-I386 WeakPolarHBondContact O-CG1 3.47Å; A382-I386 PolarHBondContact O-N 2.91Å; A382-F410 HydrophobicContact CB-CD2 4.11Å; A382-F410 HydrophobicContact CB-CE2 3.93Å
383	M	90.5	Very high	92	Very high	26 Å²	26	45 Å²	45	13%	0.128	25%	0.246	C	C	.	.	H	α-helix	trans	-62.3	-37.1	175.8	-178.1	-173.1	57.5	0	0	112.4	A379 C381 T387 W748 W757	A379-M383 WeakPolarHBondContact O-CB 3.48Å; A379-M383 PolarHBondContact O-N 3.41Å; A379-M383 VanDerWaalsContact O-N 3.11Å; C381-M383 VanDerWaalsContact C-N 3.33Å; C381-M383 PolarHBondContact O-N 2.75Å; M383-T387 WeakPolarHBondContact O-CB 3.42Å; M383-T387 PolarHBondContact O-N 2.95Å; M383-T387 PolarHBondContact O-OG1 3.42Å; M383-W748 HydrophobicContact CE-CB 3.78Å; M383-W748 HydrophobicContact CE-CD2 3.6Å; M383-W748 HydrophobicContact CE-CE3 3.25Å; M383-W748 HydrophobicContact CE-CG 3.9Å; M383-W748 HydrophobicContact CE-CZ3 3.85Å; M383-W748 HydrophobicContact SD-CB 4.38Å; M383-W748 HydrophobicContact SD-CD2 3.28Å; M383-W748 HydrophobicContact SD-CE3 3.22Å; M383-W748 HydrophobicContact SD-CG 3.87Å; M383-W748 HydrophobicContact SD-CH2 3.69Å; M383-W748 HydrophobicContact SD-CZ2 3.81Å; M383-W748 HydrophobicContact SD-CZ3 3.4Å; M383-W748 WeakPolarHBondContact SD-CZ3 3.32Å; M383-W757 HydrophobicContact CG-CH2 4.27Å; M383-W757 HydrophobicContact CG-CZ2 3.65Å
384	T	91.3	Very high	91.2	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-63.8	-45.8	174.6	-56	0	0	0	0	111.6	S380 C381 A382 T387 F388 I403 G744 V747	S380-T384 PolarHBondContact O-N 3.2Å; S380-T384 VanDerWaalsContact O-N 3.15Å; S380-T384 PolarHBondContact O-OG1 2.99Å; C381-T384 WeakPolarHBondContact O-CA 3.27Å; C381-T384 VanDerWaalsContact O-CB 3.29Å; C381-T384 WeakPolarHBondContact O-CB 3.43Å; C381-T384 PolarHBondContact O-N 3.15Å; C381-T384 VanDerWaalsContact O-N 3.08Å; A382-T384 VanDerWaalsContact C-N 3.29Å; A382-T384 PolarHBondContact O-N 3.04Å; T384-T387 WeakPolarHBondContact O-CB 3.4Å; T384-T387 PolarHBondContact O-N 3.41Å; T384-F388 PolarHBondContact O-N 3.32Å; T384-I403 HydrophobicContact CG2-CD1 3.77Å; T384-G744 WeakPolarHBondContact OG1-CA 3.3Å; T384-V747 HydrophobicContact CG2-CB 4.29Å; T384-V747 HydrophobicContact CG2-CG2 3.8Å
385	M	91.7	Very high	90.5	Very high	30 Å²	30	45.5 Å²	45.5	15%	0.148	25%	0.248	C	C	.	.	H	α-helix	trans	-61.2	-47.8	176.7	-69.8	175.8	62.3	0	0	110.9	C381 A382 T387 F388 I389 V407 F410	C381-M385 WeakPolarHBondContact O-CG 3.31Å; C381-M385 PolarHBondContact O-N 2.85Å; A382-M385 PolarHBondContact O-N 3.45Å; M385-T387 VanDerWaalsContact C-N 3.28Å; M385-T387 PolarHBondContact O-N 2.96Å; M385-F388 WeakPolarHBondContact O-CB 3.47Å; M385-F388 PolarHBondContact O-N 2.95Å; M385-F388 VanDerWaalsContact O-N 3.11Å; M385-I389 VanDerWaalsContact O-CG1 3.24Å; M385-I389 WeakPolarHBondContact O-CG1 3.02Å; M385-I389 PolarHBondContact O-N 3.1Å; M385-V407 HydrophobicContact CE-CG2 4.17Å; M385-V407 HydrophobicContact CG-CG2 4.02Å; M385-V407 HydrophobicContact SD-CG2 4.07Å; M385-F410 HydrophobicContact SD-CB 3.8Å; M385-F410 HydrophobicContact SD-CD1 4.26Å; M385-F410 HydrophobicContact SD-CD2 4.07Å; M385-F410 HydrophobicContact SD-CG 3.78Å
386	I	90.1	Very high	89.8	Confident	76 Å²	76	43.2 Å²	43.2	39%	0.39	24%	0.243	S	C	.	.	H	α-helix	trans	-57.5	-43.1	175.4	-66.7	161.1	0	0	0	110.6	A382 F388 I389 L390 W757	A382-I386 VanDerWaalsContact O-CG1 3.28Å; A382-I386 WeakPolarHBondContact O-CG1 3.47Å; A382-I386 PolarHBondContact O-N 2.91Å; I386-F388 VanDerWaalsContact C-N 3.33Å; I386-F388 PolarHBondContact O-N 2.98Å; I386-I389 PolarHBondContact O-N 3.11Å; I386-L390 HydrophobicContact CG2-CD1 3.8Å; I386-L390 HydrophobicContact CG2-CG 4.19Å; I386-L390 WeakPolarHBondContact O-CB 3.42Å; I386-L390 VanDerWaalsContact O-CG 3.27Å; I386-L390 WeakPolarHBondContact O-CG 3.39Å; I386-L390 PolarHBondContact O-N 3.37Å; I386-W757 HydrophobicContact CB-CH2 4.11Å; I386-W757 HydrophobicContact CB-CZ2 4.08Å; I386-W757 HydrophobicContact CD1-CH2 4.4Å; I386-W757 HydrophobicContact CG2-CH2 3.52Å; I386-W757 HydrophobicContact CG2-CZ2 3.71Å
387	T	88.4	Confident	89.4	Confident	2 Å²	2	39.3 Å²	39.3	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-41	177.3	-55.1	0	0	0	0	112.1	M383 T384 M385 S391 F395 V747 W757	M383-T387 WeakPolarHBondContact O-CB 3.42Å; M383-T387 PolarHBondContact O-N 2.95Å; M383-T387 PolarHBondContact O-OG1 3.42Å; T384-T387 WeakPolarHBondContact O-CB 3.4Å; T384-T387 PolarHBondContact O-N 3.41Å; M385-T387 VanDerWaalsContact C-N 3.28Å; M385-T387 PolarHBondContact O-N 2.96Å; T387-S391 PolarHBondContact O-N 3.44Å; T387-S391 PolarHBondContact O-OG 3.02Å; T387-F395 HydrophobicContact CG2-CE2 4.15Å; T387-F395 HydrophobicContact CG2-CZ 4.02Å; T387-V747 HydrophobicContact CG2-CG1 3.77Å; T387-W757 PolarHBondContact OG1-NE1 3.13Å
388	F	89.5	Confident	88.9	Confident	20 Å²	20	39.8 Å²	39.8	9%	0.088	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-41.4	175.2	174.2	-105.3	0	0	0	112.1	T384 M385 I386 S391 R392 F395 I403	T384-F388 PolarHBondContact O-N 3.32Å; M385-F388 WeakPolarHBondContact O-CB 3.47Å; M385-F388 PolarHBondContact O-N 2.95Å; M385-F388 VanDerWaalsContact O-N 3.11Å; I386-F388 VanDerWaalsContact C-N 3.33Å; I386-F388 PolarHBondContact O-N 2.98Å; F388-S391 CarbonylContact O-C 3.53Å; F388-S391 VanDerWaalsContact O-C 3.31Å; F388-S391 PolarHBondContact O-N 2.97Å; F388-R392 HydrophobicContact CE2-CG 3.95Å; F388-R392 HydrophobicContact CZ-CG 3.87Å; F388-R392 VanDerWaalsContact O-CA 3.26Å; F388-R392 WeakPolarHBondContact O-CA 3.41Å; F388-R392 PolarHBondContact O-N 2.95Å; F388-F395 HydrophobicContact CB-CD2 4.36Å; F388-F395 HydrophobicContact CB-CE2 4.41Å; F388-F395 HydrophobicContact CD2-CB 3.99Å; F388-F395 AromaticContact CD2-CD2 3.75Å; F388-F395 HydrophobicContact CD2-CD2 3.75Å; F388-F395 HydrophobicContact CD2-CG 4.14Å; F388-F395 HydrophobicContact CE2-CB 4.21Å; F388-I403 HydrophobicContact CB-CD1 4.32Å; F388-I403 HydrophobicContact CB-CG1 4.49Å; F388-I403 HydrophobicContact CB-CG2 3.86Å; F388-I403 HydrophobicContact CD1-CG2 3.99Å; F388-I403 HydrophobicContact CD2-CB 4.43Å; F388-I403 HydrophobicContact CD2-CG1 3.96Å; F388-I403 HydrophobicContact CD2-CG2 3.93Å; F388-I403 HydrophobicContact CE2-CG2 4.47Å; F388-I403 HydrophobicContact CG-CG1 4.4Å; F388-I403 HydrophobicContact CG-CG2 3.65Å
389	I	89.7	Confident	88.5	Confident	86 Å²	86	39 Å²	39	44%	0.441	22%	0.221	S	C	.	.	H	α-helix	trans	-64.4	-44.6	177.9	-64.1	170.1	0	0	0	110.7	M385 I386 S391 F892	M385-I389 VanDerWaalsContact O-CG1 3.24Å; M385-I389 WeakPolarHBondContact O-CG1 3.02Å; M385-I389 PolarHBondContact O-N 3.1Å; I386-I389 PolarHBondContact O-N 3.11Å; I389-S391 VanDerWaalsContact C-N 3.28Å; I389-S391 PolarHBondContact O-N 2.8Å; I389-F892 HydrophobicContact CD1-CE1 3.5Å; I389-F892 HydrophobicContact CD1-CZ 3.67Å; I389-F892 HydrophobicContact CG1-CE1 3.6Å; I389-F892 HydrophobicContact CG1-CZ 4.26Å
390	L	87.4	Confident	88.3	Confident	88 Å²	88	38.5 Å²	38.5	46%	0.461	21%	0.207	S	C	.	.	H	α-helix	trans	-68.5	-25.7	178.1	-67.8	175	0	0	0	113.1	I386	I386-L390 HydrophobicContact CG2-CD1 3.8Å; I386-L390 HydrophobicContact CG2-CG 4.19Å; I386-L390 WeakPolarHBondContact O-CB 3.42Å; I386-L390 VanDerWaalsContact O-CG 3.27Å; I386-L390 WeakPolarHBondContact O-CG 3.39Å; I386-L390 PolarHBondContact O-N 3.37Å
391	S	83.3	Confident	88.2	Confident	19 Å²	19	37.8 Å²	37.8	13%	0.133	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-147	61.8	-173.3	60.5	0	0	0	0	113.5	T387 F388 I389 S393 R394 F395	T387-S391 PolarHBondContact O-N 3.44Å; T387-S391 PolarHBondContact O-OG 3.02Å; F388-S391 CarbonylContact O-C 3.53Å; F388-S391 VanDerWaalsContact O-C 3.31Å; F388-S391 PolarHBondContact O-N 2.97Å; I389-S391 VanDerWaalsContact C-N 3.28Å; I389-S391 PolarHBondContact O-N 2.8Å; S391-S393 PolarHBondContact O-N 3.1Å; S391-R394 VanDerWaalsContact O-CB 3.3Å; S391-R394 WeakPolarHBondContact O-CB 3Å; S391-R394 PolarHBondContact O-N 3.33Å; S391-F395 WeakPolarHBondContact O-CD2 3.35Å
392	R	85.2	Confident	88	Confident	102 Å²	102	38.2 Å²	38.2	39%	0.385	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-59.6	-42.2	-176.4	-177.9	176	-72	-175.7	-4.8	113.6	F388 R394 F395 F892	F388-R392 HydrophobicContact CE2-CG 3.95Å; F388-R392 HydrophobicContact CZ-CG 3.87Å; F388-R392 VanDerWaalsContact O-CA 3.26Å; F388-R392 WeakPolarHBondContact O-CA 3.41Å; F388-R392 PolarHBondContact O-N 2.95Å; R392-R394 PolarHBondContact O-N 2.98Å; R392-R394 VanDerWaalsContact O-N 3.07Å; R392-F395 PolarHBondContact O-N 3.45Å; R392-F395 VanDerWaalsContact O-N 3.14Å; R392-F892 VanDerWaalsContact CZ-O 3.3Å; R392-F892 PolarHBondContact NH1-O 3.47Å; R392-F892 PolarHBondContact NH2-O 3.35Å
393	S	81.3	Confident	88	Confident	121 Å²	121	37.1 Å²	37.1	85%	0.846	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-62.6	-16.7	-178.1	58.8	0	0	0	0	113.9	S391	S391-S393 PolarHBondContact O-N 3.1Å
394	R	80.2	Confident	88.2	Confident	55 Å²	55	37.4 Å²	37.4	21%	0.208	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-72.9	-32.8	177.9	-175.7	172.8	174.7	-170	-11.2	112.6	S391 R392 A396 N750 K752 S753	S391-R394 VanDerWaalsContact O-CB 3.3Å; S391-R394 WeakPolarHBondContact O-CB 3Å; S391-R394 PolarHBondContact O-N 3.33Å; R392-R394 PolarHBondContact O-N 2.98Å; R392-R394 VanDerWaalsContact O-N 3.07Å; R394-A396 PolarHBondContact O-N 3.02Å; R394-N750 PolarHBondContact NH2-ND2 3.36Å; R394-N750 PolarHBondContact NH2-OD1 2Å; R394-K752 VanDerWaalsContact NH1-C 3.31Å; R394-S753 VanDerWaalsContact CZ-OG 3.23Å; R394-S753 VanDerWaalsContact NH1-CA 3.25Å; R394-S753 PolarHBondContact NH1-OG 3.11Å; R394-S753 PolarHBondContact NH2-OG 3.45Å
395	F	83	Confident	88.3	Confident	13 Å²	13	37.5 Å²	37.5	6%	0.057	20%	0.195	C	C	.	.			trans	-100.7	69.5	-170.5	-60.1	-79.2	0	0	0	112.1	T387 F388 S391 R392 E399 R400 I403 V747	T387-F395 HydrophobicContact CG2-CE2 4.15Å; T387-F395 HydrophobicContact CG2-CZ 4.02Å; F388-F395 HydrophobicContact CB-CD2 4.36Å; F388-F395 HydrophobicContact CB-CE2 4.41Å; F388-F395 HydrophobicContact CD2-CB 3.99Å; F388-F395 AromaticContact CD2-CD2 3.75Å; F388-F395 HydrophobicContact CD2-CD2 3.75Å; F388-F395 HydrophobicContact CD2-CG 4.14Å; F388-F395 HydrophobicContact CE2-CB 4.21Å; S391-F395 WeakPolarHBondContact O-CD2 3.35Å; R392-F395 PolarHBondContact O-N 3.45Å; R392-F395 VanDerWaalsContact O-N 3.14Å; F395-E399 VanDerWaalsContact CA-OE1 3.31Å; F395-E399 WeakPolarHBondContact CA-OE1 2.94Å; F395-E399 WeakPolarHBondContact CD1-OE1 3.02Å; F395-R400 WeakPolarHBondContact O-CG 3.37Å; F395-I403 HydrophobicContact CB-CG1 4.23Å; F395-I403 HydrophobicContact CD1-CD1 3.86Å; F395-I403 HydrophobicContact CD1-CG1 4.16Å; F395-I403 HydrophobicContact CD2-CD1 4.5Å; F395-I403 HydrophobicContact CE1-CD1 3.95Å; F395-I403 HydrophobicContact CG-CD1 4.13Å; F395-I403 HydrophobicContact CG-CG1 4.13Å; F395-I403 HydrophobicContact CZ-CD1 4.3Å; F395-V747 HydrophobicContact CE1-CG1 4.17Å; F395-V747 HydrophobicContact CE1-CG2 4.15Å; F395-V747 HydrophobicContact CZ-CG1 3.77Å
396	A	84.5	Confident	88.5	Confident	43 Å²	43	36 Å²	36	36%	0.355	19%	0.188	S	C	.	.			trans	-80.1	165.8	176	0	0	0	0	0	112	R394 E399 R400	R394-A396 PolarHBondContact O-N 3.02Å; A396-E399 WeakPolarHBondContact O-CG 3.3Å; A396-E399 PolarHBondContact O-N 3.45Å; A396-R400 PolarHBondContact O-N 3.45Å; A396-R400 VanDerWaalsContact O-N 3.13Å
397	Y	88	Confident	88.8	Confident	3 Å²	3	33 Å²	33	1%	0.012	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	144.8	166.2	-75.7	-82.2	0	0	0	110.4	R400 P401 C512 I515 E516 L522	Y397-R400 HydrophobicContact CD1-CB 4.27Å; Y397-R400 HydrophobicContact CD2-CB 4.45Å; Y397-R400 HydrophobicContact CE1-CB 4.28Å; Y397-R400 HydrophobicContact CE2-CB 4.46Å; Y397-R400 HydrophobicContact CG-CB 4.36Å; Y397-P401 HydrophobicContact CD1-CG 4.22Å; Y397-P401 HydrophobicContact CE1-CG 3.95Å; Y397-C512 PolarHBondContact O-SG 3.38Å; Y397-I515 HydrophobicContact CD1-CB 4.49Å; Y397-I515 HydrophobicContact CD1-CG2 3.44Å; Y397-I515 VanDerWaalsContact CD1-CG2 3.44Å; Y397-I515 HydrophobicContact CD2-CG2 4.26Å; Y397-I515 HydrophobicContact CE1-CG2 4.08Å; Y397-I515 HydrophobicContact CG-CB 4.16Å; Y397-I515 HydrophobicContact CG-CG2 3.56Å; Y397-E516 HydrophobicContact CD2-CB 4.38Å; Y397-E516 WeakPolarHBondContact CD2-OE2 3.38Å; Y397-E516 WeakPolarHBondContact CE2-OE2 3.29Å; Y397-L522 HydrophobicContact CE1-CD1 4.28Å
398	P	87.2	Confident	89.2	Confident	10 Å²	10	33 Å²	33	7%	0.065	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	cis	-90.5	7.5	7.2	35.6	-36.2	0	0	0	115.3	P401 L498 I515 M659 I662	P398-P401 WeakPolarHBondContact O-CD 3.5Å; P398-L498 WeakPolarHBondContact O-CD1 3.12Å; P398-I515 HydrophobicContact CB-CD1 4.33Å; P398-M659 HydrophobicContact CG-SD 3.88Å; P398-I662 HydrophobicContact CG-CD1 4.17Å
399	E	87.5	Confident	89.6	Confident	28 Å²	28	32.4 Å²	32.4	13%	0.131	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-21.3	-178.1	59.7	173.4	-141.7	0	0	114.4	F395 A396 P401 I402 I662	F395-E399 VanDerWaalsContact CA-OE1 3.31Å; F395-E399 WeakPolarHBondContact CA-OE1 2.94Å; F395-E399 WeakPolarHBondContact CD1-OE1 3.02Å; A396-E399 WeakPolarHBondContact O-CG 3.3Å; A396-E399 PolarHBondContact O-N 3.45Å; E399-P401 VanDerWaalsContact C-N 3.35Å; E399-I402 VanDerWaalsContact O-CB 3.31Å; E399-I402 WeakPolarHBondContact O-CB 3.39Å; E399-I402 WeakPolarHBondContact O-CG1 3.4Å; E399-I402 PolarHBondContact O-N 3.39Å; E399-I662 HydrophobicContact CB-CD1 4Å
400	R	90.7	Very high	89.9	Confident	46 Å²	46	30.7 Å²	30.7	17%	0.174	16%	0.159	C	C	.	.	H	α-helix	trans	-50.3	-39.3	-178.9	-160.5	173.5	179.5	176.9	-0.8	115.3	F395 A396 Y397 I402 I403 Y404 E516	F395-R400 WeakPolarHBondContact O-CG 3.37Å; A396-R400 PolarHBondContact O-N 3.45Å; A396-R400 VanDerWaalsContact O-N 3.13Å; Y397-R400 HydrophobicContact CD1-CB 4.27Å; Y397-R400 HydrophobicContact CD2-CB 4.45Å; Y397-R400 HydrophobicContact CE1-CB 4.28Å; Y397-R400 HydrophobicContact CE2-CB 4.46Å; Y397-R400 HydrophobicContact CG-CB 4.36Å; R400-I402 PolarHBondContact O-N 3.21Å; R400-I402 VanDerWaalsContact O-N 3.13Å; R400-I403 WeakPolarHBondContact O-CB 3.19Å; R400-I403 PolarHBondContact O-N 3.48Å; R400-Y404 HydrophobicContact CG-CE2 3.88Å; R400-Y404 PolarHBondContact NE-OH 3.24Å; R400-E516 IonicContact CZ-OE1 3.59Å; R400-E516 VanDerWaalsContact NH1-CD 3.29Å; R400-E516 IonicContact NH1-OE1 3.18Å; R400-E516 PolarHBondContact NH1-OE1 3.3Å; R400-E516 IonicContact NH1-OE2 3.93Å; R400-E516 PolarHBondContact NH1-OE2 3.41Å
401	P	93.3	Very high	90.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-53.6	-29.4	173.8	-29.2	38	0	0	0	115.2	Y397 P398 E399 I403 Y404 I405 W494 L498	Y397-P401 HydrophobicContact CD1-CG 4.22Å; Y397-P401 HydrophobicContact CE1-CG 3.95Å; P398-P401 WeakPolarHBondContact O-CD 3.5Å; E399-P401 VanDerWaalsContact C-N 3.35Å; P401-I403 PolarHBondContact O-N 3.26Å; P401-Y404 PolarHBondContact O-N 3.03Å; P401-Y404 VanDerWaalsContact O-N 3.16Å; P401-I405 WeakPolarHBondContact O-CG1 3.21Å; P401-I405 PolarHBondContact O-N 3.19Å; P401-W494 HydrophobicContact CB-CE3 4.19Å; P401-L498 HydrophobicContact CB-CB 3.9Å; P401-L498 HydrophobicContact CB-CD1 4.18Å; P401-L498 HydrophobicContact CG-CD1 4.48Å
402	I	91.4	Very high	91.1	Very high	9 Å²	9	29.5 Å²	29.5	5%	0.046	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-34.7	177.3	-60.7	172.9	0	0	0	111	E399 R400 I405 S406 L498	E399-I402 VanDerWaalsContact O-CB 3.31Å; E399-I402 WeakPolarHBondContact O-CB 3.39Å; E399-I402 WeakPolarHBondContact O-CG1 3.4Å; E399-I402 PolarHBondContact O-N 3.39Å; R400-I402 PolarHBondContact O-N 3.21Å; R400-I402 VanDerWaalsContact O-N 3.13Å; I402-I405 WeakPolarHBondContact O-CB 3.36Å; I402-I405 PolarHBondContact O-N 2.96Å; I402-S406 PolarHBondContact O-N 3.12Å; I402-S406 VanDerWaalsContact O-N 3.07Å; I402-S406 PolarHBondContact O-OG 2.02Å; I402-L498 HydrophobicContact CD1-CD1 4.47Å; I402-L498 HydrophobicContact CG1-CD1 4.01Å; I402-L498 HydrophobicContact CG1-CD2 3.99Å
403	I	92.9	Very high	91.7	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-67.7	-42.7	177	-56.2	-56.3	0	0	0	110.6	T384 F388 F395 R400 P401 I405 S406 V407 V747	T384-I403 HydrophobicContact CG2-CD1 3.77Å; F388-I403 HydrophobicContact CB-CD1 4.32Å; F388-I403 HydrophobicContact CB-CG1 4.49Å; F388-I403 HydrophobicContact CB-CG2 3.86Å; F388-I403 HydrophobicContact CD1-CG2 3.99Å; F388-I403 HydrophobicContact CD2-CB 4.43Å; F388-I403 HydrophobicContact CD2-CG1 3.96Å; F388-I403 HydrophobicContact CD2-CG2 3.93Å; F388-I403 HydrophobicContact CE2-CG2 4.47Å; F388-I403 HydrophobicContact CG-CG1 4.4Å; F388-I403 HydrophobicContact CG-CG2 3.65Å; F395-I403 HydrophobicContact CB-CG1 4.23Å; F395-I403 HydrophobicContact CD1-CD1 3.86Å; F395-I403 HydrophobicContact CD1-CG1 4.16Å; F395-I403 HydrophobicContact CD2-CD1 4.5Å; F395-I403 HydrophobicContact CE1-CD1 3.95Å; F395-I403 HydrophobicContact CG-CD1 4.13Å; F395-I403 HydrophobicContact CG-CG1 4.13Å; F395-I403 HydrophobicContact CZ-CD1 4.3Å; R400-I403 WeakPolarHBondContact O-CB 3.19Å; R400-I403 PolarHBondContact O-N 3.48Å; P401-I403 PolarHBondContact O-N 3.26Å; I403-I405 VanDerWaalsContact C-N 3.31Å; I403-I405 PolarHBondContact O-N 3.39Å; I403-S406 WeakPolarHBondContact O-CB 3.5Å; I403-S406 PolarHBondContact O-N 3.4Å; I403-S406 VanDerWaalsContact O-N 3.11Å; I403-V407 WeakPolarHBondContact O-CG2 3.33Å; I403-V407 PolarHBondContact O-N 3.37Å; I403-V747 HydrophobicContact CD1-CG2 4.41Å
404	Y	95.1	Very high	92.5	Very high	32 Å²	32	21 Å²	21	13%	0.125	10%	0.102	C	C	.	.	H	α-helix	trans	-66.9	-32.8	177.1	-60	-57.2	0	0	0	112.4	R400 P401 V407 C408 W494 H523	R400-Y404 HydrophobicContact CG-CE2 3.88Å; R400-Y404 PolarHBondContact NE-OH 3.24Å; P401-Y404 PolarHBondContact O-N 3.03Å; P401-Y404 VanDerWaalsContact O-N 3.16Å; Y404-V407 PolarHBondContact O-N 2.99Å; Y404-C408 PolarHBondContact O-N 2.9Å; Y404-C408 PolarHBondContact O-SG 2.92Å; Y404-W494 VanDerWaalsContact CB-CD2 3.47Å; Y404-W494 HydrophobicContact CD1-CZ2 4.44Å; Y404-W494 HydrophobicContact CD2-CD2 4.31Å; Y404-W494 AromaticContact CD2-CE3 3.86Å; Y404-W494 HydrophobicContact CD2-CE3 3.86Å; Y404-W494 AromaticContact CD2-CH2 3.47Å; Y404-W494 HydrophobicContact CD2-CH2 3.47Å; Y404-W494 VanDerWaalsContact CD2-CH2 3.47Å; Y404-W494 AromaticContact CD2-CZ2 3.93Å; Y404-W494 HydrophobicContact CD2-CZ2 3.93Å; Y404-W494 AromaticContact CD2-CZ3 3.42Å; Y404-W494 HydrophobicContact CD2-CZ3 3.42Å; Y404-W494 VanDerWaalsContact CD2-CZ3 3.42Å; Y404-W494 AromaticContact CE2-CH2 3.98Å; Y404-W494 HydrophobicContact CE2-CH2 3.98Å; Y404-W494 HydrophobicContact CE2-CZ3 4.14Å; Y404-W494 HydrophobicContact CG-CD2 4.18Å; Y404-W494 AromaticContact CG-CE2 3.99Å; Y404-W494 HydrophobicContact CG-CE3 4.19Å; Y404-W494 AromaticContact CG-CH2 3.9Å; Y404-W494 HydrophobicContact CG-CH2 3.9Å; Y404-W494 AromaticContact CG-CZ2 3.86Å; Y404-W494 HydrophobicContact CG-CZ2 3.86Å; Y404-W494 HydrophobicContact CG-CZ3 4.07Å; Y404-H523 AromaticContact CE1-CE1 3.67Å; Y404-H523 AromaticContact CE2-CE1 3.39Å; Y404-H523 WeakPolarHBondContact CE2-CE1 3.31Å; Y404-H523 AromaticContact CE2-NE2 3.4Å; Y404-H523 WeakPolarHBondContact CE2-NE2 3.29Å; Y404-H523 AromaticContact CZ-CE1 3.21Å; Y404-H523 AromaticContact CZ-NE2 3.5Å; Y404-H523 PolarHBondContact OH-CE1 2.96Å; Y404-H523 PolarHBondContact OH-NE2 3.43Å
405	I	94.7	Very high	93.3	Very high	2 Å²	2	18.3 Å²	18.3	1%	0.01	9%	0.092	C	C	.	.	H	α-helix	trans	-59.1	-47.8	168.2	-66.8	172.4	0	0	0	110.2	P401 I402 I403 V407 C408 Y409 W494 W495 L498 Y669 V739	P401-I405 WeakPolarHBondContact O-CG1 3.21Å; P401-I405 PolarHBondContact O-N 3.19Å; I402-I405 WeakPolarHBondContact O-CB 3.36Å; I402-I405 PolarHBondContact O-N 2.96Å; I403-I405 VanDerWaalsContact C-N 3.31Å; I403-I405 PolarHBondContact O-N 3.39Å; I405-V407 VanDerWaalsContact C-N 3.32Å; I405-V407 PolarHBondContact O-N 2.84Å; I405-C408 WeakPolarHBondContact O-CB 3.44Å; I405-C408 PolarHBondContact O-N 2.93Å; I405-C408 VanDerWaalsContact O-N 3.17Å; I405-Y409 HydrophobicContact CG2-CD2 3.62Å; I405-Y409 HydrophobicContact CG2-CE2 3.63Å; I405-Y409 VanDerWaalsContact O-CD2 3.26Å; I405-Y409 WeakPolarHBondContact O-CD2 3.15Å; I405-Y409 PolarHBondContact O-N 3.23Å; I405-W494 HydrophobicContact CG1-CB 3.68Å; I405-W495 HydrophobicContact CD1-CB 4.16Å; I405-L498 HydrophobicContact CD1-CD2 4.32Å; I405-Y669 HydrophobicContact CD1-CE2 4.33Å; I405-V739 HydrophobicContact CG2-CG1 4.25Å
406	S	95	Very high	94	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-62.4	-35.9	176.1	-62.1	0	0	0	0	113.1	C381 I402 I403 Y409 F410 S743	C381-S406 WeakPolarHBondContact CB-O 3.11Å; I402-S406 PolarHBondContact O-N 3.12Å; I402-S406 VanDerWaalsContact O-N 3.07Å; I402-S406 PolarHBondContact O-OG 2.02Å; I403-S406 WeakPolarHBondContact O-CB 3.5Å; I403-S406 PolarHBondContact O-N 3.4Å; I403-S406 VanDerWaalsContact O-N 3.11Å; S406-Y409 PolarHBondContact O-N 2.95Å; S406-F410 WeakPolarHBondContact O-CB 3.32Å; S406-F410 PolarHBondContact O-N 3.24Å; S406-S743 WeakPolarHBondContact OG-CB 3.44Å; S406-S743 PolarHBondContact OG-OG 3.22Å
407	V	95.8	Very high	94.6	Very high	13 Å²	13	17.6 Å²	17.6	8%	0.079	8%	0.082	C	C	.	.	H	α-helix	trans	-63.2	-43.6	173.1	173.7	0	0	0	0	110.9	M385 I403 Y404 I405 Y409 F410 F411 M889	M385-V407 HydrophobicContact CE-CG2 4.17Å; M385-V407 HydrophobicContact CG-CG2 4.02Å; M385-V407 HydrophobicContact SD-CG2 4.07Å; I403-V407 WeakPolarHBondContact O-CG2 3.33Å; I403-V407 PolarHBondContact O-N 3.37Å; Y404-V407 PolarHBondContact O-N 2.99Å; I405-V407 VanDerWaalsContact C-N 3.32Å; I405-V407 PolarHBondContact O-N 2.84Å; V407-Y409 PolarHBondContact O-N 3.41Å; V407-F410 WeakPolarHBondContact O-CB 3.41Å; V407-F410 PolarHBondContact O-N 3.41Å; V407-F411 HydrophobicContact CG1-CD2 4.17Å; V407-F411 HydrophobicContact CG1-CE2 4.03Å; V407-F411 WeakPolarHBondContact O-CD2 3.32Å; V407-F411 PolarHBondContact O-N 3.02Å; V407-M889 HydrophobicContact CG1-CE 4.37Å
408	C	97.5	Very high	95	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-46.7	175.8	-63.4	0	0	0	0	111.1	Y404 I405 F410 F411 Y412 F487 W494	Y404-C408 PolarHBondContact O-N 2.9Å; Y404-C408 PolarHBondContact O-SG 2.92Å; I405-C408 WeakPolarHBondContact O-CB 3.44Å; I405-C408 PolarHBondContact O-N 2.93Å; I405-C408 VanDerWaalsContact O-N 3.17Å; C408-F410 VanDerWaalsContact C-N 3.34Å; C408-F410 PolarHBondContact O-N 3.24Å; C408-F411 PolarHBondContact O-N 3.19Å; C408-Y412 VanDerWaalsContact O-CB 3.28Å; C408-Y412 WeakPolarHBondContact O-CB 3.25Å; C408-Y412 PolarHBondContact O-N 3.37Å; C408-F487 WeakPolarHBondContact O-CB 3.46Å; C408-W494 VanDerWaalsContact SG-CD1 3.57Å
409	Y	97.2	Very high	95.4	Very high	9 Å²	9	19.5 Å²	19.5	4%	0.035	9%	0.091	C	C	.	.	H	α-helix	trans	-71.7	-25	-179.2	-79.3	-66.6	0	0	0	114.4	I405 S406 V407 Y412 S413 S736 V739	I405-Y409 HydrophobicContact CG2-CD2 3.62Å; I405-Y409 HydrophobicContact CG2-CE2 3.63Å; I405-Y409 VanDerWaalsContact O-CD2 3.26Å; I405-Y409 WeakPolarHBondContact O-CD2 3.15Å; I405-Y409 PolarHBondContact O-N 3.23Å; S406-Y409 PolarHBondContact O-N 2.95Å; V407-Y409 PolarHBondContact O-N 3.41Å; Y409-Y412 AromaticContact CD1-CD1 3.97Å; Y409-Y412 HydrophobicContact CD1-CD1 3.97Å; Y409-Y412 HydrophobicContact CE1-CD1 4.15Å; Y409-S413 WeakPolarHBondContact O-CB 3.42Å; Y409-S413 PolarHBondContact O-N 3.41Å; Y409-S736 WeakPolarHBondContact CE1-O 3.44Å; Y409-S736 PolarHBondContact OH-O 2.86Å; Y409-V739 HydrophobicContact CD2-CB 4.47Å; Y409-V739 HydrophobicContact CD2-CG1 4.29Å; Y409-V739 HydrophobicContact CE1-CB 4.44Å; Y409-V739 HydrophobicContact CE2-CB 3.65Å; Y409-V739 HydrophobicContact CE2-CG1 3.44Å; Y409-V739 VanDerWaalsContact CE2-CG1 3.44Å; Y409-V739 WeakPolarHBondContact OH-CB 3.3Å
410	F	97.4	Very high	95.7	Very high	49 Å²	49	20.5 Å²	20.5	22%	0.215	10%	0.104	C	C	.	.	H	α-helix	trans	-58.7	-56.6	169	177.6	-93.3	0	0	0	110.3	L378 C381 A382 M385 S406 V407 C408 S413 T414	L378-F410 HydrophobicContact CD1-CD2 4.47Å; L378-F410 HydrophobicContact CD1-CE2 4.25Å; L378-F410 HydrophobicContact CD2-CE2 4.4Å; L378-F410 HydrophobicContact CG-CD2 4.12Å; L378-F410 HydrophobicContact CG-CE2 4.01Å; C381-F410 HydrophobicContact CB-CB 3.9Å; C381-F410 HydrophobicContact CB-CD2 4.49Å; A382-F410 HydrophobicContact CB-CD2 4.11Å; A382-F410 HydrophobicContact CB-CE2 3.93Å; M385-F410 HydrophobicContact SD-CB 3.8Å; M385-F410 HydrophobicContact SD-CD1 4.26Å; M385-F410 HydrophobicContact SD-CD2 4.07Å; M385-F410 HydrophobicContact SD-CG 3.78Å; S406-F410 WeakPolarHBondContact O-CB 3.32Å; S406-F410 PolarHBondContact O-N 3.24Å; V407-F410 WeakPolarHBondContact O-CB 3.41Å; V407-F410 PolarHBondContact O-N 3.41Å; C408-F410 VanDerWaalsContact C-N 3.34Å; C408-F410 PolarHBondContact O-N 3.24Å; F410-S413 PolarHBondContact O-N 2.96Å; F410-T414 PolarHBondContact O-N 2.89Å; F410-T414 PolarHBondContact O-OG1 2.83Å
411	F	97.9	Very high	96	Very high	57 Å²	57	25.1 Å²	25.1	25%	0.25	13%	0.132	C	C	.	.	H	α-helix	trans	-70.4	-38.2	-179.4	-72.1	-72	0	0	0	113	V407 C408 S413 T414 G415 I483 F487	V407-F411 HydrophobicContact CG1-CD2 4.17Å; V407-F411 HydrophobicContact CG1-CE2 4.03Å; V407-F411 WeakPolarHBondContact O-CD2 3.32Å; V407-F411 PolarHBondContact O-N 3.02Å; C408-F411 PolarHBondContact O-N 3.19Å; F411-S413 PolarHBondContact O-N 2.81Å; F411-T414 WeakPolarHBondContact O-CB 3.42Å; F411-T414 PolarHBondContact O-N 3.18Å; F411-G415 PolarHBondContact O-N 3.21Å; F411-G415 VanDerWaalsContact O-N 3.08Å; F411-I483 WeakPolarHBondContact O-CG2 3.39Å; F411-F487 HydrophobicContact CB-CB 4.39Å; F411-F487 HydrophobicContact CB-CD1 3.83Å; F411-F487 HydrophobicContact CB-CD2 3.34Å; F411-F487 HydrophobicContact CB-CE1 3.85Å; F411-F487 HydrophobicContact CB-CE2 3.38Å; F411-F487 HydrophobicContact CB-CG 3.58Å; F411-F487 HydrophobicContact CB-CZ 3.63Å; F411-F487 HydrophobicContact CD1-CE2 4.23Å; F411-F487 HydrophobicContact CD1-CZ 4.17Å; F411-F487 HydrophobicContact CD2-CD1 4.17Å; F411-F487 AromaticContact CD2-CE1 3.56Å; F411-F487 HydrophobicContact CD2-CE1 3.56Å; F411-F487 HydrophobicContact CD2-CE2 4.28Å; F411-F487 AromaticContact CD2-CZ 3.63Å; F411-F487 HydrophobicContact CD2-CZ 3.63Å; F411-F487 HydrophobicContact CE2-CE1 4.35Å; F411-F487 HydrophobicContact CE2-CZ 4.31Å; F411-F487 HydrophobicContact CG-CD1 4.33Å; F411-F487 HydrophobicContact CG-CD2 4.2Å; F411-F487 AromaticContact CG-CE1 3.87Å; F411-F487 HydrophobicContact CG-CE1 3.87Å; F411-F487 AromaticContact CG-CE2 3.74Å; F411-F487 HydrophobicContact CG-CE2 3.74Å; F411-F487 HydrophobicContact CG-CG 4.49Å; F411-F487 AromaticContact CG-CZ 3.55Å; F411-F487 HydrophobicContact CG-CZ 3.55Å
412	Y	97.7	Very high	96	Very high	25 Å²	25	27 Å²	27	10%	0.098	14%	0.141	C	C	.	.	H	α-helix	trans	-55.2	-45.1	173.7	-174.7	-114.6	0	0	0	110.8	C408 Y409 G415 F416 L484 L737	C408-Y412 VanDerWaalsContact O-CB 3.28Å; C408-Y412 WeakPolarHBondContact O-CB 3.25Å; C408-Y412 PolarHBondContact O-N 3.37Å; Y409-Y412 AromaticContact CD1-CD1 3.97Å; Y409-Y412 HydrophobicContact CD1-CD1 3.97Å; Y409-Y412 HydrophobicContact CE1-CD1 4.15Å; Y412-G415 PolarHBondContact O-N 3.34Å; Y412-F416 AromaticContact CD1-CE2 3.89Å; Y412-F416 HydrophobicContact CD1-CE2 3.89Å; Y412-F416 HydrophobicContact CD2-CE2 4.5Å; Y412-F416 AromaticContact CE1-CE2 3.47Å; Y412-F416 HydrophobicContact CE1-CE2 3.47Å; Y412-F416 VanDerWaalsContact CE1-CE2 3.47Å; Y412-F416 HydrophobicContact CE1-CZ 4.05Å; Y412-F416 HydrophobicContact CE2-CE2 4.1Å; Y412-F416 HydrophobicContact CG-CE2 4.39Å; Y412-F416 AromaticContact CZ-CE2 3.58Å; Y412-F416 AromaticContact CZ-CZ 3.86Å; Y412-F416 WeakPolarHBondContact O-CD2 3.33Å; Y412-L484 HydrophobicContact CD2-CB 4.45Å; Y412-L484 HydrophobicContact CD2-CD2 3.95Å; Y412-L484 WeakPolarHBondContact CD2-O 3.38Å; Y412-L484 HydrophobicContact CE2-CB 4.17Å; Y412-L484 HydrophobicContact CE2-CD2 3.88Å; Y412-L484 VanDerWaalsContact CE2-O 3.26Å; Y412-L484 WeakPolarHBondContact CE2-O 3.32Å; Y412-L484 VanDerWaalsContact O-CD2 3.31Å; Y412-L484 WeakPolarHBondContact O-CD2 3.33Å; Y412-L737 HydrophobicContact CD1-CD2 3.97Å; Y412-L737 HydrophobicContact CE1-CD2 4.13Å
413	S	98	Very high	96.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.5	-34.5	176	-170.7	0	0	0	0	113.5	A374 Y409 F410 F411 G415 F416 I417	A374-S413 WeakPolarHBondContact CA-OG 3.46Å; A374-S413 WeakPolarHBondContact CB-OG 3.36Å; A374-S413 PolarHBondContact O-OG 3.45Å; Y409-S413 WeakPolarHBondContact O-CB 3.42Å; Y409-S413 PolarHBondContact O-N 3.41Å; F410-S413 PolarHBondContact O-N 2.96Å; F411-S413 PolarHBondContact O-N 2.81Å; S413-G415 PolarHBondContact O-N 3.28Å; S413-F416 PolarHBondContact O-N 3.46Å; S413-I417 PolarHBondContact O-N 3.2Å
414	T	96.9	Very high	96.1	Very high	44 Å²	44	29.7 Å²	29.7	27%	0.27	16%	0.159	S	C	.	.	H	α-helix	trans	-59.9	-34.2	172.7	-53.2	0	0	0	0	111.3	L378 F410 F411 F416 I417 L418	L378-T414 WeakPolarHBondContact CD1-OG1 3.49Å; F410-T414 PolarHBondContact O-N 2.89Å; F410-T414 PolarHBondContact O-OG1 2.83Å; F411-T414 WeakPolarHBondContact O-CB 3.42Å; F411-T414 PolarHBondContact O-N 3.18Å; T414-F416 PolarHBondContact O-N 2.94Å; T414-I417 PolarHBondContact O-N 3.39Å; T414-L418 WeakPolarHBondContact O-CB 3.41Å; T414-L418 PolarHBondContact O-N 3.5Å
415	G	96.8	Very high	96	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-43.9	176.2	0	0	0	0	0	113.5	F411 Y412 S413 L418 H419	F411-G415 PolarHBondContact O-N 3.21Å; F411-G415 VanDerWaalsContact O-N 3.08Å; Y412-G415 PolarHBondContact O-N 3.34Å; S413-G415 PolarHBondContact O-N 3.28Å; G415-L418 PolarHBondContact O-N 3.21Å; G415-H419 PolarHBondContact O-N 2.92Å
416	F	97.6	Very high	95.9	Very high	8 Å²	8	36 Å²	36	4%	0.035	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-41.9	175.9	-69	-85.5	0	0	0	112.3	M370 A374 Y412 S413 T414 H419 A420 L484 L551 I733 L737	M370-F416 HydrophobicContact CB-CD1 4.31Å; M370-F416 HydrophobicContact SD-CD1 4.23Å; M370-F416 HydrophobicContact SD-CE1 4.31Å; A374-F416 HydrophobicContact CB-CB 3.81Å; A374-F416 HydrophobicContact CB-CG 4.49Å; Y412-F416 AromaticContact CD1-CE2 3.89Å; Y412-F416 HydrophobicContact CD1-CE2 3.89Å; Y412-F416 HydrophobicContact CD2-CE2 4.5Å; Y412-F416 AromaticContact CE1-CE2 3.47Å; Y412-F416 HydrophobicContact CE1-CE2 3.47Å; Y412-F416 VanDerWaalsContact CE1-CE2 3.47Å; Y412-F416 HydrophobicContact CE1-CZ 4.05Å; Y412-F416 HydrophobicContact CE2-CE2 4.1Å; Y412-F416 HydrophobicContact CG-CE2 4.39Å; Y412-F416 AromaticContact CZ-CE2 3.58Å; Y412-F416 AromaticContact CZ-CZ 3.86Å; Y412-F416 WeakPolarHBondContact O-CD2 3.33Å; S413-F416 PolarHBondContact O-N 3.46Å; T414-F416 PolarHBondContact O-N 2.94Å; F416-H419 PolarHBondContact O-N 2.9Å; F416-A420 PolarHBondContact O-N 3.49Å; F416-L484 HydrophobicContact CD2-CD2 3.68Å; F416-L484 HydrophobicContact CE2-CD2 3.51Å; F416-L484 HydrophobicContact CG-CD2 4.29Å; F416-L484 HydrophobicContact CZ-CD2 4.02Å; F416-L551 HydrophobicContact CD1-CD1 3.7Å; F416-L551 HydrophobicContact CE1-CD1 3.43Å; F416-L551 VanDerWaalsContact CE1-CD1 3.43Å; F416-L551 HydrophobicContact CZ-CD1 4.46Å; F416-I733 HydrophobicContact CE1-CG2 4.12Å; F416-I733 HydrophobicContact CZ-CG2 4.31Å; F416-L737 HydrophobicContact CD2-CD2 4.36Å; F416-L737 HydrophobicContact CE2-CD2 4.25Å
417	I	97.3	Very high	95.8	Very high	33 Å²	33	36 Å²	36	17%	0.169	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-41.9	178.5	-67	163.5	0	0	0	110.1	L371 A374 I375 L378 S413 T414 H419 A420 L421	L371-I417 HydrophobicContact CD1-CG1 4.4Å; A374-I417 HydrophobicContact CB-CD1 4.39Å; A374-I417 HydrophobicContact CB-CG1 4.04Å; I375-I417 HydrophobicContact CG1-CD1 4.33Å; L378-I417 HydrophobicContact CB-CD1 4.24Å; L378-I417 HydrophobicContact CD1-CD1 3.82Å; L378-I417 HydrophobicContact CG-CD1 4.48Å; S413-I417 PolarHBondContact O-N 3.2Å; T414-I417 PolarHBondContact O-N 3.39Å; I417-H419 VanDerWaalsContact C-N 3.35Å; I417-H419 PolarHBondContact O-N 3.09Å; I417-A420 WeakPolarHBondContact O-CB 3.11Å; I417-A420 PolarHBondContact O-N 2.96Å; I417-A420 VanDerWaalsContact O-N 3.11Å; I417-L421 HydrophobicContact CG2-CD1 3.93Å; I417-L421 HydrophobicContact CG2-CG 4.2Å; I417-L421 VanDerWaalsContact O-CG 3.3Å; I417-L421 WeakPolarHBondContact O-CG 3.26Å; I417-L421 PolarHBondContact O-N 2.87Å
418	L	96.3	Very high	95.7	Very high	43 Å²	43	35.4 Å²	35.4	23%	0.225	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-46.3	177.1	-178.3	64.1	0	0	0	111	T414 G415 A420 L421 I422 I479 V480 I483	T414-L418 WeakPolarHBondContact O-CB 3.41Å; T414-L418 PolarHBondContact O-N 3.5Å; G415-L418 PolarHBondContact O-N 3.21Å; L418-A420 VanDerWaalsContact C-N 3.34Å; L418-A420 PolarHBondContact O-N 3.38Å; L418-L421 PolarHBondContact O-N 3.31Å; L418-I422 HydrophobicContact CD1-CD1 3.61Å; L418-I422 HydrophobicContact CD1-CG1 4.16Å; L418-I422 HydrophobicContact CD2-CD1 4.39Å; L418-I422 HydrophobicContact CG-CD1 3.63Å; L418-I422 HydrophobicContact CG-CG1 4.5Å; L418-I422 VanDerWaalsContact O-CG1 3.3Å; L418-I422 WeakPolarHBondContact O-CG1 3.37Å; L418-I422 PolarHBondContact O-N 3.22Å; L418-I479 HydrophobicContact CD2-CG2 3.96Å; L418-V480 HydrophobicContact CD2-CG2 4.5Å; L418-I483 HydrophobicContact CD2-CD1 3.65Å
419	H	95.8	Very high	95.5	Very high	9 Å²	9	36 Å²	36	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-45.3	172.7	165.6	-98.3	0	0	0	112	G415 F416 I417 L421 I422 G423 V480 T549 G550 L551	G415-H419 PolarHBondContact O-N 2.92Å; F416-H419 PolarHBondContact O-N 2.9Å; I417-H419 VanDerWaalsContact C-N 3.35Å; I417-H419 PolarHBondContact O-N 3.09Å; H419-L421 VanDerWaalsContact C-N 3.31Å; H419-L421 PolarHBondContact O-N 3.31Å; H419-I422 PolarHBondContact O-N 3.07Å; H419-G423 PolarHBondContact O-N 2.78Å; H419-V480 HydrophobicContact CB-CG1 4.46Å; H419-V480 HydrophobicContact CB-CG2 4.37Å; H419-T549 PolarHBondContact CE1-O 3.15Å; H419-T549 PolarHBondContact NE2-O 3.41Å; H419-G550 PolarHBondContact CD2-O 3.17Å; H419-G550 PolarHBondContact NE2-O 3Å; H419-L551 HydrophobicContact CB-CD2 3.54Å
420	A	95	Very high	95.3	Very high	49 Å²	49	41.9 Å²	41.9	41%	0.405	22%	0.223	S	C	.	.	H	α-helix	trans	-63.3	-34.6	178.7	0	0	0	0	0	113.1	L371 F416 I417 L418	L371-A420 HydrophobicContact CD1-CB 3.97Å; F416-A420 PolarHBondContact O-N 3.49Å; I417-A420 WeakPolarHBondContact O-CB 3.11Å; I417-A420 PolarHBondContact O-N 2.96Å; I417-A420 VanDerWaalsContact O-N 3.11Å; L418-A420 VanDerWaalsContact C-N 3.34Å; L418-A420 PolarHBondContact O-N 3.38Å
421	L	95.5	Very high	94.8	Very high	143 Å²	143	44 Å²	44	75%	0.749	24%	0.237	S	C	*	.	H	α-helix	trans	-75.1	-40.4	178.5	-70.1	174.1	0	0	0	112.9	I417 L418 H419	I417-L421 HydrophobicContact CG2-CD1 3.93Å; I417-L421 HydrophobicContact CG2-CG 4.2Å; I417-L421 VanDerWaalsContact O-CG 3.3Å; I417-L421 WeakPolarHBondContact O-CG 3.26Å; I417-L421 PolarHBondContact O-N 2.87Å; L418-L421 PolarHBondContact O-N 3.31Å; H419-L421 VanDerWaalsContact C-N 3.31Å; H419-L421 PolarHBondContact O-N 3.31Å
422	I	94.8	Very high	94	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.205	24%	0.238	C	C	.	.	H	α-helix	trans	-76	-33.2	-179.6	-64.9	164.5	0	0	0	111.1	L418 H419 V427 W476	L418-I422 HydrophobicContact CD1-CD1 3.61Å; L418-I422 HydrophobicContact CD1-CG1 4.16Å; L418-I422 HydrophobicContact CD2-CD1 4.39Å; L418-I422 HydrophobicContact CG-CD1 3.63Å; L418-I422 HydrophobicContact CG-CG1 4.5Å; L418-I422 VanDerWaalsContact O-CG1 3.3Å; L418-I422 WeakPolarHBondContact O-CG1 3.37Å; L418-I422 PolarHBondContact O-N 3.22Å; H419-I422 PolarHBondContact O-N 3.07Å; I422-V427 HydrophobicContact CB-CG2 3.93Å; I422-V427 HydrophobicContact CD1-CG2 4.41Å; I422-V427 HydrophobicContact CG2-CG2 3.66Å; I422-W476 HydrophobicContact CD1-CD2 3.87Å; I422-W476 HydrophobicContact CD1-CE3 3.32Å; I422-W476 HydrophobicContact CD1-CG 4.49Å; I422-W476 HydrophobicContact CD1-CH2 4.38Å; I422-W476 HydrophobicContact CD1-CZ3 3.61Å; I422-W476 HydrophobicContact CG1-CE3 4.39Å; I422-W476 HydrophobicContact CG1-CZ3 4.47Å; I422-W476 HydrophobicContact CG2-CD2 4.39Å; I422-W476 HydrophobicContact CG2-CG 4.29Å
423	G	93.2	Very high	92.8	Very high	27 Å²	27	47 Å²	47	28%	0.278	26%	0.257	S	S	.	.			trans	93	154.4	-177.6	0	0	0	0	0	113.3	H419 D425 V427	H419-G423 PolarHBondContact O-N 2.78Å; G423-D425 PolarHBondContact O-N 2.84Å; G423-V427 WeakPolarHBondContact O-CG2 3.31Å; G423-V427 PolarHBondContact O-N 3.39Å
424	R	93.4	Very high	91.1	Very high	41 Å²	41	50.1 Å²	50.1	16%	0.155	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-48.3	-177.8	177.8	-175.8	-125	109.4	0.2	112.1	N367 S426 V427 A428 E547 L548	N367-R424 PolarHBondContact ND2-NH1 3.11Å; R424-S426 VanDerWaalsContact C-N 3.29Å; R424-S426 PolarHBondContact O-N 2.79Å; R424-V427 PolarHBondContact O-N 3.47Å; R424-A428 PolarHBondContact O-N 2.6Å; R424-E547 PolarHBondContact NH2-O 3.21Å; R424-L548 PolarHBondContact NH2-O 3.21Å
425	D	91.6	Very high	89.1	Confident	95 Å²	95	50.3 Å²	50.3	51%	0.508	27%	0.273	S	S	.	.	H	α-helix	trans	-63.7	-37.2	-171.1	-60.3	-26.7	0	0	0	112.3	G423 C429	G423-D425 PolarHBondContact O-N 2.84Å; D425-C429 WeakPolarHBondContact O-CA 3.49Å; D425-C429 WeakPolarHBondContact O-CB 3.39Å; D425-C429 PolarHBondContact O-N 3.4Å
426	S	92.3	Very high	87	Confident	72 Å²	72	54.6 Å²	54.6	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-76.2	-29.5	178.6	-64.6	0	0	0	0	113.5	R424	R424-S426 VanDerWaalsContact C-N 3.29Å; R424-S426 PolarHBondContact O-N 2.79Å
427	V	94.1	Very high	84.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-88.4	-48.6	-178.3	178.1	0	0	0	0	111.7	I422 G423 R424 W476 C477 V480	I422-V427 HydrophobicContact CB-CG2 3.93Å; I422-V427 HydrophobicContact CD1-CG2 4.41Å; I422-V427 HydrophobicContact CG2-CG2 3.66Å; G423-V427 WeakPolarHBondContact O-CG2 3.31Å; G423-V427 PolarHBondContact O-N 3.39Å; R424-V427 PolarHBondContact O-N 3.47Å; V427-W476 HydrophobicContact CG2-CB 4.2Å; V427-C477 WeakPolarHBondContact O-CA 3.49Å; V427-C477 WeakPolarHBondContact O-CB 3.17Å; V427-V480 HydrophobicContact CG1-CB 4.2Å; V427-V480 HydrophobicContact CG1-CG2 3.9Å; V427-V480 HydrophobicContact CG2-CG2 4.34Å
428	A	94.1	Very high	81.7	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-104.8	-20.5	-168.3	0	0	0	0	0	114.4	R424 L467 I468 A545 G550	R424-A428 PolarHBondContact O-N 2.6Å; A428-L467 HydrophobicContact CB-CD1 4Å; A428-I468 WeakPolarHBondContact O-CG1 2.94Å; A428-I468 PolarHBondContact O-N 3.48Å; A428-A545 HydrophobicContact CB-CB 3.74Å; A428-G550 VanDerWaalsContact CB-O 3.25Å; A428-G550 WeakPolarHBondContact CB-O 3.45Å
429	C	93.6	Very high	79.3	Confident	13 Å²	13	60.4 Å²	60.4	9%	0.088	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	145.6	-176	-48.6	0	0	0	0	112.5	C352 D425 F466	C352-C429 HydrophobicContact CB-CB 3.6Å; C352-C429 WeakPolarHBondContact CB-SG 3.22Å; C352-C429 WeakPolarHBondContact SG-CA 3.44Å; C352-C429 WeakPolarHBondContact SG-CB 3.41Å; C352-C429 CovalentContact SG-SG 2Å; C352-C429 PolarHBondContact SG-SG 3.35Å; D425-C429 WeakPolarHBondContact O-CA 3.49Å; D425-C429 WeakPolarHBondContact O-CB 3.39Å; D425-C429 PolarHBondContact O-N 3.4Å; C429-F466 WeakPolarHBondContact CA-O 3.48Å
430	R	92.2	Very high	76.6	Confident	132 Å²	132	64.3 Å²	64.3	50%	0.498	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.9	169.1	-171	64	-179.2	134	3.5	110.2	T465 F466 I468 E473	R430-T465 CarbonylContact O-C 2.97Å; R430-T465 WeakPolarHBondContact O-CA 3.41Å; R430-F466 HydrophobicContact CB-CD1 4.44Å; R430-F466 HydrophobicContact CB-CE1 3.84Å; R430-F466 HydrophobicContact CB-CE2 4.05Å; R430-F466 HydrophobicContact CB-CZ 3.65Å; R430-F466 HydrophobicContact CG-CE1 3.97Å; R430-F466 HydrophobicContact CG-CZ 3.76Å; R430-F466 PolarHBondContact N-O 3.43Å; R430-F466 WeakPolarHBondContact O-CD1 3.39Å; R430-F466 PolarHBondContact O-N 3.3Å; R430-I468 HydrophobicContact CB-CG1 4.19Å; R430-E473 WeakPolarHBondContact CD-O 3.37Å
431	N	86.7	Confident	73.9	Confident	93 Å²	93	64.2 Å²	64.2	50%	0.497	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	136	-179.9	-59.7	-10.4	0	0	0	110	T465	N431-T465 WeakPolarHBondContact OD1-CG2 3.5Å
432	K	80.6	Confident	71.4	Confident	64 Å²	64	60.3 Å²	60.3	28%	0.278	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.4	167.3	-174.6	171.8	178.1	173.1	0	108.3	I335 L336 L337 E434 V464 F466	I335-K432 HydrophobicContact CG2-CD 4.06Å; L336-K432 PolarHBondContact O-NZ 3.04Å; L337-K432 PolarHBondContact O-NZ 2.72Å; K432-E434 PolarHBondContact O-N 2.87Å; K432-V464 PolarHBondContact N-O 3.26Å; K432-V464 PolarHBondContact O-N 2.76Å; K432-V464 VanDerWaalsContact O-O 3.14Å; K432-F466 HydrophobicContact CB-CD1 4.02Å; K432-F466 HydrophobicContact CB-CE1 3.88Å
433	V	72.7	Confident	69	Low	81 Å²	81	64.3 Å²	64.3	49%	0.491	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	108.5	174.9	-173.8	0	0	0	0	107.5	K461	V433-K461 HydrophobicContact CG1-CB 3.97Å; V433-K461 HydrophobicContact CG1-CD 4.21Å; V433-K461 HydrophobicContact CG1-CG 4.18Å
434	E	62.8	Low	67	Low	66 Å²	66	66.7 Å²	66.7	31%	0.308	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	130.5	169.5	-74.4	-168.6	164.8	0	0	109.6	I335 K432 V462 V464	I335-E434 WeakPolarHBondContact CG2-OE1 3.42Å; K432-E434 PolarHBondContact O-N 2.87Å; E434-V462 PolarHBondContact N-O 3.47Å; E434-V462 PolarHBondContact O-N 2.82Å; E434-V464 HydrophobicContact CB-CG2 3.94Å; E434-V464 HydrophobicContact CG-CG2 3.81Å
435	T	54.1	Low	64.7	Low	48 Å²	48	68 Å²	68	29%	0.294	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	114.2	170.6	-52.9	0	0	0	0	107.1	L253 S437	L253-T435 HydrophobicContact CD1-CG2 3.44Å; L253-T435 VanDerWaalsContact CD1-CG2 3.44Å; T435-S437 VanDerWaalsContact C-N 3.29Å; T435-S437 PolarHBondContact O-N 2.61Å; T435-S437 PolarHBondContact O-OG 2.88Å
436	I	54.3	Low	62.9	Low	89 Å²	89	67.3 Å²	67.3	46%	0.456	41%	0.41	S	S	.	.			trans	-60.2	97	173.7	-64.5	171.1	0	0	0	107.5	L440 V462	I436-L440 HydrophobicContact CG2-CD1 3.84Å; I436-V462 HydrophobicContact CD1-CG2 3.48Å; I436-V462 VanDerWaalsContact CD1-CG2 3.48Å; I436-V462 HydrophobicContact CG1-CG2 3.89Å
437	S	43.6	Very low	61.1	Low	67 Å²	67	72 Å²	72	47%	0.469	42%	0.424	S	S	.	.			trans	-78.2	130.2	176.1	-59.7	0	0	0	0	107.8	T435 S439	T435-S437 VanDerWaalsContact C-N 3.29Å; T435-S437 PolarHBondContact O-N 2.61Å; T435-S437 PolarHBondContact O-OG 2.88Å; S437-S439 PolarHBondContact O-N 2.96Å; S437-S439 PolarHBondContact O-OG 3.31Å; S437-S439 VanDerWaalsContact O-OG 3.11Å
438	S	39.3	Very low	59.3	Low	77 Å²	77	78.2 Å²	78.2	54%	0.538	45%	0.453	S	S	.	.	S	Bend	trans	-29.1	11.2	173.5	42.9	0	0	0	0	120.7	L440	S438-L440 VanDerWaalsContact C-N 3.31Å; S438-L440 PolarHBondContact O-N 3.08Å
439	S	45.1	Very low	57.4	Low	62 Å²	62	79.6 Å²	79.6	43%	0.434	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-7.9	-179.4	67.6	0	0	0	0	115.5	K324 S437	K324-S439 PolarHBondContact NZ-O 3.3Å; S437-S439 PolarHBondContact O-N 2.96Å; S437-S439 PolarHBondContact O-OG 3.31Å; S437-S439 VanDerWaalsContact O-OG 3.11Å
440	L	40.6	Very low	55.5	Low	91 Å²	91	79.8 Å²	79.8	48%	0.476	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.2	179.6	-80.4	148	0	0	0	114.4	I436 S438 P442	I436-L440 HydrophobicContact CG2-CD1 3.84Å; S438-L440 VanDerWaalsContact C-N 3.31Å; S438-L440 PolarHBondContact O-N 3.08Å; L440-P442 WeakPolarHBondContact O-CD 3.42Å
441	L	37.6	Very low	53.7	Low	47 Å²	47	79.9 Å²	79.9	25%	0.246	47%	0.474	C	S	.	.	S	Bend	trans	-77.4	125.4	178.5	-84.6	160.5	0	0	0	111.2	S443 L453 L454	L441-S443 PolarHBondContact O-N 3.39Å; L441-L453 HydrophobicContact CD2-CD2 4.26Å; L441-L454 HydrophobicContact CD1-CD1 3.72Å; L441-L454 HydrophobicContact CD1-CD2 3.91Å; L441-L454 HydrophobicContact CD1-CG 3.89Å
442	P	42.9	Very low	52.2	Low	61 Å²	61	82.9 Å²	82.9	40%	0.396	48%	0.483	S	S	.	.			trans	-58	133.3	174	-20.3	30.6	0	0	0	110.7	L440 G444	L440-P442 WeakPolarHBondContact O-CD 3.42Å; P442-G444 VanDerWaalsContact C-N 3.28Å; P442-G444 PolarHBondContact O-N 3.02Å
443	S	43.5	Very low	50.6	Low	125 Å²	125	84.5 Å²	84.5	87%	0.874	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	87.9	168.8	-48.7	0	0	0	0	109.1	L441	L441-S443 PolarHBondContact O-N 3.39Å
444	G	51.5	Low	49.5	Very low	76 Å²	76	84.2 Å²	84.2	78%	0.784	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	160.4	-4.8	-176.9	0	0	0	0	0	116.6	P442	P442-G444 VanDerWaalsContact C-N 3.28Å; P442-G444 PolarHBondContact O-N 3.02Å
445	V	46.1	Very low	49	Very low	69 Å²	69	86.3 Å²	86.3	42%	0.418	51%	0.507	S	S	.	.			trans	-86.7	131.3	176.6	179.6	0	0	0	0	110.3	A450	V445-A450 HydrophobicContact CG1-CB 4.06Å
446	S	52.4	Low	48.9	Very low	80 Å²	80	88.4 Å²	88.4	56%	0.559	52%	0.523	S	S	*	.			trans	-57.6	145.1	176.5	83	0	0	0	0	111	E448 G449 A450	S446-E448 PolarHBondContact O-N 3.21Å; S446-G449 WeakPolarHBondContact O-CA 3.5Å; S446-G449 PolarHBondContact O-N 2.92Å; S446-G449 PolarHBondContact OG-N 2.82Å; S446-A450 PolarHBondContact O-N 3.31Å
447	Q	55.6	Low	48.7	Very low	171 Å²	171	88.5 Å²	88.5	80%	0.799	53%	0.528	S	S	*	.	H	α-helix	trans	-51.9	-31.1	-177.8	-113.9	-179.5	-6.3	0	0	113.2	K451	Q447-K451 WeakPolarHBondContact O-CG 3.46Å; Q447-K451 PolarHBondContact O-N 2.93Å
448	E	56.1	Low	48.6	Very low	130 Å²	130	88.5 Å²	88.5	61%	0.607	53%	0.531	S	S	*	.	H	α-helix	trans	-77.2	-39.6	177.5	-151.3	66.4	-151.8	0	0	112.4	S446 K451 K452	S446-E448 PolarHBondContact O-N 3.21Å; E448-K451 PolarHBondContact O-N 3.19Å; E448-K452 PolarHBondContact O-N 3.46Å; E448-K452 VanDerWaalsContact O-N 3.11Å
449	G	54.9	Low	49.1	Very low	29 Å²	29	89.2 Å²	89.2	30%	0.299	53%	0.526	S	S	.	.	H	α-helix	trans	-68.8	-38.8	175.6	0	0	0	0	0	112.2	S446 K452 L453	S446-G449 WeakPolarHBondContact O-CA 3.5Å; S446-G449 PolarHBondContact O-N 2.92Å; S446-G449 PolarHBondContact OG-N 2.82Å; G449-K452 PolarHBondContact O-N 3.35Å; G449-L453 WeakPolarHBondContact O-CB 3.44Å; G449-L453 PolarHBondContact O-N 3.33Å
450	A	54	Low	49.1	Very low	17 Å²	17	89.7 Å²	89.7	14%	0.14	53%	0.53	C	S	.	.	H	α-helix	trans	-65.9	-39.8	175.4	0	0	0	0	0	111.1	V445 S446 L453 L454	V445-A450 HydrophobicContact CG1-CB 4.06Å; S446-A450 PolarHBondContact O-N 3.31Å; A450-L453 PolarHBondContact O-N 3.27Å; A450-L454 WeakPolarHBondContact O-CB 3.25Å; A450-L454 WeakPolarHBondContact O-CD1 3.1Å; A450-L454 WeakPolarHBondContact O-CG 3.31Å; A450-L454 PolarHBondContact O-N 3.49Å
451	K	53	Low	49.8	Very low	134 Å²	134	89.7 Å²	89.7	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-63.5	-43.9	174.3	-85.7	178	175.9	176.4	0	112.7	Q447 E448 L454 T455	Q447-K451 WeakPolarHBondContact O-CG 3.46Å; Q447-K451 PolarHBondContact O-N 2.93Å; E448-K451 PolarHBondContact O-N 3.19Å; K451-L454 PolarHBondContact O-N 3.45Å; K451-T455 PolarHBondContact O-N 3.4Å; K451-T455 PolarHBondContact O-OG1 2.84Å
452	K	55.5	Low	51.2	Low	157 Å²	157	90.1 Å²	90.1	68%	0.683	53%	0.53	S	S	*	.	H	α-helix	trans	-68	-33.9	176.5	-86.2	-176.9	175.5	178.4	0	113.7	E448 G449 T455 S456	E448-K452 PolarHBondContact O-N 3.46Å; E448-K452 VanDerWaalsContact O-N 3.11Å; G449-K452 PolarHBondContact O-N 3.35Å; K452-T455 WeakPolarHBondContact CA-OG1 3.31Å; K452-T455 PolarHBondContact O-OG1 3.18Å; K452-T455 VanDerWaalsContact O-OG1 3.14Å; K452-S456 PolarHBondContact O-N 3.32Å; K452-S456 PolarHBondContact O-OG 2.87Å
453	L	47.4	Very low	52.6	Low	97 Å²	97	92.5 Å²	92.5	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-76.4	-35.1	175.2	-150.1	91.5	0	0	0	111.4	L441 G449 A450 S456 V457	L441-L453 HydrophobicContact CD2-CD2 4.26Å; G449-L453 WeakPolarHBondContact O-CB 3.44Å; G449-L453 PolarHBondContact O-N 3.33Å; A450-L453 PolarHBondContact O-N 3.27Å; L453-S456 PolarHBondContact O-N 3.19Å; L453-S456 PolarHBondContact O-OG 3.29Å; L453-V457 VanDerWaalsContact O-CB 3.25Å; L453-V457 WeakPolarHBondContact O-CB 3.2Å; L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 2.85Å
454	L	49	Very low	54.4	Low	76 Å²	76	87.1 Å²	87.1	40%	0.398	50%	0.501	S	S	.	.	H	α-helix	trans	-74.6	-26.9	176.3	-76.5	166.5	0	0	0	112.6	L441 A450 K451 A458	L441-L454 HydrophobicContact CD1-CD1 3.72Å; L441-L454 HydrophobicContact CD1-CD2 3.91Å; L441-L454 HydrophobicContact CD1-CG 3.89Å; A450-L454 WeakPolarHBondContact O-CB 3.25Å; A450-L454 WeakPolarHBondContact O-CD1 3.1Å; A450-L454 WeakPolarHBondContact O-CG 3.31Å; A450-L454 PolarHBondContact O-N 3.49Å; K451-L454 PolarHBondContact O-N 3.45Å; L454-A458 VanDerWaalsContact O-CA 3.29Å; L454-A458 WeakPolarHBondContact O-CA 3.38Å; L454-A458 WeakPolarHBondContact O-CB 3.18Å; L454-A458 PolarHBondContact O-N 2.95Å
455	T	52.6	Low	56.2	Low	110 Å²	110	85.1 Å²	85.1	68%	0.675	47%	0.474	S	S	*	.	H	α-helix	trans	-76.7	-23.6	170.6	42.7	0	0	0	0	113.1	K451 K452	K451-T455 PolarHBondContact O-N 3.4Å; K451-T455 PolarHBondContact O-OG1 2.84Å; K452-T455 WeakPolarHBondContact CA-OG1 3.31Å; K452-T455 PolarHBondContact O-OG1 3.18Å; K452-T455 VanDerWaalsContact O-OG1 3.14Å
456	S	51.4	Low	58.3	Low	91 Å²	91	82.4 Å²	82.4	64%	0.636	46%	0.457	S	S	*	.	H	α-helix	trans	-88.4	-21.6	170.9	63.4	0	0	0	0	113.9	K452 L453	K452-S456 PolarHBondContact O-N 3.32Å; K452-S456 PolarHBondContact O-OG 2.87Å; L453-S456 PolarHBondContact O-N 3.19Å; L453-S456 PolarHBondContact O-OG 3.29Å
457	V	49.9	Very low	60.2	Low	92 Å²	92	78.7 Å²	78.7	56%	0.558	43%	0.431	S	S	*	.	S	Bend	trans	-103.2	9	176.9	-177.9	0	0	0	0	111.9	L453 Q459	L453-V457 VanDerWaalsContact O-CB 3.25Å; L453-V457 WeakPolarHBondContact O-CB 3.2Å; L453-V457 WeakPolarHBondContact O-CG2 3.48Å; L453-V457 PolarHBondContact O-N 2.85Å; V457-Q459 PolarHBondContact O-N 3.31Å
458	A	41.9	Very low	61.9	Low	66 Å²	66	70.6 Å²	70.6	55%	0.545	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	109.8	-176.7	0	0	0	0	0	111.7	L454	L454-A458 VanDerWaalsContact O-CA 3.29Å; L454-A458 WeakPolarHBondContact O-CA 3.38Å; L454-A458 WeakPolarHBondContact O-CB 3.18Å; L454-A458 PolarHBondContact O-N 2.95Å
459	Q	50.3	Low	63.4	Low	93 Å²	93	65.8 Å²	65.8	44%	0.435	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.5	50.9	162	-50.4	-178.7	-20.2	0	0	116.9	L253 V457 K461	L253-Q459 HydrophobicContact CD2-CB 3.76Å; L253-Q459 HydrophobicContact CD2-CG 3.52Å; L253-Q459 HydrophobicContact CG-CG 4.39Å; V457-Q459 PolarHBondContact O-N 3.31Å; Q459-K461 VanDerWaalsContact C-N 3.28Å; Q459-K461 PolarHBondContact O-N 2.95Å
460	S	44.7	Very low	64.7	Low	72 Å²	72	66.6 Å²	66.6	50%	0.503	37%	0.373	S	S	.	.			trans	-67.3	93.4	159	-173.9	0	0	0	0	109.2	V462	S460-V462 PolarHBondContact O-N 3.23Å
461	K	56.2	Low	65.4	Low	90 Å²	90	65.9 Å²	65.9	39%	0.391	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	112.2	165.5	-73	-178.9	-178.7	180	0	106.6	L253 V433 Q459	L253-K461 PolarHBondContact O-NZ 3.47Å; V433-K461 HydrophobicContact CG1-CB 3.97Å; V433-K461 HydrophobicContact CG1-CD 4.21Å; V433-K461 HydrophobicContact CG1-CG 4.18Å; Q459-K461 VanDerWaalsContact C-N 3.28Å; Q459-K461 PolarHBondContact O-N 2.95Å
462	V	65.6	Low	66.5	Low	56 Å²	56	67.3 Å²	67.3	34%	0.339	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	119.2	177.1	-175.4	0	0	0	0	108	E434 I436 S460 V464	E434-V462 PolarHBondContact N-O 3.47Å; E434-V462 PolarHBondContact O-N 2.82Å; I436-V462 HydrophobicContact CD1-CG2 3.48Å; I436-V462 VanDerWaalsContact CD1-CG2 3.48Å; I436-V462 HydrophobicContact CG1-CG2 3.89Å; S460-V462 PolarHBondContact O-N 3.23Å; V462-V464 HydrophobicContact CB-CG2 4.4Å; V462-V464 HydrophobicContact CG1-CG2 3.96Å; V462-V464 PolarHBondContact O-N 3.41Å
463	N	74	Confident	67.6	Low	111 Å²	111	62.5 Å²	62.5	59%	0.594	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	106.7	169.7	-75.7	-17.8	0	0	0	108.3
464	V	81	Confident	69.4	Low	12 Å²	12	58.6 Å²	58.6	7%	0.073	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	139.2	177.4	-155.3	0	0	0	0	108.9	I335 R351 K432 E434 V462	I335-V464 HydrophobicContact CD1-CB 3.73Å; I335-V464 HydrophobicContact CD1-CG1 3.3Å; I335-V464 HydrophobicContact CG1-CG1 4.29Å; R351-V464 HydrophobicContact CG-CG1 4.43Å; K432-V464 PolarHBondContact N-O 3.26Å; K432-V464 PolarHBondContact O-N 2.76Å; K432-V464 VanDerWaalsContact O-O 3.14Å; E434-V464 HydrophobicContact CB-CG2 3.94Å; E434-V464 HydrophobicContact CG-CG2 3.81Å; V462-V464 HydrophobicContact CB-CG2 4.4Å; V462-V464 HydrophobicContact CG1-CG2 3.96Å; V462-V464 PolarHBondContact O-N 3.41Å
465	T	88.7	Confident	71.5	Confident	35 Å²	35	60 Å²	60	22%	0.215	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.8	-179.5	68.2	0	0	0	0	110.7	R351 C352 R430 N431	R351-T465 WeakPolarHBondContact CA-O 3.4Å; C352-T465 PolarHBondContact N-O 3.48Å; R430-T465 CarbonylContact O-C 2.97Å; R430-T465 WeakPolarHBondContact O-CA 3.41Å; N431-T465 WeakPolarHBondContact OD1-CG2 3.5Å
466	F	90.7	Very high	73.5	Confident	11 Å²	11	60.5 Å²	60.5	5%	0.048	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	154.4	176.7	64.4	-83	0	0	0	111.8	I335 L337 A349 R350 C429 R430 K432 E473	I335-F466 HydrophobicContact CD1-CB 3.93Å; L337-F466 HydrophobicContact CD1-CE2 4.35Å; L337-F466 HydrophobicContact CD2-CD1 4.23Å; L337-F466 HydrophobicContact CD2-CD2 3.92Å; L337-F466 HydrophobicContact CD2-CE1 4.14Å; L337-F466 HydrophobicContact CD2-CE2 3.79Å; L337-F466 HydrophobicContact CD2-CG 4.13Å; L337-F466 HydrophobicContact CD2-CZ 3.9Å; A349-F466 HydrophobicContact CB-CB 4.02Å; A349-F466 HydrophobicContact CB-CD2 3.76Å; A349-F466 HydrophobicContact CB-CG 4.2Å; R350-F466 CarbonylContact O-C 3.51Å; R350-F466 VanDerWaalsContact O-CA 3.31Å; R350-F466 WeakPolarHBondContact O-CA 3.31Å; R350-F466 WeakPolarHBondContact O-CB 3.35Å; C429-F466 WeakPolarHBondContact CA-O 3.48Å; R430-F466 HydrophobicContact CB-CD1 4.44Å; R430-F466 HydrophobicContact CB-CE1 3.84Å; R430-F466 HydrophobicContact CB-CE2 4.05Å; R430-F466 HydrophobicContact CB-CZ 3.65Å; R430-F466 HydrophobicContact CG-CE1 3.97Å; R430-F466 HydrophobicContact CG-CZ 3.76Å; R430-F466 PolarHBondContact N-O 3.43Å; R430-F466 WeakPolarHBondContact O-CD1 3.39Å; R430-F466 PolarHBondContact O-N 3.3Å; K432-F466 HydrophobicContact CB-CD1 4.02Å; K432-F466 HydrophobicContact CB-CE1 3.88Å; F466-E473 WeakPolarHBondContact CE2-OE2 3.45Å
467	L	91.7	Very high	75.6	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	125.6	174.5	-169.1	68.9	0	0	0	108.6	R350 A428 T469 A545 E547	R350-L467 PolarHBondContact O-N 3.06Å; A428-L467 HydrophobicContact CB-CD1 4Å; L467-T469 WeakPolarHBondContact O-CG2 3.3Å; L467-T469 PolarHBondContact O-N 3.41Å; L467-A545 HydrophobicContact CD1-CB 3.55Å; L467-A545 WeakPolarHBondContact CD2-O 3.37Å; L467-A545 HydrophobicContact CG-CB 3.79Å; L467-E547 HydrophobicContact CD2-CB 4.35Å
468	I	91.9	Very high	77.7	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.293	C	S	.	.			trans	-54.6	130.6	-175.8	-70.5	166.3	0	0	0	111	A428 R430 S470 E473 C477 A545 Q557	A428-I468 WeakPolarHBondContact O-CG1 2.94Å; A428-I468 PolarHBondContact O-N 3.48Å; R430-I468 HydrophobicContact CB-CG1 4.19Å; I468-S470 VanDerWaalsContact CG2-O 3.22Å; I468-S470 WeakPolarHBondContact CG2-O 2.87Å; I468-E473 HydrophobicContact CG1-CB 4.3Å; I468-E473 HydrophobicContact CG2-CB 4.2Å; I468-C477 HydrophobicContact CD1-CB 3.7Å; I468-A545 HydrophobicContact CB-CB 4.25Å; I468-A545 PolarHBondContact O-N 3.4Å; I468-Q557 PolarHBondContact O-NE2 2.86Å
469	T	87.2	Confident	80.3	Confident	28 Å²	28	51.1 Å²	51.1	17%	0.172	27%	0.272	C	S	.	.			trans	-115.1	-4.1	179	63.3	0	0	0	0	112.8	L337 A349 L467 E473 D544	L337-T469 WeakPolarHBondContact CD1-OG1 3.38Å; A349-T469 HydrophobicContact CB-CG2 3.6Å; L467-T469 WeakPolarHBondContact O-CG2 3.3Å; L467-T469 PolarHBondContact O-N 3.41Å; T469-E473 PolarHBondContact N-OE2 3.47Å; T469-E473 VanDerWaalsContact N-OE2 3.11Å; T469-D544 VanDerWaalsContact O-OD1 3.11Å
470	S	81.3	Confident	82.5	Confident	46 Å²	46	46.7 Å²	46.7	32%	0.322	25%	0.251	S	S	.	.	S	Bend	trans	-148.6	134	177.1	-70.4	0	0	0	0	110.3	I468 H472 E473 I543	I468-S470 VanDerWaalsContact CG2-O 3.22Å; I468-S470 WeakPolarHBondContact CG2-O 2.87Å; S470-H472 PolarHBondContact O-N 3.09Å; S470-E473 PolarHBondContact N-OE2 3.41Å; S470-E473 WeakPolarHBondContact O-CB 3.46Å; S470-E473 WeakPolarHBondContact O-CG 3.29Å; S470-E473 PolarHBondContact O-N 2.97Å; S470-I543 CarbonylContact C-O 3.58Å; S470-I543 WeakPolarHBondContact CA-O 3.35Å; S470-I543 PolarHBondContact N-O 3.15Å
471	G	69.9	Low	84.9	Confident	3 Å²	3	43.3 Å²	43.3	3%	0.031	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-59.2	-22.9	-171.6	0	0	0	0	0	115.4	E473 T478 I543	G471-E473 PolarHBondContact O-N 3.34Å; G471-T478 PolarHBondContact O-OG1 3.04Å; G471-I543 PolarHBondContact N-O 3.43Å
472	H	75.8	Confident	86.9	Confident	164 Å²	164	42 Å²	42	76%	0.759	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-70.8	-16	179.3	-165.9	60.8	0	0	0	113.6	S470 G474	S470-H472 PolarHBondContact O-N 3.09Å; H472-G474 VanDerWaalsContact C-N 3.35Å; H472-G474 PolarHBondContact O-N 3.44Å
473	E	77.9	Confident	88.4	Confident	56 Å²	56	40.9 Å²	40.9	26%	0.262	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-78.4	-18	-174.7	-59.2	178.8	140	0	0	113.4	R430 F466 I468 T469 S470 G471	R430-E473 WeakPolarHBondContact CD-O 3.37Å; F466-E473 WeakPolarHBondContact CE2-OE2 3.45Å; I468-E473 HydrophobicContact CG1-CB 4.3Å; I468-E473 HydrophobicContact CG2-CB 4.2Å; T469-E473 PolarHBondContact N-OE2 3.47Å; T469-E473 VanDerWaalsContact N-OE2 3.11Å; S470-E473 PolarHBondContact N-OE2 3.41Å; S470-E473 WeakPolarHBondContact O-CB 3.46Å; S470-E473 WeakPolarHBondContact O-CG 3.29Å; S470-E473 PolarHBondContact O-N 2.97Å; G471-E473 PolarHBondContact O-N 3.34Å
474	G	86	Confident	89.5	Confident	14 Å²	14	36 Å²	36	14%	0.144	19%	0.19	C	C	.	.			trans	-148.9	119.7	-176	0	0	0	0	0	114.4	H472 C477 T478	H472-G474 VanDerWaalsContact C-N 3.35Å; H472-G474 PolarHBondContact O-N 3.44Å; G474-C477 WeakPolarHBondContact O-CB 3.44Å; G474-C477 PolarHBondContact O-N 3.46Å; G474-T478 PolarHBondContact O-N 3Å; G474-T478 VanDerWaalsContact O-N 3.12Å; G474-T478 PolarHBondContact O-OG1 3.2Å
475	T	92.1	Very high	90.3	Very high	106 Å²	106	35.5 Å²	35.5	65%	0.65	19%	0.187	S	C	*	.	H	α-helix	trans	-61.3	-47.4	177.2	-50.8	0	0	0	0	111.9	C477 T478 I479	T475-C477 VanDerWaalsContact C-N 3.35Å; T475-C477 PolarHBondContact O-N 2.93Å; T475-T478 PolarHBondContact O-N 3.41Å; T475-I479 HydrophobicContact CG2-CD1 4.01Å; T475-I479 WeakPolarHBondContact O-CG1 3.37Å; T475-I479 PolarHBondContact O-N 3.39Å
476	W	94.3	Very high	90.7	Very high	121 Å²	121	36.3 Å²	36.3	46%	0.458	19%	0.187	S	C	.	.	H	α-helix	trans	-66.4	-36.6	-179.9	-66.3	118.7	0	0	0	112.7	I422 V427 T478 I479 V480	I422-W476 HydrophobicContact CD1-CD2 3.87Å; I422-W476 HydrophobicContact CD1-CE3 3.32Å; I422-W476 HydrophobicContact CD1-CG 4.49Å; I422-W476 HydrophobicContact CD1-CH2 4.38Å; I422-W476 HydrophobicContact CD1-CZ3 3.61Å; I422-W476 HydrophobicContact CG1-CE3 4.39Å; I422-W476 HydrophobicContact CG1-CZ3 4.47Å; I422-W476 HydrophobicContact CG2-CD2 4.39Å; I422-W476 HydrophobicContact CG2-CG 4.29Å; V427-W476 HydrophobicContact CG2-CB 4.2Å; W476-T478 VanDerWaalsContact C-N 3.33Å; W476-T478 PolarHBondContact O-N 3.34Å; W476-I479 HydrophobicContact CE3-CD1 3.75Å; W476-I479 HydrophobicContact CZ3-CD1 4Å; W476-I479 PolarHBondContact O-N 3.48Å; W476-V480 WeakPolarHBondContact O-CG2 3.47Å; W476-V480 PolarHBondContact O-N 3.46Å
477	C	95.5	Very high	91.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-55.5	-49.7	171.5	-170.6	0	0	0	0	111.1	V427 I468 G474 T475 V480 F481 C552	V427-C477 WeakPolarHBondContact O-CA 3.49Å; V427-C477 WeakPolarHBondContact O-CB 3.17Å; I468-C477 HydrophobicContact CD1-CB 3.7Å; G474-C477 WeakPolarHBondContact O-CB 3.44Å; G474-C477 PolarHBondContact O-N 3.46Å; T475-C477 VanDerWaalsContact C-N 3.35Å; T475-C477 PolarHBondContact O-N 2.93Å; C477-V480 PolarHBondContact O-N 2.84Å; C477-F481 WeakPolarHBondContact O-CB 3.32Å; C477-F481 PolarHBondContact O-N 2.98Å; C477-C552 WeakPolarHBondContact CA-SG 3.42Å; C477-C552 HydrophobicContact CB-CB 3.97Å; C477-C552 WeakPolarHBondContact CB-SG 3.37Å; C477-C552 VanDerWaalsContact O-CB 3.22Å; C477-C552 WeakPolarHBondContact O-CB 3.3Å; C477-C552 WeakPolarHBondContact SG-CB 3.45Å; C477-C552 CovalentContact SG-SG 2.02Å; C477-C552 PolarHBondContact SG-SG 2.91Å
478	T	95.6	Very high	91.3	Very high	30 Å²	30	38.2 Å²	38.2	18%	0.184	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-42.8	178.1	-65.1	0	0	0	0	112	G471 G474 T475 W476 V480 F481 L482 L538	G471-T478 PolarHBondContact O-OG1 3.04Å; G474-T478 PolarHBondContact O-N 3Å; G474-T478 VanDerWaalsContact O-N 3.12Å; G474-T478 PolarHBondContact O-OG1 3.2Å; T475-T478 PolarHBondContact O-N 3.41Å; W476-T478 VanDerWaalsContact C-N 3.33Å; W476-T478 PolarHBondContact O-N 3.34Å; T478-V480 PolarHBondContact O-N 3.13Å; T478-F481 WeakPolarHBondContact O-CB 3.25Å; T478-F481 PolarHBondContact O-N 3.4Å; T478-L482 HydrophobicContact CG2-CD1 4.22Å; T478-L482 HydrophobicContact CG2-CG 4.3Å; T478-L482 VanDerWaalsContact O-CG 3.25Å; T478-L482 WeakPolarHBondContact O-CG 3.47Å; T478-L482 PolarHBondContact O-N 2.8Å; T478-L538 HydrophobicContact CG2-CD2 3.9Å
479	I	95.6	Very high	91.6	Very high	22 Å²	22	38.3 Å²	38.3	11%	0.113	20%	0.197	C	C	.	.	H	α-helix	trans	-61.3	-46.8	178	-67.4	165.4	0	0	0	111.3	L418 T475 W476 F481 L482 I483 L884	L418-I479 HydrophobicContact CD2-CG2 3.96Å; T475-I479 HydrophobicContact CG2-CD1 4.01Å; T475-I479 WeakPolarHBondContact O-CG1 3.37Å; T475-I479 PolarHBondContact O-N 3.39Å; W476-I479 HydrophobicContact CE3-CD1 3.75Å; W476-I479 HydrophobicContact CZ3-CD1 4Å; W476-I479 PolarHBondContact O-N 3.48Å; I479-F481 VanDerWaalsContact C-N 3.34Å; I479-L482 PolarHBondContact O-N 3.27Å; I479-I483 HydrophobicContact CG2-CD1 4.12Å; I479-I483 WeakPolarHBondContact O-CG1 3.49Å; I479-I483 PolarHBondContact O-N 3.16Å; I479-I483 VanDerWaalsContact O-N 3.16Å; I479-L884 HydrophobicContact CD1-CD1 3.72Å; I479-L884 HydrophobicContact CG1-CD1 3.82Å
480	V	96.1	Very high	92.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-62.6	-43.7	177.6	170.3	0	0	0	0	110.5	L418 H419 V427 W476 C477 T478 L482 I483 L484 L551	L418-V480 HydrophobicContact CD2-CG2 4.5Å; H419-V480 HydrophobicContact CB-CG1 4.46Å; H419-V480 HydrophobicContact CB-CG2 4.37Å; V427-V480 HydrophobicContact CG1-CB 4.2Å; V427-V480 HydrophobicContact CG1-CG2 3.9Å; V427-V480 HydrophobicContact CG2-CG2 4.34Å; W476-V480 WeakPolarHBondContact O-CG2 3.47Å; W476-V480 PolarHBondContact O-N 3.46Å; C477-V480 PolarHBondContact O-N 2.84Å; T478-V480 PolarHBondContact O-N 3.13Å; V480-L482 PolarHBondContact O-N 3.18Å; V480-I483 PolarHBondContact O-N 3.44Å; V480-L484 HydrophobicContact CG1-CD1 3.6Å; V480-L484 HydrophobicContact CG1-CG 4.22Å; V480-L484 WeakPolarHBondContact O-CB 3.25Å; V480-L484 WeakPolarHBondContact O-CG 3.36Å; V480-L484 PolarHBondContact O-N 3.14Å; V480-L551 HydrophobicContact CG1-CD2 4.08Å
481	F	96.9	Very high	92.8	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-56.2	-49.9	173.2	160.4	-102.7	0	0	0	112.1	C477 T478 I479 I483 L484 F485 T534 I537 L538 I543 C552	C477-F481 WeakPolarHBondContact O-CB 3.32Å; C477-F481 PolarHBondContact O-N 2.98Å; T478-F481 WeakPolarHBondContact O-CB 3.25Å; T478-F481 PolarHBondContact O-N 3.4Å; I479-F481 VanDerWaalsContact C-N 3.34Å; F481-I483 VanDerWaalsContact C-N 3.3Å; F481-I483 PolarHBondContact O-N 3.06Å; F481-L484 PolarHBondContact O-N 3.37Å; F481-F485 HydrophobicContact CD2-CB 3.79Å; F481-F485 HydrophobicContact CD2-CG 4.37Å; F481-F485 HydrophobicContact CE2-CB 3.51Å; F481-F485 HydrophobicContact CE2-CD1 4.11Å; F481-F485 HydrophobicContact CE2-CD2 4.01Å; F481-F485 AromaticContact CE2-CG 3.61Å; F481-F485 HydrophobicContact CE2-CG 3.61Å; F481-F485 HydrophobicContact CZ-CB 4.11Å; F481-F485 HydrophobicContact CZ-CD1 4.07Å; F481-F485 HydrophobicContact CZ-CG 4.05Å; F481-F485 WeakPolarHBondContact O-CB 3.47Å; F481-F485 PolarHBondContact O-N 3.18Å; F481-T534 HydrophobicContact CE1-CG2 4.09Å; F481-T534 HydrophobicContact CZ-CG2 4.45Å; F481-I537 HydrophobicContact CE1-CG2 4.14Å; F481-I537 HydrophobicContact CE2-CD1 4.49Å; F481-I537 HydrophobicContact CE2-CG2 3.96Å; F481-I537 HydrophobicContact CZ-CB 3.9Å; F481-I537 HydrophobicContact CZ-CD1 4.15Å; F481-I537 HydrophobicContact CZ-CG2 3.4Å; F481-L538 HydrophobicContact CD1-CD2 4.45Å; F481-L538 HydrophobicContact CE1-CD2 4.15Å; F481-L538 HydrophobicContact CE1-CG 4.4Å; F481-I543 HydrophobicContact CB-CD1 4.5Å; F481-I543 HydrophobicContact CB-CG2 3.95Å; F481-I543 HydrophobicContact CD1-CD1 3.31Å; F481-I543 HydrophobicContact CD1-CG1 3.9Å; F481-I543 HydrophobicContact CD2-CD1 4.49Å; F481-I543 HydrophobicContact CD2-CG1 4.21Å; F481-I543 HydrophobicContact CD2-CG2 4.29Å; F481-I543 HydrophobicContact CE1-CD1 3.54Å; F481-I543 HydrophobicContact CE1-CG1 3.98Å; F481-I543 HydrophobicContact CE2-CG1 4.26Å; F481-I543 HydrophobicContact CG-CD1 3.84Å; F481-I543 HydrophobicContact CG-CG1 4.01Å; F481-I543 HydrophobicContact CG-CG2 4.01Å; F481-I543 HydrophobicContact CZ-CD1 4.22Å; F481-I543 HydrophobicContact CZ-CG1 4.15Å; F481-C552 WeakPolarHBondContact CA-O 3.22Å; F481-C552 HydrophobicContact CB-CB 4.35Å
482	L	97	Very high	94.1	Very high	62 Å²	62	35 Å²	35	33%	0.325	17%	0.174	S	C	.	.	H	α-helix	trans	-56.2	-46.2	-178.3	-74.5	174.7	0	0	0	111.3	T478 I479 V480 Y486 T534 L538	T478-L482 HydrophobicContact CG2-CD1 4.22Å; T478-L482 HydrophobicContact CG2-CG 4.3Å; T478-L482 VanDerWaalsContact O-CG 3.25Å; T478-L482 WeakPolarHBondContact O-CG 3.47Å; T478-L482 PolarHBondContact O-N 2.8Å; I479-L482 PolarHBondContact O-N 3.27Å; V480-L482 PolarHBondContact O-N 3.18Å; L482-Y486 WeakPolarHBondContact O-CB 3.37Å; L482-Y486 PolarHBondContact O-N 2.9Å; L482-T534 HydrophobicContact CD2-CG2 3.43Å; L482-T534 VanDerWaalsContact CD2-CG2 3.43Å; L482-L538 HydrophobicContact CD2-CD1 4.02Å; L482-L538 HydrophobicContact CD2-CD2 4.34Å
483	I	97.3	Very high	95.1	Very high	34 Å²	34	27.8 Å²	27.8	17%	0.174	14%	0.141	C	C	.	.	H	α-helix	trans	-67.4	-53.7	179.9	-63.3	167.9	0	0	0	110.3	F411 L418 I479 V480 F481 F487	F411-I483 WeakPolarHBondContact O-CG2 3.39Å; L418-I483 HydrophobicContact CD2-CD1 3.65Å; I479-I483 HydrophobicContact CG2-CD1 4.12Å; I479-I483 WeakPolarHBondContact O-CG1 3.49Å; I479-I483 PolarHBondContact O-N 3.16Å; I479-I483 VanDerWaalsContact O-N 3.16Å; V480-I483 PolarHBondContact O-N 3.44Å; F481-I483 VanDerWaalsContact C-N 3.3Å; F481-I483 PolarHBondContact O-N 3.06Å; I483-F487 HydrophobicContact CG2-CD2 4.18Å; I483-F487 VanDerWaalsContact O-CD2 3.26Å; I483-F487 WeakPolarHBondContact O-CD2 3Å; I483-F487 PolarHBondContact O-N 2.62Å
484	L	97.3	Very high	96	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-48.9	-174.3	-68.2	178.3	0	0	0	111.8	Y412 F416 V480 F481 S488 L551	Y412-L484 HydrophobicContact CD2-CB 4.45Å; Y412-L484 HydrophobicContact CD2-CD2 3.95Å; Y412-L484 WeakPolarHBondContact CD2-O 3.38Å; Y412-L484 HydrophobicContact CE2-CB 4.17Å; Y412-L484 HydrophobicContact CE2-CD2 3.88Å; Y412-L484 VanDerWaalsContact CE2-O 3.26Å; Y412-L484 WeakPolarHBondContact CE2-O 3.32Å; Y412-L484 VanDerWaalsContact O-CD2 3.31Å; Y412-L484 WeakPolarHBondContact O-CD2 3.33Å; F416-L484 HydrophobicContact CD2-CD2 3.68Å; F416-L484 HydrophobicContact CE2-CD2 3.51Å; F416-L484 HydrophobicContact CG-CD2 4.29Å; F416-L484 HydrophobicContact CZ-CD2 4.02Å; V480-L484 HydrophobicContact CG1-CD1 3.6Å; V480-L484 HydrophobicContact CG1-CG 4.22Å; V480-L484 WeakPolarHBondContact O-CB 3.25Å; V480-L484 WeakPolarHBondContact O-CG 3.36Å; V480-L484 PolarHBondContact O-N 3.14Å; F481-L484 PolarHBondContact O-N 3.37Å; L484-S488 WeakPolarHBondContact O-CB 3.46Å; L484-S488 PolarHBondContact O-N 2.82Å; L484-S488 VanDerWaalsContact O-N 3.12Å; L484-L551 HydrophobicContact CD1-CB 4.45Å; L484-L551 HydrophobicContact CD1-CD1 4.37Å; L484-L551 HydrophobicContact CD1-CD2 4Å
485	F	97.7	Very high	96.5	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-69.5	-51.2	-175.3	-176	-94.9	0	0	0	111.8	F481 F487 S488 Q489 K533 T534 I537 N553 V554 I566	F481-F485 HydrophobicContact CD2-CB 3.79Å; F481-F485 HydrophobicContact CD2-CG 4.37Å; F481-F485 HydrophobicContact CE2-CB 3.51Å; F481-F485 HydrophobicContact CE2-CD1 4.11Å; F481-F485 HydrophobicContact CE2-CD2 4.01Å; F481-F485 AromaticContact CE2-CG 3.61Å; F481-F485 HydrophobicContact CE2-CG 3.61Å; F481-F485 HydrophobicContact CZ-CB 4.11Å; F481-F485 HydrophobicContact CZ-CD1 4.07Å; F481-F485 HydrophobicContact CZ-CG 4.05Å; F481-F485 WeakPolarHBondContact O-CB 3.47Å; F481-F485 PolarHBondContact O-N 3.18Å; F485-F487 PolarHBondContact O-N 3.27Å; F485-S488 PolarHBondContact O-N 3.46Å; F485-Q489 HydrophobicContact CD1-CG 4.18Å; F485-Q489 HydrophobicContact CD2-CG 4.34Å; F485-Q489 HydrophobicContact CE1-CG 3.85Å; F485-Q489 HydrophobicContact CE2-CG 4.04Å; F485-Q489 HydrophobicContact CG-CG 4.41Å; F485-Q489 HydrophobicContact CZ-CG 3.78Å; F485-Q489 VanDerWaalsContact O-CG 3.23Å; F485-Q489 WeakPolarHBondContact O-CG 3.19Å; F485-Q489 PolarHBondContact O-N 3.05Å; F485-K533 HydrophobicContact CE1-CB 4.31Å; F485-K533 HydrophobicContact CE1-CD 3.89Å; F485-K533 HydrophobicContact CE1-CG 3.89Å; F485-K533 HydrophobicContact CZ-CD 3.57Å; F485-K533 HydrophobicContact CZ-CG 3.81Å; F485-T534 WeakPolarHBondContact CD1-OG1 3.28Å; F485-I537 HydrophobicContact CD1-CD1 4.13Å; F485-I537 HydrophobicContact CD2-CD1 4.42Å; F485-I537 HydrophobicContact CE1-CD1 3.39Å; F485-I537 HydrophobicContact CE2-CD1 3.73Å; F485-I537 HydrophobicContact CZ-CD1 3.13Å; F485-N553 WeakPolarHBondContact CD2-OD1 3.49Å; F485-V554 HydrophobicContact CD2-CG1 4.05Å; F485-V554 HydrophobicContact CE2-CG1 3.72Å; F485-I566 HydrophobicContact CE2-CG1 4.45Å
486	Y	98	Very high	96.7	Very high	52 Å²	52	19.8 Å²	19.8	20%	0.204	9%	0.093	C	C	.	.	H	α-helix	trans	-60	-52.2	-175.4	179.2	-96.6	0	0	0	111.8	L482 S488 Q489 A490 W527 P530 A531	L482-Y486 WeakPolarHBondContact O-CB 3.37Å; L482-Y486 PolarHBondContact O-N 2.9Å; Y486-S488 PolarHBondContact O-N 2.93Å; Y486-Q489 PolarHBondContact O-N 2.77Å; Y486-A490 WeakPolarHBondContact O-CB 3.06Å; Y486-A490 PolarHBondContact O-N 3.34Å; Y486-W527 HydrophobicContact CE1-CE3 4.11Å; Y486-W527 HydrophobicContact CE1-CZ3 4.21Å; Y486-W527 PolarHBondContact OH-O 2.91Å; Y486-P530 HydrophobicContact CD2-CB 3.87Å; Y486-P530 HydrophobicContact CE2-CB 3.86Å; Y486-A531 HydrophobicContact CE2-CB 3.84Å
487	F	97.9	Very high	96.7	Very high	35 Å²	35	14.5 Å²	14.5	15%	0.154	7%	0.073	C	C	.	.	H	α-helix	trans	-72.2	-30	-176.5	-70	-70.4	0	0	0	112.6	C408 F411 I483 F485 S491	C408-F487 WeakPolarHBondContact O-CB 3.46Å; F411-F487 HydrophobicContact CB-CB 4.39Å; F411-F487 HydrophobicContact CB-CD1 3.83Å; F411-F487 HydrophobicContact CB-CD2 3.34Å; F411-F487 HydrophobicContact CB-CE1 3.85Å; F411-F487 HydrophobicContact CB-CE2 3.38Å; F411-F487 HydrophobicContact CB-CG 3.58Å; F411-F487 HydrophobicContact CB-CZ 3.63Å; F411-F487 HydrophobicContact CD1-CE2 4.23Å; F411-F487 HydrophobicContact CD1-CZ 4.17Å; F411-F487 HydrophobicContact CD2-CD1 4.17Å; F411-F487 AromaticContact CD2-CE1 3.56Å; F411-F487 HydrophobicContact CD2-CE1 3.56Å; F411-F487 HydrophobicContact CD2-CE2 4.28Å; F411-F487 AromaticContact CD2-CZ 3.63Å; F411-F487 HydrophobicContact CD2-CZ 3.63Å; F411-F487 HydrophobicContact CE2-CE1 4.35Å; F411-F487 HydrophobicContact CE2-CZ 4.31Å; F411-F487 HydrophobicContact CG-CD1 4.33Å; F411-F487 HydrophobicContact CG-CD2 4.2Å; F411-F487 AromaticContact CG-CE1 3.87Å; F411-F487 HydrophobicContact CG-CE1 3.87Å; F411-F487 AromaticContact CG-CE2 3.74Å; F411-F487 HydrophobicContact CG-CE2 3.74Å; F411-F487 HydrophobicContact CG-CG 4.49Å; F411-F487 AromaticContact CG-CZ 3.55Å; F411-F487 HydrophobicContact CG-CZ 3.55Å; I483-F487 HydrophobicContact CG2-CD2 4.18Å; I483-F487 VanDerWaalsContact O-CD2 3.26Å; I483-F487 WeakPolarHBondContact O-CD2 3Å; I483-F487 PolarHBondContact O-N 2.62Å; F485-F487 PolarHBondContact O-N 3.27Å; F487-S491 WeakPolarHBondContact O-CB 3.42Å; F487-S491 PolarHBondContact O-N 3.13Å
488	S	96.8	Very high	96.6	Very high	18 Å²	18	14.6 Å²	14.6	13%	0.126	7%	0.074	C	C	.	.	H	α-helix	trans	-60.4	-52.9	169	-178.5	0	0	0	0	110.9	L484 F485 Y486 A490 S491 Y492	L484-S488 WeakPolarHBondContact O-CB 3.46Å; L484-S488 PolarHBondContact O-N 2.82Å; L484-S488 VanDerWaalsContact O-N 3.12Å; F485-S488 PolarHBondContact O-N 3.46Å; Y486-S488 PolarHBondContact O-N 2.93Å; S488-A490 PolarHBondContact O-N 3.43Å; S488-S491 WeakPolarHBondContact O-CB 3.33Å; S488-S491 PolarHBondContact O-N 2.93Å; S488-S491 VanDerWaalsContact O-N 3.15Å; S488-S491 PolarHBondContact O-OG 3.49Å; S488-Y492 WeakPolarHBondContact O-CD2 3.48Å; S488-Y492 PolarHBondContact O-N 2.91Å
489	Q	97.3	Very high	96.6	Very high	3 Å²	3	13.1 Å²	13.1	1%	0.014	7%	0.065	C	C	.	.	H	α-helix	trans	-64.4	-39.3	-178.9	-62.5	-63	-22.1	0	0	112.4	F485 Y486 S491 Y492 L493 P530 K533	F485-Q489 HydrophobicContact CD1-CG 4.18Å; F485-Q489 HydrophobicContact CD2-CG 4.34Å; F485-Q489 HydrophobicContact CE1-CG 3.85Å; F485-Q489 HydrophobicContact CE2-CG 4.04Å; F485-Q489 HydrophobicContact CG-CG 4.41Å; F485-Q489 HydrophobicContact CZ-CG 3.78Å; F485-Q489 VanDerWaalsContact O-CG 3.23Å; F485-Q489 WeakPolarHBondContact O-CG 3.19Å; F485-Q489 PolarHBondContact O-N 3.05Å; Y486-Q489 PolarHBondContact O-N 2.77Å; Q489-S491 VanDerWaalsContact C-N 3.32Å; Q489-S491 PolarHBondContact O-N 2.71Å; Q489-Y492 WeakPolarHBondContact O-CB 3.45Å; Q489-Y492 PolarHBondContact O-N 3.4Å; Q489-L493 PolarHBondContact O-N 3.01Å; Q489-P530 HydrophobicContact CB-CB 4.02Å; Q489-P530 HydrophobicContact CB-CG 4.27Å; Q489-K533 HydrophobicContact CG-CD 4.23Å
490	A	97.8	Very high	96.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.9	-40.4	174.1	0	0	0	0	0	112.2	Y486 S488 Y492 L493 W494 W527 P530	Y486-A490 WeakPolarHBondContact O-CB 3.06Å; Y486-A490 PolarHBondContact O-N 3.34Å; S488-A490 PolarHBondContact O-N 3.43Å; A490-Y492 VanDerWaalsContact C-N 3.27Å; A490-Y492 PolarHBondContact O-N 3.27Å; A490-L493 PolarHBondContact O-N 3.29Å; A490-W494 VanDerWaalsContact O-CD1 3.23Å; A490-W494 PolarHBondContact O-N 3.44Å; A490-W527 HydrophobicContact CB-CE3 3.85Å; A490-W527 HydrophobicContact CB-CZ3 3.52Å; A490-P530 HydrophobicContact CB-CB 4.37Å; A490-P530 HydrophobicContact CB-CG 3.94Å
491	S	96.2	Very high	96.3	Very high	2 Å²	2	13.7 Å²	13.7	1%	0.014	7%	0.068	C	C	.	.	H	α-helix	trans	-61.8	-34.6	176.9	79.7	0	0	0	0	112.8	F487 S488 Q489 W495	F487-S491 WeakPolarHBondContact O-CB 3.42Å; F487-S491 PolarHBondContact O-N 3.13Å; S488-S491 WeakPolarHBondContact O-CB 3.33Å; S488-S491 PolarHBondContact O-N 2.93Å; S488-S491 VanDerWaalsContact O-N 3.15Å; S488-S491 PolarHBondContact O-OG 3.49Å; Q489-S491 VanDerWaalsContact C-N 3.32Å; Q489-S491 PolarHBondContact O-N 2.71Å; S491-W495 PolarHBondContact O-N 3.39Å
492	Y	96.8	Very high	96.1	Very high	7 Å²	7	13.7 Å²	13.7	3%	0.027	7%	0.068	C	C	.	.	H	α-helix	trans	-63.5	-47.6	175.1	-88.6	-98	0	0	0	111.3	S488 Q489 A490 W495 V496 Q570 Y573 K673 I677	S488-Y492 WeakPolarHBondContact O-CD2 3.48Å; S488-Y492 PolarHBondContact O-N 2.91Å; Q489-Y492 WeakPolarHBondContact O-CB 3.45Å; Q489-Y492 PolarHBondContact O-N 3.4Å; A490-Y492 VanDerWaalsContact C-N 3.27Å; A490-Y492 PolarHBondContact O-N 3.27Å; Y492-W495 WeakPolarHBondContact O-CB 3.32Å; Y492-W495 PolarHBondContact O-N 3.01Å; Y492-V496 PolarHBondContact O-N 3.3Å; Y492-Q570 HydrophobicContact CD1-CG 4.36Å; Y492-Q570 HydrophobicContact CE1-CB 4.16Å; Y492-Q570 HydrophobicContact CE1-CG 4Å; Y492-Q570 HydrophobicContact CE2-CG 4.28Å; Y492-Y573 HydrophobicContact CD1-CD2 4.37Å; Y492-Y573 HydrophobicContact CG-CD2 4.29Å; Y492-K673 HydrophobicContact CD1-CD 4.25Å; Y492-K673 HydrophobicContact CE1-CB 4.15Å; Y492-K673 HydrophobicContact CE1-CD 4.07Å; Y492-K673 HydrophobicContact CE1-CG 3.98Å; Y492-K673 PolarHBondContact O-NZ 3.24Å; Y492-I677 HydrophobicContact CE1-CD1 4.49Å
493	L	97.1	Very high	95.8	Very high	11 Å²	11	12.5 Å²	12.5	6%	0.058	6%	0.06	C	C	.	.	H	α-helix	trans	-68.5	-39.1	179.4	-73.3	167.6	0	0	0	112.6	Q489 A490 W495 V496 M497 A526 V529 P530 Y573	Q489-L493 PolarHBondContact O-N 3.01Å; A490-L493 PolarHBondContact O-N 3.29Å; L493-W495 PolarHBondContact O-N 3.22Å; L493-V496 CarbonylContact O-C 3.57Å; L493-V496 WeakPolarHBondContact O-CA 3.31Å; L493-V496 WeakPolarHBondContact O-CB 3.27Å; L493-V496 PolarHBondContact O-N 2.98Å; L493-M497 WeakPolarHBondContact O-CG 3.26Å; L493-M497 PolarHBondContact O-N 3.45Å; L493-A526 HydrophobicContact CB-CB 4.41Å; L493-V529 HydrophobicContact CD1-CB 3.69Å; L493-V529 HydrophobicContact CD1-CG1 3.85Å; L493-P530 HydrophobicContact CD1-CG 3.55Å; L493-Y573 HydrophobicContact CD2-CD1 3.85Å; L493-Y573 HydrophobicContact CD2-CE1 3.54Å; L493-Y573 HydrophobicContact CD2-CE2 4.38Å; L493-Y573 HydrophobicContact CD2-CG 4.41Å; L493-Y573 HydrophobicContact CG-CE1 4.28Å; L493-Y573 HydrophobicContact CG-CE2 4.25Å
494	W	96.8	Very high	95.6	Very high	1 Å²	1	11.3 Å²	11.3	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-61.7	-32.4	176.1	-85.1	114.8	0	0	0	113.1	P401 Y404 I405 C408 A490 M497 L498 H523 A526 W527	P401-W494 HydrophobicContact CB-CE3 4.19Å; Y404-W494 VanDerWaalsContact CB-CD2 3.47Å; Y404-W494 HydrophobicContact CD1-CZ2 4.44Å; Y404-W494 HydrophobicContact CD2-CD2 4.31Å; Y404-W494 AromaticContact CD2-CE3 3.86Å; Y404-W494 HydrophobicContact CD2-CE3 3.86Å; Y404-W494 AromaticContact CD2-CH2 3.47Å; Y404-W494 HydrophobicContact CD2-CH2 3.47Å; Y404-W494 VanDerWaalsContact CD2-CH2 3.47Å; Y404-W494 AromaticContact CD2-CZ2 3.93Å; Y404-W494 HydrophobicContact CD2-CZ2 3.93Å; Y404-W494 AromaticContact CD2-CZ3 3.42Å; Y404-W494 HydrophobicContact CD2-CZ3 3.42Å; Y404-W494 VanDerWaalsContact CD2-CZ3 3.42Å; Y404-W494 AromaticContact CE2-CH2 3.98Å; Y404-W494 HydrophobicContact CE2-CH2 3.98Å; Y404-W494 HydrophobicContact CE2-CZ3 4.14Å; Y404-W494 HydrophobicContact CG-CD2 4.18Å; Y404-W494 AromaticContact CG-CE2 3.99Å; Y404-W494 HydrophobicContact CG-CE3 4.19Å; Y404-W494 AromaticContact CG-CH2 3.9Å; Y404-W494 HydrophobicContact CG-CH2 3.9Å; Y404-W494 AromaticContact CG-CZ2 3.86Å; Y404-W494 HydrophobicContact CG-CZ2 3.86Å; Y404-W494 HydrophobicContact CG-CZ3 4.07Å; I405-W494 HydrophobicContact CG1-CB 3.68Å; C408-W494 VanDerWaalsContact SG-CD1 3.57Å; A490-W494 VanDerWaalsContact O-CD1 3.23Å; A490-W494 PolarHBondContact O-N 3.44Å; W494-M497 HydrophobicContact CE3-CB 4.03Å; W494-M497 HydrophobicContact CE3-CG 4.26Å; W494-M497 HydrophobicContact CZ3-CB 4.32Å; W494-M497 HydrophobicContact CZ3-CG 4.47Å; W494-M497 PolarHBondContact O-N 3.3Å; W494-L498 PolarHBondContact O-N 3Å; W494-H523 AromaticContact CH2-CD2 3.94Å; W494-H523 AromaticContact CH2-CE1 3.45Å; W494-H523 VanDerWaalsContact CH2-CE1 3.45Å; W494-H523 WeakPolarHBondContact CH2-CE1 3.5Å; W494-H523 AromaticContact CH2-CG 3.78Å; W494-H523 AromaticContact CH2-ND1 3.47Å; W494-H523 WeakPolarHBondContact CH2-ND1 3.26Å; W494-H523 AromaticContact CH2-NE2 3.75Å; W494-H523 AromaticContact CZ2-CE1 3.87Å; W494-H523 AromaticContact CZ2-ND1 3.65Å; W494-A526 HydrophobicContact CD2-CB 3.89Å; W494-A526 HydrophobicContact CE3-CB 4.35Å; W494-A526 HydrophobicContact CG-CB 4.33Å; W494-A526 HydrophobicContact CH2-CB 4.21Å; W494-A526 HydrophobicContact CZ2-CB 3.75Å; W494-A526 HydrophobicContact CZ3-CB 4.49Å; W494-W527 AromaticContact CE2-CE2 3.88Å; W494-W527 AromaticContact CE2-CZ2 3.78Å; W494-W527 AromaticContact CZ2-CE2 3.72Å; W494-W527 AromaticContact CZ2-CZ2 3.92Å; W494-W527 HydrophobicContact CZ2-CZ2 3.92Å; W494-W527 AromaticContact CZ2-NE1 3.55Å; W494-W527 AromaticContact NE1-CD2 3.86Å; W494-W527 AromaticContact NE1-CE2 3.43Å; W494-W527 AromaticContact NE1-CE3 3.98Å; W494-W527 AromaticContact NE1-CH2 3.32Å; W494-W527 VanDerWaalsContact NE1-CH2 3.32Å; W494-W527 AromaticContact NE1-CZ2 3.15Å; W494-W527 AromaticContact NE1-CZ3 3.75Å
495	W	96.1	Very high	95.2	Very high	1 Å²	1	12 Å²	12	0%	0.004	6%	0.06	C	C	.	.	H	α-helix	trans	-70.6	-36	169.6	173.3	78.6	0	0	0	113.1	I405 S491 Y492 L493 M497 L498 A499 Y573 L574 I578 L581 S666 Y669 V670 K673	I405-W495 HydrophobicContact CD1-CB 4.16Å; S491-W495 PolarHBondContact O-N 3.39Å; Y492-W495 WeakPolarHBondContact O-CB 3.32Å; Y492-W495 PolarHBondContact O-N 3.01Å; L493-W495 PolarHBondContact O-N 3.22Å; W495-M497 VanDerWaalsContact C-N 3.3Å; W495-L498 WeakPolarHBondContact O-CB 3.38Å; W495-L498 PolarHBondContact O-N 3.32Å; W495-A499 PolarHBondContact O-N 3.48Å; W495-Y573 WeakPolarHBondContact CZ3-O 3.19Å; W495-L574 HydrophobicContact CH2-CD1 4.04Å; W495-L574 HydrophobicContact CZ3-CD1 4.39Å; W495-I578 HydrophobicContact CH2-CG1 4.45Å; W495-L581 HydrophobicContact CH2-CD1 4.48Å; W495-L581 HydrophobicContact CZ2-CD1 3.74Å; W495-S666 PolarHBondContact NE1-O 2.92Å; W495-S666 VanDerWaalsContact NE1-O 3.1Å; W495-S666 PolarHBondContact NE1-OG 3.22Å; W495-Y669 AromaticContact CD1-CD2 3.79Å; W495-V670 HydrophobicContact CH2-CG2 4.32Å; W495-V670 HydrophobicContact CZ2-CG2 3.74Å; W495-K673 HydrophobicContact CD2-CD 4.06Å; W495-K673 HydrophobicContact CE3-CD 4.14Å; W495-K673 HydrophobicContact CG-CD 4.43Å; W495-K673 HydrophobicContact CZ3-CD 4.49Å
496	V	96.3	Very high	94.6	Very high	7 Å²	7	12.4 Å²	12.4	4%	0.042	6%	0.063	C	C	.	.	H	α-helix	trans	-62.5	-41.5	170.2	178	0	0	0	0	110.1	Y492 L493 L498 A499 I500 Y573 L576	Y492-V496 PolarHBondContact O-N 3.3Å; L493-V496 CarbonylContact O-C 3.57Å; L493-V496 WeakPolarHBondContact O-CA 3.31Å; L493-V496 WeakPolarHBondContact O-CB 3.27Å; L493-V496 PolarHBondContact O-N 2.98Å; V496-L498 VanDerWaalsContact C-N 3.3Å; V496-L498 PolarHBondContact O-N 3.3Å; V496-A499 WeakPolarHBondContact O-CB 3.49Å; V496-A499 PolarHBondContact O-N 3.39Å; V496-A499 VanDerWaalsContact O-N 3.14Å; V496-I500 HydrophobicContact CG1-CD1 3.89Å; V496-I500 HydrophobicContact CG1-CG1 4.37Å; V496-I500 WeakPolarHBondContact O-CG1 3.4Å; V496-I500 PolarHBondContact O-N 3.03Å; V496-Y573 WeakPolarHBondContact CG2-O 3.19Å; V496-L576 HydrophobicContact CG1-CB 4.48Å
497	M	95.1	Very high	94	Very high	9 Å²	9	11.6 Å²	11.6	4%	0.044	7%	0.065	C	C	.	.	H	α-helix	trans	-63.3	-35.4	174.6	-61.3	-51.6	136.4	0	0	112.2	L493 W494 W495 I500 S501 L522 L525 A526	L493-M497 WeakPolarHBondContact O-CG 3.26Å; L493-M497 PolarHBondContact O-N 3.45Å; W494-M497 HydrophobicContact CE3-CB 4.03Å; W494-M497 HydrophobicContact CE3-CG 4.26Å; W494-M497 HydrophobicContact CZ3-CB 4.32Å; W494-M497 HydrophobicContact CZ3-CG 4.47Å; W494-M497 PolarHBondContact O-N 3.3Å; W495-M497 VanDerWaalsContact C-N 3.3Å; M497-I500 HydrophobicContact CE-CD1 4.47Å; M497-I500 HydrophobicContact SD-CD1 4.27Å; M497-S501 VanDerWaalsContact O-CB 3.26Å; M497-S501 WeakPolarHBondContact O-CB 3.49Å; M497-S501 PolarHBondContact O-N 3.47Å; M497-S501 PolarHBondContact O-OG 3.44Å; M497-L522 HydrophobicContact CG-CB 4.49Å; M497-L522 HydrophobicContact SD-CB 4.11Å; M497-L522 HydrophobicContact SD-CD2 3.56Å; M497-L522 VanDerWaalsContact SD-CD2 3.56Å; M497-L522 HydrophobicContact SD-CG 4.41Å; M497-L525 HydrophobicContact CE-CB 4.25Å; M497-A526 HydrophobicContact CG-CB 4.11Å
498	L	93.7	Very high	93.3	Very high	2 Å²	2	12.6 Å²	12.6	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-62.5	-46.7	171	179	62.9	0	0	0	111.1	P398 P401 I402 I405 W494 W495 V496 S501 W502 I662	P398-L498 WeakPolarHBondContact O-CD1 3.12Å; P401-L498 HydrophobicContact CB-CB 3.9Å; P401-L498 HydrophobicContact CB-CD1 4.18Å; P401-L498 HydrophobicContact CG-CD1 4.48Å; I402-L498 HydrophobicContact CD1-CD1 4.47Å; I402-L498 HydrophobicContact CG1-CD1 4.01Å; I402-L498 HydrophobicContact CG1-CD2 3.99Å; I405-L498 HydrophobicContact CD1-CD2 4.32Å; W494-L498 PolarHBondContact O-N 3Å; W495-L498 WeakPolarHBondContact O-CB 3.38Å; W495-L498 PolarHBondContact O-N 3.32Å; V496-L498 VanDerWaalsContact C-N 3.3Å; V496-L498 PolarHBondContact O-N 3.3Å; L498-S501 PolarHBondContact O-N 3.32Å; L498-W502 VanDerWaalsContact O-CB 3.26Å; L498-W502 WeakPolarHBondContact O-CB 3.32Å; L498-W502 PolarHBondContact O-N 2.9Å; L498-I662 HydrophobicContact CD1-CG2 3.98Å
499	A	94.3	Very high	92.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.8	-44	177.3	0	0	0	0	0	112.1	W495 V496 W502 F503 F580 L581	W495-A499 PolarHBondContact O-N 3.48Å; V496-A499 WeakPolarHBondContact O-CB 3.49Å; V496-A499 PolarHBondContact O-N 3.39Å; V496-A499 VanDerWaalsContact O-N 3.14Å; A499-W502 PolarHBondContact O-N 3.39Å; A499-F503 VanDerWaalsContact O-CB 3.3Å; A499-F503 WeakPolarHBondContact O-CB 3.49Å; A499-F503 PolarHBondContact O-N 3.49Å; A499-F580 HydrophobicContact CB-CB 4.16Å; A499-L581 HydrophobicContact CB-CD1 4.47Å; A499-L581 HydrophobicContact CB-CD2 4.29Å; A499-L581 HydrophobicContact CB-CG 3.88Å
500	I	93.5	Very high	92.1	Very high	34 Å²	34	22.8 Å²	22.8	17%	0.174	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-49.9	175.7	-69.2	168.4	0	0	0	110.7	V496 M497 W502 F503 L504 F580	V496-I500 HydrophobicContact CG1-CD1 3.89Å; V496-I500 HydrophobicContact CG1-CG1 4.37Å; V496-I500 WeakPolarHBondContact O-CG1 3.4Å; V496-I500 PolarHBondContact O-N 3.03Å; M497-I500 HydrophobicContact CE-CD1 4.47Å; M497-I500 HydrophobicContact SD-CD1 4.27Å; I500-W502 VanDerWaalsContact C-N 3.26Å; I500-W502 PolarHBondContact O-N 3.12Å; I500-F503 PolarHBondContact O-N 3.29Å; I500-L504 HydrophobicContact CG2-CD1 3.85Å; I500-L504 HydrophobicContact CG2-CG 4.26Å; I500-L504 VanDerWaalsContact O-CG 3.32Å; I500-L504 WeakPolarHBondContact O-CG 3.23Å; I500-L504 PolarHBondContact O-N 3.46Å; I500-F580 HydrophobicContact CD1-CD2 4.36Å; I500-F580 HydrophobicContact CD1-CE2 3.98Å; I500-F580 HydrophobicContact CD1-CZ 4.45Å; I500-F580 HydrophobicContact CG1-CD1 4.42Å; I500-F580 HydrophobicContact CG1-CD2 3.58Å; I500-F580 HydrophobicContact CG1-CE1 4.42Å; I500-F580 HydrophobicContact CG1-CE2 3.6Å; I500-F580 HydrophobicContact CG1-CG 4.03Å; I500-F580 HydrophobicContact CG1-CZ 4.04Å
501	S	92.5	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.1	-43.2	179.4	-60.1	0	0	0	0	110.8	M497 L498 S505 I515	M497-S501 VanDerWaalsContact O-CB 3.26Å; M497-S501 WeakPolarHBondContact O-CB 3.49Å; M497-S501 PolarHBondContact O-N 3.47Å; M497-S501 PolarHBondContact O-OG 3.44Å; L498-S501 PolarHBondContact O-N 3.32Å; S501-S505 PolarHBondContact O-N 2.97Å; S501-S505 PolarHBondContact O-OG 3.28Å; S501-I515 VanDerWaalsContact O-CD1 3.3Å; S501-I515 WeakPolarHBondContact O-CD1 3.36Å
502	W	92.4	Very high	90.7	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-66.2	-44.4	176.7	179.6	84.1	0	0	0	112.4	L498 A499 I500 L504 S505 A506 L581 G584 F585 L588 M659 A663	L498-W502 VanDerWaalsContact O-CB 3.26Å; L498-W502 WeakPolarHBondContact O-CB 3.32Å; L498-W502 PolarHBondContact O-N 2.9Å; A499-W502 PolarHBondContact O-N 3.39Å; I500-W502 VanDerWaalsContact C-N 3.26Å; I500-W502 PolarHBondContact O-N 3.12Å; W502-L504 PolarHBondContact O-N 3.18Å; W502-S505 PolarHBondContact O-N 2.96Å; W502-A506 WeakPolarHBondContact O-CB 3.49Å; W502-A506 PolarHBondContact O-N 2.96Å; W502-L581 HydrophobicContact CD2-CD2 4.38Å; W502-L581 HydrophobicContact CE3-CD2 3.84Å; W502-L581 HydrophobicContact CZ3-CD2 4.05Å; W502-L581 WeakPolarHBondContact CZ3-O 3.26Å; W502-G584 VanDerWaalsContact CZ3-C 3.46Å; W502-F585 HydrophobicContact CH2-CB 3.97Å; W502-L588 HydrophobicContact CH2-CD1 4.06Å; W502-L588 HydrophobicContact CZ2-CD1 3.41Å; W502-L588 VanDerWaalsContact CZ2-CD1 3.41Å; W502-M659 HydrophobicContact CG-CE 4.3Å; W502-M659 PolarHBondContact NE1-O 3.4Å; W502-A663 VanDerWaalsContact CE2-CB 3.47Å; W502-A663 HydrophobicContact CH2-CB 4.16Å; W502-A663 HydrophobicContact CZ2-CB 3.27Å
503	F	91.9	Very high	90.3	Very high	37 Å²	37	35.9 Å²	35.9	16%	0.162	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-45.7	175.5	161.6	-102.3	0	0	0	112	A499 I500 A506 S507 F580 V583	A499-F503 VanDerWaalsContact O-CB 3.3Å; A499-F503 WeakPolarHBondContact O-CB 3.49Å; A499-F503 PolarHBondContact O-N 3.49Å; I500-F503 PolarHBondContact O-N 3.29Å; F503-A506 PolarHBondContact O-N 3.39Å; F503-S507 VanDerWaalsContact CD2-OG 3.24Å; F503-S507 WeakPolarHBondContact CD2-OG 3.21Å; F503-S507 VanDerWaalsContact CE2-CB 3.46Å; F503-S507 WeakPolarHBondContact CE2-OG 3.26Å; F503-S507 WeakPolarHBondContact O-CB 3.41Å; F503-S507 PolarHBondContact O-N 2.92Å; F503-S507 PolarHBondContact O-OG 3.42Å; F503-F580 HydrophobicContact CB-CB 4.13Å; F503-F580 HydrophobicContact CB-CD1 4.25Å; F503-F580 AromaticContact CD1-CD1 3.73Å; F503-F580 HydrophobicContact CD1-CD1 3.73Å; F503-F580 HydrophobicContact CD1-CE1 4.17Å; F503-F580 HydrophobicContact CE1-CD1 4.25Å; F503-F580 HydrophobicContact CE1-CE1 4.36Å; F503-F580 AromaticContact CG-CD1 3.9Å; F503-F580 HydrophobicContact CG-CD1 3.9Å; F503-V583 HydrophobicContact CD2-CB 4.23Å; F503-V583 HydrophobicContact CD2-CG1 4.02Å; F503-V583 HydrophobicContact CE2-CB 4.14Å; F503-V583 HydrophobicContact CE2-CG1 3.48Å; F503-V583 VanDerWaalsContact CE2-CG1 3.48Å; F503-V583 HydrophobicContact CZ-CG1 4.43Å
504	L	91.3	Very high	89.9	Confident	9 Å²	9	36.7 Å²	36.7	5%	0.047	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-42.1	178.4	-69.1	173.5	0	0	0	111.4	I500 W502 C508 K509 W510 I515 I518	I500-L504 HydrophobicContact CG2-CD1 3.85Å; I500-L504 HydrophobicContact CG2-CG 4.26Å; I500-L504 VanDerWaalsContact O-CG 3.32Å; I500-L504 WeakPolarHBondContact O-CG 3.23Å; I500-L504 PolarHBondContact O-N 3.46Å; W502-L504 PolarHBondContact O-N 3.18Å; L504-C508 HydrophobicContact CD2-CB 4.45Å; L504-C508 CarbonylContact O-C 3.31Å; L504-C508 WeakPolarHBondContact O-CA 3.39Å; L504-C508 VanDerWaalsContact O-CB 3.28Å; L504-C508 WeakPolarHBondContact O-CB 3.39Å; L504-C508 PolarHBondContact O-N 2.84Å; L504-C508 VanDerWaalsContact O-N 3.16Å; L504-K509 PolarHBondContact O-N 3.49Å; L504-W510 HydrophobicContact CB-CB 4.28Å; L504-W510 HydrophobicContact CB-CD2 4.26Å; L504-W510 HydrophobicContact CB-CE3 4.35Å; L504-W510 HydrophobicContact CB-CG 4.25Å; L504-W510 HydrophobicContact CD1-CE3 4.02Å; L504-W510 HydrophobicContact CD1-CZ3 4.11Å; L504-W510 HydrophobicContact CD2-CD2 4.38Å; L504-W510 PolarHBondContact O-N 2.98Å; L504-I515 HydrophobicContact CB-CD1 4.41Å; L504-I518 HydrophobicContact CD1-CD1 3.77Å
505	S	89	Confident	89.6	Confident	23 Å²	23	36.7 Å²	36.7	16%	0.161	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-40.6	174.2	-73.4	0	0	0	0	112.8	S501 W502 K509 W510 I515 M659	S501-S505 PolarHBondContact O-N 2.97Å; S501-S505 PolarHBondContact O-OG 3.28Å; W502-S505 PolarHBondContact O-N 2.96Å; S505-K509 WeakPolarHBondContact O-CA 3.22Å; S505-W510 WeakPolarHBondContact CA-O 3.43Å; S505-W510 PolarHBondContact OG-O 3.36Å; S505-I515 WeakPolarHBondContact OG-CD1 3.01Å; S505-M659 VanDerWaalsContact CB-CE 3.43Å
506	A	85.8	Confident	89.3	Confident	10 Å²	10	40.3 Å²	40.3	8%	0.083	22%	0.224	C	C	.	.	H	α-helix	trans	-78.4	-51	-175	0	0	0	0	0	113.7	W502 F503 L588 M659	W502-A506 WeakPolarHBondContact O-CB 3.49Å; W502-A506 PolarHBondContact O-N 2.96Å; F503-A506 PolarHBondContact O-N 3.39Å; A506-L588 HydrophobicContact CB-CD1 3.96Å; A506-L588 HydrophobicContact CB-CD2 3.97Å; A506-L588 HydrophobicContact CB-CG 3.83Å; A506-M659 HydrophobicContact CB-CE 4.05Å
507	S	84.6	Confident	89.1	Confident	34 Å²	34	43.8 Å²	43.8	24%	0.238	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-44.7	-174.2	-53.5	0	0	0	0	112.1	F503 K509 G584 S587	F503-S507 VanDerWaalsContact CD2-OG 3.24Å; F503-S507 WeakPolarHBondContact CD2-OG 3.21Å; F503-S507 VanDerWaalsContact CE2-CB 3.46Å; F503-S507 WeakPolarHBondContact CE2-OG 3.26Å; F503-S507 WeakPolarHBondContact O-CB 3.41Å; F503-S507 PolarHBondContact O-N 2.92Å; F503-S507 PolarHBondContact O-OG 3.42Å; S507-K509 VanDerWaalsContact C-N 3.34Å; S507-G584 WeakPolarHBondContact OG-CA 3.26Å; S507-S587 WeakPolarHBondContact CB-OG 3.48Å; S507-S587 WeakPolarHBondContact OG-CB 3.44Å; S507-S587 PolarHBondContact OG-OG 3.31Å
508	C	84.3	Confident	89	Confident	56 Å²	56	45 Å²	45	38%	0.378	26%	0.26	S	S	.	.	S	Bend	trans	-89.7	-2.6	-175.4	-54.3	0	0	0	0	112.7	L504 W510	L504-C508 HydrophobicContact CD2-CB 4.45Å; L504-C508 CarbonylContact O-C 3.31Å; L504-C508 WeakPolarHBondContact O-CA 3.39Å; L504-C508 VanDerWaalsContact O-CB 3.28Å; L504-C508 WeakPolarHBondContact O-CB 3.39Å; L504-C508 PolarHBondContact O-N 2.84Å; L504-C508 VanDerWaalsContact O-N 3.16Å; C508-W510 HydrophobicContact CB-CG 4.2Å; C508-W510 PolarHBondContact O-N 3.17Å
509	K	83.2	Confident	88.8	Confident	161 Å²	161	46 Å²	46	70%	0.7	27%	0.267	S	S	*	.			trans	55.3	31.3	-175.9	-56	179.4	-179.6	175.3	0	112.8	L504 S505 S507 G511	L504-K509 PolarHBondContact O-N 3.49Å; S505-K509 WeakPolarHBondContact O-CA 3.22Å; S507-K509 VanDerWaalsContact C-N 3.34Å; K509-G511 PolarHBondContact O-N 3.16Å
510	W	85.2	Confident	88.8	Confident	74 Å²	74	49.9 Å²	49.9	28%	0.28	29%	0.294	S	S	.	.			trans	-69.8	124.2	177	-75.7	25.4	0	0	0	110	L504 S505 C508 G514 I515 I518	L504-W510 HydrophobicContact CB-CB 4.28Å; L504-W510 HydrophobicContact CB-CD2 4.26Å; L504-W510 HydrophobicContact CB-CE3 4.35Å; L504-W510 HydrophobicContact CB-CG 4.25Å; L504-W510 HydrophobicContact CD1-CE3 4.02Å; L504-W510 HydrophobicContact CD1-CZ3 4.11Å; L504-W510 HydrophobicContact CD2-CD2 4.38Å; L504-W510 PolarHBondContact O-N 2.98Å; S505-W510 WeakPolarHBondContact CA-O 3.43Å; S505-W510 PolarHBondContact OG-O 3.36Å; C508-W510 HydrophobicContact CB-CG 4.2Å; C508-W510 PolarHBondContact O-N 3.17Å; W510-G514 WeakPolarHBondContact CZ3-O 3.26Å; W510-I515 HydrophobicContact CB-CG1 4.17Å; W510-I515 HydrophobicContact CE3-CG1 4.08Å; W510-I518 HydrophobicContact CH2-CG2 4.32Å; W510-I518 HydrophobicContact CZ3-CD1 3.74Å; W510-I518 HydrophobicContact CZ3-CG1 4.09Å; W510-I518 HydrophobicContact CZ3-CG2 4.03Å
511	G	81.1	Confident	88.9	Confident	46 Å²	46	51.6 Å²	51.6	47%	0.474	30%	0.303	S	S	.	.			trans	-71.3	172.1	169.1	0	0	0	0	0	112	K509 E513 G514 I515	K509-G511 PolarHBondContact O-N 3.16Å; G511-E513 PolarHBondContact O-N 3.32Å; G511-G514 PolarHBondContact O-N 2.73Å; G511-I515 PolarHBondContact O-N 3.2Å
512	C	84	Confident	88.9	Confident	65 Å²	65	52.1 Å²	52.1	44%	0.439	31%	0.305	S	S	.	.	H	α-helix	trans	-55.1	-40.7	-179.9	-49.9	0	0	0	0	112	Y397 G514 I515 E516	Y397-C512 PolarHBondContact O-SG 3.38Å; C512-G514 VanDerWaalsContact C-N 3.33Å; C512-G514 PolarHBondContact O-N 3.1Å; C512-I515 PolarHBondContact O-N 3.05Å; C512-E516 WeakPolarHBondContact O-CB 3.31Å; C512-E516 PolarHBondContact O-N 3.05Å
513	E	88.7	Confident	89	Confident	174 Å²	174	54.1 Å²	54.1	81%	0.813	31%	0.314	S	S	*	.	H	α-helix	trans	-62.2	-37.5	177.9	-62.9	176.9	-179.1	0	0	112.9	G511 E516 A517	G511-E513 PolarHBondContact O-N 3.32Å; E513-E516 PolarHBondContact O-N 2.99Å; E513-A517 WeakPolarHBondContact O-CB 3.03Å; E513-A517 PolarHBondContact O-N 2.69Å
514	G	88.3	Confident	89.2	Confident	28 Å²	28	57.8 Å²	57.8	29%	0.289	33%	0.333	S	S	.	.	H	α-helix	trans	-66.4	-39.1	179.1	0	0	0	0	0	112.1	W510 G511 C512	W510-G514 WeakPolarHBondContact CZ3-O 3.26Å; G511-G514 PolarHBondContact O-N 2.73Å; C512-G514 VanDerWaalsContact C-N 3.33Å; C512-G514 PolarHBondContact O-N 3.1Å
515	I	90	Very high	89.4	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-76.3	-39.2	176.5	-58.7	175.9	0	0	0	110.7	Y397 P398 S501 L504 S505 W510 G511 C512 A517 I518 S519 L522	Y397-I515 HydrophobicContact CD1-CB 4.49Å; Y397-I515 HydrophobicContact CD1-CG2 3.44Å; Y397-I515 VanDerWaalsContact CD1-CG2 3.44Å; Y397-I515 HydrophobicContact CD2-CG2 4.26Å; Y397-I515 HydrophobicContact CE1-CG2 4.08Å; Y397-I515 HydrophobicContact CG-CB 4.16Å; Y397-I515 HydrophobicContact CG-CG2 3.56Å; P398-I515 HydrophobicContact CB-CD1 4.33Å; S501-I515 VanDerWaalsContact O-CD1 3.3Å; S501-I515 WeakPolarHBondContact O-CD1 3.36Å; L504-I515 HydrophobicContact CB-CD1 4.41Å; S505-I515 WeakPolarHBondContact OG-CD1 3.01Å; W510-I515 HydrophobicContact CB-CG1 4.17Å; W510-I515 HydrophobicContact CE3-CG1 4.08Å; G511-I515 PolarHBondContact O-N 3.2Å; C512-I515 PolarHBondContact O-N 3.05Å; I515-A517 PolarHBondContact O-N 3.4Å; I515-I518 WeakPolarHBondContact O-CG1 3.44Å; I515-I518 PolarHBondContact O-N 2.97Å; I515-S519 PolarHBondContact O-N 3.48Å; I515-S519 VanDerWaalsContact O-N 3.12Å; I515-L522 HydrophobicContact CG2-CD1 4.14Å
516	E	90.7	Very high	89.8	Confident	77 Å²	77	59.8 Å²	59.8	36%	0.36	34%	0.342	S	S	.	.	H	α-helix	trans	-59.4	-35.6	175.7	-167.8	74.6	-150.9	0	0	111	Y397 R400 C512 E513 I518 S519	Y397-E516 HydrophobicContact CD2-CB 4.38Å; Y397-E516 WeakPolarHBondContact CD2-OE2 3.38Å; Y397-E516 WeakPolarHBondContact CE2-OE2 3.29Å; R400-E516 IonicContact CZ-OE1 3.59Å; R400-E516 VanDerWaalsContact NH1-CD 3.29Å; R400-E516 IonicContact NH1-OE1 3.18Å; R400-E516 PolarHBondContact NH1-OE1 3.3Å; R400-E516 IonicContact NH1-OE2 3.93Å; R400-E516 PolarHBondContact NH1-OE2 3.41Å; C512-E516 WeakPolarHBondContact O-CB 3.31Å; C512-E516 PolarHBondContact O-N 3.05Å; E513-E516 PolarHBondContact O-N 2.99Å; E516-I518 VanDerWaalsContact C-N 3.25Å; E516-I518 PolarHBondContact O-N 3.3Å; E516-S519 WeakPolarHBondContact O-CB 3.34Å; E516-S519 PolarHBondContact O-N 3.46Å; E516-S519 VanDerWaalsContact O-N 3.09Å; E516-S519 PolarHBondContact O-OG 2.86Å
517	A	91.7	Very high	90.3	Very high	80 Å²	80	62.2 Å²	62.2	66%	0.661	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-25.1	176.4	0	0	0	0	0	114.4	E513 I515	E513-A517 WeakPolarHBondContact O-CB 3.03Å; E513-A517 PolarHBondContact O-N 2.69Å; I515-A517 PolarHBondContact O-N 3.4Å
518	I	92.2	Very high	90.9	Very high	36 Å²	36	62.7 Å²	62.7	19%	0.185	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	2.5	175	63.7	161.2	0	0	0	112.9	L504 W510 I515 E516 S520 I521 L522	L504-I518 HydrophobicContact CD1-CD1 3.77Å; W510-I518 HydrophobicContact CH2-CG2 4.32Å; W510-I518 HydrophobicContact CZ3-CD1 3.74Å; W510-I518 HydrophobicContact CZ3-CG1 4.09Å; W510-I518 HydrophobicContact CZ3-CG2 4.03Å; I515-I518 WeakPolarHBondContact O-CG1 3.44Å; I515-I518 PolarHBondContact O-N 2.97Å; E516-I518 VanDerWaalsContact C-N 3.25Å; E516-I518 PolarHBondContact O-N 3.3Å; I518-S520 PolarHBondContact O-N 3.39Å; I518-I521 WeakPolarHBondContact O-CB 3.3Å; I518-I521 PolarHBondContact O-N 3.47Å; I518-L522 HydrophobicContact CD1-CD1 4.24Å; I518-L522 HydrophobicContact CD1-CD2 4.33Å; I518-L522 HydrophobicContact CD1-CG 4.34Å; I518-L522 HydrophobicContact CG1-CD1 4.28Å; I518-L522 HydrophobicContact CG1-CG 4.44Å; I518-L522 PolarHBondContact O-N 3.36Å
519	S	91	Very high	91.5	Very high	22 Å²	22	62.7 Å²	62.7	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-56.9	-37	-173.7	63.3	0	0	0	0	112.8	I515 E516 I521 L522 H523	I515-S519 PolarHBondContact O-N 3.48Å; I515-S519 VanDerWaalsContact O-N 3.12Å; E516-S519 WeakPolarHBondContact O-CB 3.34Å; E516-S519 PolarHBondContact O-N 3.46Å; E516-S519 VanDerWaalsContact O-N 3.09Å; E516-S519 PolarHBondContact O-OG 2.86Å; S519-I521 VanDerWaalsContact C-N 3.28Å; S519-I521 PolarHBondContact O-N 3.38Å; S519-L522 PolarHBondContact O-N 3.34Å; S519-L522 VanDerWaalsContact O-N 3.16Å; S519-H523 WeakPolarHBondContact O-CB 3.21Å; S519-H523 PolarHBondContact O-CD2 3.12Å; S519-H523 VanDerWaalsContact O-CD2 3.23Å; S519-H523 PolarHBondContact O-N 3.34Å
520	S	93.5	Very high	92.2	Very high	82 Å²	82	55 Å²	55	57%	0.573	32%	0.32	S	S	*	.	H	α-helix	trans	-57.2	-39.9	176.6	57.2	0	0	0	0	112.5	I518 M524	I518-S520 PolarHBondContact O-N 3.39Å; S520-M524 VanDerWaalsContact O-CB 3.29Å; S520-M524 WeakPolarHBondContact O-CB 3.48Å; S520-M524 PolarHBondContact O-N 3.35Å
521	I	94.8	Very high	92.8	Very high	70 Å²	70	53 Å²	53	36%	0.359	32%	0.319	S	S	.	.	H	α-helix	trans	-70.1	-44.9	177	-59.7	173.2	0	0	0	110.2	I518 S519 H523 M524 L525	I518-I521 WeakPolarHBondContact O-CB 3.3Å; I518-I521 PolarHBondContact O-N 3.47Å; S519-I521 VanDerWaalsContact C-N 3.28Å; S519-I521 PolarHBondContact O-N 3.38Å; I521-H523 VanDerWaalsContact C-N 3.32Å; I521-H523 PolarHBondContact O-N 2.91Å; I521-M524 PolarHBondContact O-N 2.97Å; I521-L525 HydrophobicContact CG2-CD1 4.05Å; I521-L525 HydrophobicContact CG2-CG 4.41Å; I521-L525 WeakPolarHBondContact O-CG 3.4Å; I521-L525 PolarHBondContact O-N 3.4Å
522	L	93.3	Very high	93.6	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-45.1	178.2	-59.5	177.9	0	0	0	111.2	Y397 M497 I515 I518 S519 A526	Y397-L522 HydrophobicContact CE1-CD1 4.28Å; M497-L522 HydrophobicContact CG-CB 4.49Å; M497-L522 HydrophobicContact SD-CB 4.11Å; M497-L522 HydrophobicContact SD-CD2 3.56Å; M497-L522 VanDerWaalsContact SD-CD2 3.56Å; M497-L522 HydrophobicContact SD-CG 4.41Å; I515-L522 HydrophobicContact CG2-CD1 4.14Å; I518-L522 HydrophobicContact CD1-CD1 4.24Å; I518-L522 HydrophobicContact CD1-CD2 4.33Å; I518-L522 HydrophobicContact CD1-CG 4.34Å; I518-L522 HydrophobicContact CG1-CD1 4.28Å; I518-L522 HydrophobicContact CG1-CG 4.44Å; I518-L522 PolarHBondContact O-N 3.36Å; S519-L522 PolarHBondContact O-N 3.34Å; S519-L522 VanDerWaalsContact O-N 3.16Å; L522-A526 VanDerWaalsContact O-CB 3.25Å; L522-A526 WeakPolarHBondContact O-CB 3.44Å; L522-A526 PolarHBondContact O-N 3.36Å
523	H	94.9	Very high	94.1	Very high	42 Å²	42	53.6 Å²	53.6	19%	0.194	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-46	176	-88.6	-86.1	0	0	0	112.6	Y404 W494 S519 I521 A526 W527	Y404-H523 AromaticContact CE1-CE1 3.67Å; Y404-H523 AromaticContact CE2-CE1 3.39Å; Y404-H523 WeakPolarHBondContact CE2-CE1 3.31Å; Y404-H523 AromaticContact CE2-NE2 3.4Å; Y404-H523 WeakPolarHBondContact CE2-NE2 3.29Å; Y404-H523 AromaticContact CZ-CE1 3.21Å; Y404-H523 AromaticContact CZ-NE2 3.5Å; Y404-H523 PolarHBondContact OH-CE1 2.96Å; Y404-H523 PolarHBondContact OH-NE2 3.43Å; W494-H523 AromaticContact CH2-CD2 3.94Å; W494-H523 AromaticContact CH2-CE1 3.45Å; W494-H523 VanDerWaalsContact CH2-CE1 3.45Å; W494-H523 WeakPolarHBondContact CH2-CE1 3.5Å; W494-H523 AromaticContact CH2-CG 3.78Å; W494-H523 AromaticContact CH2-ND1 3.47Å; W494-H523 WeakPolarHBondContact CH2-ND1 3.26Å; W494-H523 AromaticContact CH2-NE2 3.75Å; W494-H523 AromaticContact CZ2-CE1 3.87Å; W494-H523 AromaticContact CZ2-ND1 3.65Å; S519-H523 WeakPolarHBondContact O-CB 3.21Å; S519-H523 PolarHBondContact O-CD2 3.12Å; S519-H523 VanDerWaalsContact O-CD2 3.23Å; S519-H523 PolarHBondContact O-N 3.34Å; I521-H523 VanDerWaalsContact C-N 3.32Å; I521-H523 PolarHBondContact O-N 2.91Å; H523-A526 PolarHBondContact O-N 3.41Å; H523-W527 AromaticContact ND1-NE1 3.74Å; H523-W527 PolarHBondContact O-N 3.48Å; H523-W527 VanDerWaalsContact O-N 3.17Å
524	M	95.8	Very high	94.5	Very high	114 Å²	114	45.8 Å²	45.8	56%	0.562	27%	0.27	S	S	*	.	H	α-helix	trans	-60.6	-47.3	179.5	-176.3	-97.7	-76.6	0	0	110.8	S520 I521 A528	S520-M524 VanDerWaalsContact O-CB 3.29Å; S520-M524 WeakPolarHBondContact O-CB 3.48Å; S520-M524 PolarHBondContact O-N 3.35Å; I521-M524 PolarHBondContact O-N 2.97Å; M524-A528 WeakPolarHBondContact O-CA 3.48Å; M524-A528 WeakPolarHBondContact O-CB 3.41Å; M524-A528 PolarHBondContact O-N 3.31Å
525	L	95.7	Very high	94.9	Very high	75 Å²	75	48.6 Å²	48.6	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-44.7	178.2	-68	175.9	0	0	0	112.7	M497 I521 W527 V529	M497-L525 HydrophobicContact CE-CB 4.25Å; I521-L525 HydrophobicContact CG2-CD1 4.05Å; I521-L525 HydrophobicContact CG2-CG 4.41Å; I521-L525 WeakPolarHBondContact O-CG 3.4Å; I521-L525 PolarHBondContact O-N 3.4Å; L525-W527 VanDerWaalsContact C-N 3.27Å; L525-W527 PolarHBondContact O-N 2.83Å; L525-V529 WeakPolarHBondContact O-CB 3.24Å; L525-V529 WeakPolarHBondContact O-CG2 3.32Å; L525-V529 PolarHBondContact O-N 2.85Å
526	A	96.5	Very high	95.2	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.6	-28.1	-176.3	0	0	0	0	0	113.5	L493 W494 M497 L522 H523 P530	L493-A526 HydrophobicContact CB-CB 4.41Å; W494-A526 HydrophobicContact CD2-CB 3.89Å; W494-A526 HydrophobicContact CE3-CB 4.35Å; W494-A526 HydrophobicContact CG-CB 4.33Å; W494-A526 HydrophobicContact CH2-CB 4.21Å; W494-A526 HydrophobicContact CZ2-CB 3.75Å; W494-A526 HydrophobicContact CZ3-CB 4.49Å; M497-A526 HydrophobicContact CG-CB 4.11Å; L522-A526 VanDerWaalsContact O-CB 3.25Å; L522-A526 WeakPolarHBondContact O-CB 3.44Å; L522-A526 PolarHBondContact O-N 3.36Å; H523-A526 PolarHBondContact O-N 3.41Å; A526-P530 WeakPolarHBondContact O-CD 3.48Å; A526-P530 VanDerWaalsContact O-CG 3.26Å; A526-P530 WeakPolarHBondContact O-CG 3.35Å
527	W	97.5	Very high	95.4	Very high	60 Å²	60	48.3 Å²	48.3	23%	0.227	28%	0.278	C	S	.	.	H	α-helix	trans	-100.8	-37	178.9	-63.2	128.3	0	0	0	114.1	Y486 A490 W494 H523 L525 P530 A531	Y486-W527 HydrophobicContact CE1-CE3 4.11Å; Y486-W527 HydrophobicContact CE1-CZ3 4.21Å; Y486-W527 PolarHBondContact OH-O 2.91Å; A490-W527 HydrophobicContact CB-CE3 3.85Å; A490-W527 HydrophobicContact CB-CZ3 3.52Å; W494-W527 AromaticContact CE2-CE2 3.88Å; W494-W527 AromaticContact CE2-CZ2 3.78Å; W494-W527 AromaticContact CZ2-CE2 3.72Å; W494-W527 AromaticContact CZ2-CZ2 3.92Å; W494-W527 HydrophobicContact CZ2-CZ2 3.92Å; W494-W527 AromaticContact CZ2-NE1 3.55Å; W494-W527 AromaticContact NE1-CD2 3.86Å; W494-W527 AromaticContact NE1-CE2 3.43Å; W494-W527 AromaticContact NE1-CE3 3.98Å; W494-W527 AromaticContact NE1-CH2 3.32Å; W494-W527 VanDerWaalsContact NE1-CH2 3.32Å; W494-W527 AromaticContact NE1-CZ2 3.15Å; W494-W527 AromaticContact NE1-CZ3 3.75Å; H523-W527 AromaticContact ND1-NE1 3.74Å; H523-W527 PolarHBondContact O-N 3.48Å; H523-W527 VanDerWaalsContact O-N 3.17Å; L525-W527 VanDerWaalsContact C-N 3.27Å; L525-W527 PolarHBondContact O-N 2.83Å; W527-P530 WeakPolarHBondContact O-CD 3.27Å; W527-A531 WeakPolarHBondContact O-CB 3.36Å; W527-A531 PolarHBondContact O-N 3.49Å
528	A	96.9	Very high	95.6	Very high	45 Å²	45	47.2 Å²	47.2	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-70.6	-38.9	-177.6	0	0	0	0	0	112.3	M524 A531 L532	M524-A528 WeakPolarHBondContact O-CA 3.48Å; M524-A528 WeakPolarHBondContact O-CB 3.41Å; M524-A528 PolarHBondContact O-N 3.31Å; A528-A531 PolarHBondContact O-N 3.38Å; A528-L532 WeakPolarHBondContact O-CB 3.34Å; A528-L532 PolarHBondContact O-N 3.44Å
529	V	96.8	Very high	95.7	Very high	55 Å²	55	51.2 Å²	51.2	33%	0.333	28%	0.281	S	S	.	.	H	α-helix	trans	-64.3	-46.5	-178.8	173.5	0	0	0	0	111.9	L493 L525 K533 Y573	L493-V529 HydrophobicContact CD1-CB 3.69Å; L493-V529 HydrophobicContact CD1-CG1 3.85Å; L525-V529 WeakPolarHBondContact O-CB 3.24Å; L525-V529 WeakPolarHBondContact O-CG2 3.32Å; L525-V529 PolarHBondContact O-N 2.85Å; V529-K533 WeakPolarHBondContact O-CB 3.09Å; V529-K533 PolarHBondContact O-N 3.21Å; V529-K533 VanDerWaalsContact O-N 3.08Å; V529-Y573 WeakPolarHBondContact CG1-OH 3.33Å
530	P	97.3	Very high	95.7	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.7	-40.9	171.6	-25.8	37.5	0	0	0	112.8	Y486 Q489 A490 L493 A526 W527 K533 T534	Y486-P530 HydrophobicContact CD2-CB 3.87Å; Y486-P530 HydrophobicContact CE2-CB 3.86Å; Q489-P530 HydrophobicContact CB-CB 4.02Å; Q489-P530 HydrophobicContact CB-CG 4.27Å; A490-P530 HydrophobicContact CB-CB 4.37Å; A490-P530 HydrophobicContact CB-CG 3.94Å; L493-P530 HydrophobicContact CD1-CG 3.55Å; A526-P530 WeakPolarHBondContact O-CD 3.48Å; A526-P530 VanDerWaalsContact O-CG 3.26Å; A526-P530 WeakPolarHBondContact O-CG 3.35Å; W527-P530 WeakPolarHBondContact O-CD 3.27Å; P530-K533 PolarHBondContact O-N 3.35Å; P530-T534 PolarHBondContact O-N 3.35Å; P530-T534 PolarHBondContact O-OG1 2.86Å
531	A	97.5	Very high	95.6	Very high	32 Å²	32	54.2 Å²	54.2	26%	0.264	28%	0.284	S	S	.	.	H	α-helix	trans	-60.6	-50.3	179.8	0	0	0	0	0	111.3	Y486 W527 A528 K533 T534 I535	Y486-A531 HydrophobicContact CE2-CB 3.84Å; W527-A531 WeakPolarHBondContact O-CB 3.36Å; W527-A531 PolarHBondContact O-N 3.49Å; A528-A531 PolarHBondContact O-N 3.38Å; A531-K533 VanDerWaalsContact C-N 3.29Å; A531-K533 PolarHBondContact O-N 2.91Å; A531-T534 PolarHBondContact O-N 2.98Å; A531-I535 VanDerWaalsContact O-CG1 3.32Å; A531-I535 WeakPolarHBondContact O-CG1 3.37Å; A531-I535 PolarHBondContact O-N 3.46Å
532	L	97.5	Very high	95.4	Very high	107 Å²	107	56.4 Å²	56.4	56%	0.56	29%	0.288	S	S	*	.	H	α-helix	trans	-58.3	-44.3	177.7	179.8	61	0	0	0	111.1	A528 T534 I535 I536	A528-L532 WeakPolarHBondContact O-CB 3.34Å; A528-L532 PolarHBondContact O-N 3.44Å; L532-T534 PolarHBondContact O-N 2.97Å; L532-I535 PolarHBondContact O-N 3.4Å; L532-I536 HydrophobicContact CD1-CD1 4.25Å; L532-I536 HydrophobicContact CG-CD1 4.06Å; L532-I536 VanDerWaalsContact O-CG1 3.3Å; L532-I536 WeakPolarHBondContact O-CG1 3.39Å; L532-I536 PolarHBondContact O-N 2.74Å
533	K	96.2	Very high	95.4	Very high	17 Å²	17	56 Å²	56	7%	0.074	29%	0.286	C	S	.	.	H	α-helix	trans	-61.5	-43.2	177.6	-166.1	-176.9	-171.9	-169.4	0	112.4	F485 Q489 V529 P530 A531 I536 I537 F565	F485-K533 HydrophobicContact CE1-CB 4.31Å; F485-K533 HydrophobicContact CE1-CD 3.89Å; F485-K533 HydrophobicContact CE1-CG 3.89Å; F485-K533 HydrophobicContact CZ-CD 3.57Å; F485-K533 HydrophobicContact CZ-CG 3.81Å; Q489-K533 HydrophobicContact CG-CD 4.23Å; V529-K533 WeakPolarHBondContact O-CB 3.09Å; V529-K533 PolarHBondContact O-N 3.21Å; V529-K533 VanDerWaalsContact O-N 3.08Å; P530-K533 PolarHBondContact O-N 3.35Å; A531-K533 VanDerWaalsContact C-N 3.29Å; A531-K533 PolarHBondContact O-N 2.91Å; K533-I536 PolarHBondContact O-N 2.94Å; K533-I537 HydrophobicContact CG-CD1 4.42Å; K533-I537 WeakPolarHBondContact O-CD1 3.4Å; K533-I537 WeakPolarHBondContact O-CG1 3.42Å; K533-I537 PolarHBondContact O-N 3.41Å; K533-F565 WeakPolarHBondContact CE-O 3.37Å; K533-F565 PolarHBondContact NZ-O 3.48Å
534	T	97	Very high	95.4	Very high	9 Å²	9	54.5 Å²	54.5	6%	0.055	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-44.3	175.9	-59.3	0	0	0	0	111.5	F481 L482 F485 P530 A531 L532 I536 I537 L538	F481-T534 HydrophobicContact CE1-CG2 4.09Å; F481-T534 HydrophobicContact CZ-CG2 4.45Å; L482-T534 HydrophobicContact CD2-CG2 3.43Å; L482-T534 VanDerWaalsContact CD2-CG2 3.43Å; F485-T534 WeakPolarHBondContact CD1-OG1 3.28Å; P530-T534 PolarHBondContact O-N 3.35Å; P530-T534 PolarHBondContact O-OG1 2.86Å; A531-T534 PolarHBondContact O-N 2.98Å; L532-T534 PolarHBondContact O-N 2.97Å; T534-I536 VanDerWaalsContact C-N 3.35Å; T534-I536 PolarHBondContact O-N 3.12Å; T534-I537 PolarHBondContact O-N 2.87Å; T534-L538 HydrophobicContact CG2-CD1 4.31Å; T534-L538 WeakPolarHBondContact O-CG 3.43Å; T534-L538 PolarHBondContact O-N 3.24Å
535	I	96.8	Very high	95.3	Very high	88 Å²	88	49.1 Å²	49.1	45%	0.451	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-45.4	178.1	-68.7	164.1	0	0	0	110.9	A531 L532 I537 L538 I539	A531-I535 VanDerWaalsContact O-CG1 3.32Å; A531-I535 WeakPolarHBondContact O-CG1 3.37Å; A531-I535 PolarHBondContact O-N 3.46Å; L532-I535 PolarHBondContact O-N 3.4Å; I535-I537 VanDerWaalsContact C-N 3.31Å; I535-I537 PolarHBondContact O-N 2.87Å; I535-L538 PolarHBondContact O-N 3.39Å; I535-I539 HydrophobicContact CG2-CD1 3.74Å; I535-I539 HydrophobicContact CG2-CG1 4.46Å; I535-I539 WeakPolarHBondContact O-CG1 3.45Å; I535-I539 PolarHBondContact O-N 3.32Å
536	I	96.1	Very high	95.2	Very high	71 Å²	71	46.2 Å²	46.2	36%	0.364	24%	0.238	S	C	.	.	H	α-helix	trans	-59.2	-43.6	177.9	-67.9	164.8	0	0	0	110.8	L532 K533 T534 L538 I539 M540 F565	L532-I536 HydrophobicContact CD1-CD1 4.25Å; L532-I536 HydrophobicContact CG-CD1 4.06Å; L532-I536 VanDerWaalsContact O-CG1 3.3Å; L532-I536 WeakPolarHBondContact O-CG1 3.39Å; L532-I536 PolarHBondContact O-N 2.74Å; K533-I536 PolarHBondContact O-N 2.94Å; T534-I536 VanDerWaalsContact C-N 3.35Å; T534-I536 PolarHBondContact O-N 3.12Å; I536-L538 PolarHBondContact O-N 2.95Å; I536-I539 PolarHBondContact O-N 3.29Å; I536-M540 HydrophobicContact CG2-CE 3.79Å; I536-M540 HydrophobicContact CG2-SD 4Å; I536-M540 WeakPolarHBondContact O-CE 3.38Å; I536-M540 WeakPolarHBondContact O-CG 3.2Å; I536-M540 PolarHBondContact O-N 3.17Å; I536-M540 VanDerWaalsContact O-N 3.09Å; I536-F565 HydrophobicContact CG2-CE1 4.01Å; I536-F565 HydrophobicContact CG2-CZ 4.45Å
537	I	95.2	Very high	95	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-41	178.7	-66.4	161.9	0	0	0	112.3	F481 F485 K533 T534 I535 M540 H541 I543 V554 F565	F481-I537 HydrophobicContact CE1-CG2 4.14Å; F481-I537 HydrophobicContact CE2-CD1 4.49Å; F481-I537 HydrophobicContact CE2-CG2 3.96Å; F481-I537 HydrophobicContact CZ-CB 3.9Å; F481-I537 HydrophobicContact CZ-CD1 4.15Å; F481-I537 HydrophobicContact CZ-CG2 3.4Å; F485-I537 HydrophobicContact CD1-CD1 4.13Å; F485-I537 HydrophobicContact CD2-CD1 4.42Å; F485-I537 HydrophobicContact CE1-CD1 3.39Å; F485-I537 HydrophobicContact CE2-CD1 3.73Å; F485-I537 HydrophobicContact CZ-CD1 3.13Å; K533-I537 HydrophobicContact CG-CD1 4.42Å; K533-I537 WeakPolarHBondContact O-CD1 3.4Å; K533-I537 WeakPolarHBondContact O-CG1 3.42Å; K533-I537 PolarHBondContact O-N 3.41Å; T534-I537 PolarHBondContact O-N 2.87Å; I535-I537 VanDerWaalsContact C-N 3.31Å; I535-I537 PolarHBondContact O-N 2.87Å; I537-M540 HydrophobicContact CG1-CE 4.25Å; I537-M540 PolarHBondContact O-N 3.34Å; I537-H541 PolarHBondContact O-N 3.47Å; I537-H541 VanDerWaalsContact O-N 3.16Å; I537-I543 HydrophobicContact CG2-CG1 3.9Å; I537-V554 HydrophobicContact CD1-CG1 4.08Å; I537-V554 HydrophobicContact CG2-CB 4.33Å; I537-F565 HydrophobicContact CD1-CB 3.98Å; I537-F565 HydrophobicContact CD1-CD1 4.16Å; I537-F565 HydrophobicContact CD1-CG 4.08Å; I537-F565 HydrophobicContact CG1-CB 4.34Å; I537-F565 HydrophobicContact CG1-CD1 3.84Å; I537-F565 HydrophobicContact CG1-CD2 4.39Å; I537-F565 HydrophobicContact CG1-CE1 4.38Å; I537-F565 HydrophobicContact CG1-CG 3.9Å
538	L	94.3	Very high	94.9	Very high	57 Å²	57	43.9 Å²	43.9	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-61.8	-44.1	176	-69.3	167.7	0	0	0	111.5	T478 F481 L482 T534 I535 I536 M540 H541 I543	T478-L538 HydrophobicContact CG2-CD2 3.9Å; F481-L538 HydrophobicContact CD1-CD2 4.45Å; F481-L538 HydrophobicContact CE1-CD2 4.15Å; F481-L538 HydrophobicContact CE1-CG 4.4Å; L482-L538 HydrophobicContact CD2-CD1 4.02Å; L482-L538 HydrophobicContact CD2-CD2 4.34Å; T534-L538 HydrophobicContact CG2-CD1 4.31Å; T534-L538 WeakPolarHBondContact O-CG 3.43Å; T534-L538 PolarHBondContact O-N 3.24Å; I535-L538 PolarHBondContact O-N 3.39Å; I536-L538 PolarHBondContact O-N 2.95Å; L538-M540 VanDerWaalsContact C-N 3.34Å; L538-M540 PolarHBondContact O-N 3.12Å; L538-H541 PolarHBondContact O-N 3.36Å; L538-H541 VanDerWaalsContact O-N 3.15Å; L538-H541 PolarHBondContact O-ND1 3.14Å; L538-I543 HydrophobicContact CD2-CD1 3.87Å
539	I	94.6	Very high	94.8	Very high	120 Å²	120	41.9 Å²	41.9	62%	0.615	21%	0.212	S	C	*	.	H	α-helix	trans	-63.9	-38.5	179.8	-68.1	167.2	0	0	0	111.5	I535 I536 H541	I535-I539 HydrophobicContact CG2-CD1 3.74Å; I535-I539 HydrophobicContact CG2-CG1 4.46Å; I535-I539 WeakPolarHBondContact O-CG1 3.45Å; I535-I539 PolarHBondContact O-N 3.32Å; I536-I539 PolarHBondContact O-N 3.29Å; I539-H541 VanDerWaalsContact C-N 3.26Å; I539-H541 PolarHBondContact O-CD2 2.89Å; I539-H541 PolarHBondContact O-N 3.42Å
540	M	91.8	Very high	94.6	Very high	71 Å²	71	39.3 Å²	39.3	35%	0.35	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-3.9	178.1	-55.2	171.9	-54.7	0	0	113.5	I536 I537 L538 R542 F565	I536-M540 HydrophobicContact CG2-CE 3.79Å; I536-M540 HydrophobicContact CG2-SD 4Å; I536-M540 WeakPolarHBondContact O-CE 3.38Å; I536-M540 WeakPolarHBondContact O-CG 3.2Å; I536-M540 PolarHBondContact O-N 3.17Å; I536-M540 VanDerWaalsContact O-N 3.09Å; I537-M540 HydrophobicContact CG1-CE 4.25Å; I537-M540 PolarHBondContact O-N 3.34Å; L538-M540 VanDerWaalsContact C-N 3.34Å; L538-M540 PolarHBondContact O-N 3.12Å; M540-R542 HydrophobicContact CB-CG 3.78Å; M540-R542 HydrophobicContact CE-CG 4.42Å; M540-R542 WeakPolarHBondContact O-CG 3.33Å; M540-R542 PolarHBondContact O-N 3.4Å; M540-R542 VanDerWaalsContact O-N 3.11Å; M540-F565 HydrophobicContact CE-CD1 4.46Å; M540-F565 HydrophobicContact CE-CD2 4.15Å; M540-F565 HydrophobicContact CE-CE1 3.66Å; M540-F565 HydrophobicContact CE-CE2 3.27Å; M540-F565 HydrophobicContact CE-CZ 3.03Å; M540-F565 HydrophobicContact SD-CE1 4.45Å; M540-F565 HydrophobicContact SD-CE2 4.04Å; M540-F565 HydrophobicContact SD-CZ 3.57Å; M540-F565 VanDerWaalsContact SD-CZ 3.57Å
541	H	91.2	Very high	94.5	Very high	95 Å²	95	39.4 Å²	39.4	44%	0.44	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	26	-178.1	-61.3	-75.7	0	0	0	115.6	I537 L538 I539 I543	I537-H541 PolarHBondContact O-N 3.47Å; I537-H541 VanDerWaalsContact O-N 3.16Å; L538-H541 PolarHBondContact O-N 3.36Å; L538-H541 VanDerWaalsContact O-N 3.15Å; L538-H541 PolarHBondContact O-ND1 3.14Å; I539-H541 VanDerWaalsContact C-N 3.26Å; I539-H541 PolarHBondContact O-CD2 2.89Å; I539-H541 PolarHBondContact O-N 3.42Å; H541-I543 VanDerWaalsContact C-N 3.27Å; H541-I543 PolarHBondContact O-N 2.85Å; H541-I543 VanDerWaalsContact O-N 3.1Å
542	R	90.1	Very high	94.5	Very high	117 Å²	117	37.9 Å²	37.9	44%	0.442	19%	0.185	S	C	.	.			trans	-85.8	39.5	-174.9	-61.5	-65.4	-170.9	152.7	0.9	114.2	M540 V554 N558	M540-R542 HydrophobicContact CB-CG 3.78Å; M540-R542 HydrophobicContact CE-CG 4.42Å; M540-R542 WeakPolarHBondContact O-CG 3.33Å; M540-R542 PolarHBondContact O-N 3.4Å; M540-R542 VanDerWaalsContact O-N 3.11Å; R542-V554 HydrophobicContact CB-CG2 4.42Å; R542-V554 WeakPolarHBondContact O-CG2 3.25Å; R542-N558 PolarHBondContact NH1-ND2 3.35Å
543	I	94.5	Very high	94.3	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	17%	0.166	C	C	.	.			trans	-101.1	123.9	179.4	-58.1	164.1	0	0	0	108.4	S470 G471 F481 I537 L538 H541 C552	S470-I543 CarbonylContact C-O 3.58Å; S470-I543 WeakPolarHBondContact CA-O 3.35Å; S470-I543 PolarHBondContact N-O 3.15Å; G471-I543 PolarHBondContact N-O 3.43Å; F481-I543 HydrophobicContact CB-CD1 4.5Å; F481-I543 HydrophobicContact CB-CG2 3.95Å; F481-I543 HydrophobicContact CD1-CD1 3.31Å; F481-I543 HydrophobicContact CD1-CG1 3.9Å; F481-I543 HydrophobicContact CD2-CD1 4.49Å; F481-I543 HydrophobicContact CD2-CG1 4.21Å; F481-I543 HydrophobicContact CD2-CG2 4.29Å; F481-I543 HydrophobicContact CE1-CD1 3.54Å; F481-I543 HydrophobicContact CE1-CG1 3.98Å; F481-I543 HydrophobicContact CE2-CG1 4.26Å; F481-I543 HydrophobicContact CG-CD1 3.84Å; F481-I543 HydrophobicContact CG-CG1 4.01Å; F481-I543 HydrophobicContact CG-CG2 4.01Å; F481-I543 HydrophobicContact CZ-CD1 4.22Å; F481-I543 HydrophobicContact CZ-CG1 4.15Å; I537-I543 HydrophobicContact CG2-CG1 3.9Å; L538-I543 HydrophobicContact CD2-CD1 3.87Å; H541-I543 VanDerWaalsContact C-N 3.27Å; H541-I543 PolarHBondContact O-N 2.85Å; H541-I543 VanDerWaalsContact O-N 3.1Å; I543-C552 HydrophobicContact CG2-CB 4.18Å
544	D	93.6	Very high	94.2	Very high	10 Å²	10	33.5 Å²	33.5	5%	0.053	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.8	-176.9	-44.7	-40.6	0	0	0	110	T469 C552 N553 Q557	T469-D544 VanDerWaalsContact O-OD1 3.11Å; D544-C552 WeakPolarHBondContact O-CA 3.41Å; D544-N553 PolarHBondContact N-O 3.37Å; D544-N553 PolarHBondContact O-N 2.8Å; D544-Q557 HydrophobicContact CB-CB 4.18Å; D544-Q557 HydrophobicContact CB-CG 4.12Å
545	A	94.4	Very high	94	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	148.9	171.3	0	0	0	0	0	112.1	A428 L467 I468 L551 Q557	A428-A545 HydrophobicContact CB-CB 3.74Å; L467-A545 HydrophobicContact CD1-CB 3.55Å; L467-A545 WeakPolarHBondContact CD2-O 3.37Å; L467-A545 HydrophobicContact CG-CB 3.79Å; I468-A545 HydrophobicContact CB-CB 4.25Å; I468-A545 PolarHBondContact O-N 3.4Å; A545-L551 WeakPolarHBondContact CA-O 3.44Å; A545-Q557 PolarHBondContact O-NE2 2.99Å; A545-Q557 VanDerWaalsContact O-NE2 3.1Å
546	D	94.2	Very high	93.8	Very high	15 Å²	15	32.5 Å²	32.5	8%	0.08	16%	0.155	C	C	.	.			trans	-90.5	137.8	176.2	175.7	38.1	0	0	0	112.5	L548 T549 G550 L551 Y556	D546-L548 PolarHBondContact OD1-N 3.19Å; D546-L548 WeakPolarHBondContact OD2-CB 3.18Å; D546-L548 PolarHBondContact OD2-N 2.87Å; D546-T549 VanDerWaalsContact OD2-CB 3.31Å; D546-T549 WeakPolarHBondContact OD2-CB 3.36Å; D546-T549 WeakPolarHBondContact OD2-CG2 3.38Å; D546-T549 PolarHBondContact OD2-N 3.29Å; D546-T549 PolarHBondContact OD2-OG1 3.37Å; D546-G550 VanDerWaalsContact O-CA 3.29Å; D546-G550 WeakPolarHBondContact O-CA 3.46Å; D546-G550 PolarHBondContact O-N 2.96Å; D546-L551 PolarHBondContact N-O 3.46Å; D546-Y556 HydrophobicContact CB-CD1 3.97Å; D546-Y556 HydrophobicContact CB-CD2 3.67Å; D546-Y556 HydrophobicContact CB-CE1 3.98Å; D546-Y556 HydrophobicContact CB-CE2 3.62Å; D546-Y556 HydrophobicContact CB-CG 3.83Å
547	E	92.4	Very high	93.5	Very high	11 Å²	11	30.5 Å²	30.5	5%	0.051	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-38.1	178.9	-163	-150.5	144.9	0	0	112.2	L356 F357 Y358 K363 R424 L467	L356-E547 PolarHBondContact N-OE1 2.82Å; F357-E547 WeakPolarHBondContact CB-OE2 3.49Å; F357-E547 WeakPolarHBondContact CD2-OE2 3.47Å; F357-E547 PolarHBondContact N-OE1 3.09Å; F357-E547 PolarHBondContact N-OE2 3.27Å; F357-E547 VanDerWaalsContact N-OE2 3.09Å; Y358-E547 HydrophobicContact CD2-CB 4.4Å; K363-E547 WeakPolarHBondContact CE-O 3.4Å; K363-E547 WeakPolarHBondContact CE-OE1 3.37Å; K363-E547 IonicContact NZ-OE1 2.77Å; K363-E547 PolarHBondContact NZ-OE1 3.33Å; R424-E547 PolarHBondContact NH2-O 3.21Å; L467-E547 HydrophobicContact CD2-CB 4.35Å
548	L	94.4	Very high	93.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-44.3	-174.1	178.9	57.6	0	0	0	112.4	Y358 K363 A366 R424 D546 V726 N729 M730	Y358-L548 HydrophobicContact CD1-CD1 3.87Å; Y358-L548 HydrophobicContact CD2-CB 3.72Å; Y358-L548 HydrophobicContact CD2-CD1 4.12Å; Y358-L548 HydrophobicContact CD2-CG 4.43Å; Y358-L548 HydrophobicContact CE1-CB 4.48Å; Y358-L548 HydrophobicContact CE1-CD1 4.22Å; Y358-L548 HydrophobicContact CE1-CD2 4.05Å; Y358-L548 HydrophobicContact CE1-CG 4.49Å; Y358-L548 HydrophobicContact CE2-CB 3.54Å; Y358-L548 HydrophobicContact CE2-CD1 4.49Å; Y358-L548 HydrophobicContact CE2-CD2 4.48Å; Y358-L548 HydrophobicContact CE2-CG 4.38Å; Y358-L548 HydrophobicContact CG-CB 4.25Å; Y358-L548 HydrophobicContact CG-CD1 3.75Å; Y358-L548 HydrophobicContact CG-CG 4.49Å; K363-L548 HydrophobicContact CG-CD1 4.36Å; A366-L548 HydrophobicContact CB-CD1 3.98Å; A366-L548 HydrophobicContact CB-CG 4.06Å; R424-L548 PolarHBondContact NH2-O 3.21Å; D546-L548 PolarHBondContact OD1-N 3.19Å; D546-L548 WeakPolarHBondContact OD2-CB 3.18Å; D546-L548 PolarHBondContact OD2-N 2.87Å; L548-V726 HydrophobicContact CD1-CG1 4.35Å; L548-V726 HydrophobicContact CD1-CG2 4.36Å; L548-V726 HydrophobicContact CD2-CG1 4.32Å; L548-N729 HydrophobicContact CD2-CB 3.65Å; L548-M730 HydrophobicContact CD2-CE 3.61Å; L548-M730 HydrophobicContact CG-CE 4.17Å
549	T	94.4	Very high	93.1	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.018	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-25.8	-172.2	63	0	0	0	0	114	N367 M370 H419 D546 L551 I733	N367-T549 PolarHBondContact OD1-O 2.64Å; M370-T549 HydrophobicContact CE-CG2 3.67Å; M370-T549 HydrophobicContact SD-CG2 3.4Å; M370-T549 WeakPolarHBondContact SD-CG2 3.41Å; H419-T549 PolarHBondContact CE1-O 3.15Å; H419-T549 PolarHBondContact NE2-O 3.41Å; D546-T549 VanDerWaalsContact OD2-CB 3.31Å; D546-T549 WeakPolarHBondContact OD2-CB 3.36Å; D546-T549 WeakPolarHBondContact OD2-CG2 3.38Å; D546-T549 PolarHBondContact OD2-N 3.29Å; D546-T549 PolarHBondContact OD2-OG1 3.37Å; T549-L551 WeakPolarHBondContact OG1-CB 3.26Å; T549-L551 PolarHBondContact OG1-N 3.16Å; T549-I733 HydrophobicContact CG2-CD1 4.1Å
550	G	93.7	Very high	93	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.15	C	C	.	.			trans	76.3	9.9	-170.7	0	0	0	0	0	113.9	H419 A428 D546	H419-G550 PolarHBondContact CD2-O 3.17Å; H419-G550 PolarHBondContact NE2-O 3Å; A428-G550 VanDerWaalsContact CB-O 3.25Å; A428-G550 WeakPolarHBondContact CB-O 3.45Å; D546-G550 VanDerWaalsContact O-CA 3.29Å; D546-G550 WeakPolarHBondContact O-CA 3.46Å; D546-G550 PolarHBondContact O-N 2.96Å
551	L	95.5	Very high	93.2	Very high	3 Å²	3	27 Å²	27	2%	0.016	14%	0.135	C	C	.	.			trans	-82.3	149.8	176.3	-64.3	171.6	0	0	0	111.1	M370 F416 H419 V480 L484 A545 D546 T549	M370-L551 HydrophobicContact SD-CD1 3.8Å; F416-L551 HydrophobicContact CD1-CD1 3.7Å; F416-L551 HydrophobicContact CE1-CD1 3.43Å; F416-L551 VanDerWaalsContact CE1-CD1 3.43Å; F416-L551 HydrophobicContact CZ-CD1 4.46Å; H419-L551 HydrophobicContact CB-CD2 3.54Å; V480-L551 HydrophobicContact CG1-CD2 4.08Å; L484-L551 HydrophobicContact CD1-CB 4.45Å; L484-L551 HydrophobicContact CD1-CD1 4.37Å; L484-L551 HydrophobicContact CD1-CD2 4Å; A545-L551 WeakPolarHBondContact CA-O 3.44Å; D546-L551 PolarHBondContact N-O 3.46Å; T549-L551 WeakPolarHBondContact OG1-CB 3.26Å; T549-L551 PolarHBondContact OG1-N 3.16Å
552	C	96	Very high	93.4	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.9	175.4	-70.3	0	0	0	0	111.7	C477 F481 I543 D544	C477-C552 WeakPolarHBondContact CA-SG 3.42Å; C477-C552 HydrophobicContact CB-CB 3.97Å; C477-C552 WeakPolarHBondContact CB-SG 3.37Å; C477-C552 VanDerWaalsContact O-CB 3.22Å; C477-C552 WeakPolarHBondContact O-CB 3.3Å; C477-C552 WeakPolarHBondContact SG-CB 3.45Å; C477-C552 CovalentContact SG-SG 2.02Å; C477-C552 PolarHBondContact SG-SG 2.91Å; F481-C552 WeakPolarHBondContact CA-O 3.22Å; F481-C552 HydrophobicContact CB-CB 4.35Å; I543-C552 HydrophobicContact CG2-CB 4.18Å; D544-C552 WeakPolarHBondContact O-CA 3.41Å
553	N	95.1	Very high	93.6	Very high	30 Å²	30	20.8 Å²	20.8	16%	0.16	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	171.5	174.9	-156.3	1.3	0	0	0	111.2	F485 D544 Y556	F485-N553 WeakPolarHBondContact CD2-OD1 3.49Å; D544-N553 PolarHBondContact N-O 3.37Å; D544-N553 PolarHBondContact O-N 2.8Å; N553-Y556 HydrophobicContact CB-CD2 4.02Å; N553-Y556 HydrophobicContact CB-CE2 3.35Å
554	V	94.2	Very high	93.7	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.006	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	134.3	173.6	61.9	0	0	0	0	110.6	F485 I537 R542 S561 F565 I566	F485-V554 HydrophobicContact CD2-CG1 4.05Å; F485-V554 HydrophobicContact CE2-CG1 3.72Å; I537-V554 HydrophobicContact CD1-CG1 4.08Å; I537-V554 HydrophobicContact CG2-CB 4.33Å; R542-V554 HydrophobicContact CB-CG2 4.42Å; R542-V554 WeakPolarHBondContact O-CG2 3.25Å; V554-S561 VanDerWaalsContact CG2-CB 3.46Å; V554-F565 HydrophobicContact CG1-CB 3.97Å; V554-F565 HydrophobicContact CG2-CB 4.17Å; V554-F565 HydrophobicContact CG2-CD2 4.03Å; V554-F565 HydrophobicContact CG2-CG 4.45Å; V554-I566 HydrophobicContact CG1-CD1 3.85Å; V554-I566 HydrophobicContact CG1-CG1 3.81Å; V554-I566 WeakPolarHBondContact O-CD1 3.2Å
555	G	92.1	Very high	93.8	Very high	7 Å²	7	24 Å²	24	7%	0.072	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.6	15.9	166.3	0	0	0	0	0	117	N558	G555-N558 VanDerWaalsContact CA-O 3.31Å; G555-N558 WeakPolarHBondContact CA-O 3.49Å
556	Y	92.6	Very high	93.9	Very high	69 Å²	69	24.4 Å²	24.4	27%	0.271	14%	0.137	S	C	.	.	S	Bend	trans	-73.4	-41.1	168.9	-71.1	-55.5	0	0	0	112.2	D546 N553	D546-Y556 HydrophobicContact CB-CD1 3.97Å; D546-Y556 HydrophobicContact CB-CD2 3.67Å; D546-Y556 HydrophobicContact CB-CE1 3.98Å; D546-Y556 HydrophobicContact CB-CE2 3.62Å; D546-Y556 HydrophobicContact CB-CG 3.83Å; N553-Y556 HydrophobicContact CB-CD2 4.02Å; N553-Y556 HydrophobicContact CB-CE2 3.35Å
557	Q	89.3	Confident	94.1	Very high	30 Å²	30	24.1 Å²	24.1	14%	0.14	14%	0.135	C	C	.	.	S	Bend	trans	-105.4	-11	-178.7	-59.1	-173.4	53	0	0	112.2	I468 D544 A545 Y687	I468-Q557 PolarHBondContact O-NE2 2.86Å; D544-Q557 HydrophobicContact CB-CB 4.18Å; D544-Q557 HydrophobicContact CB-CG 4.12Å; A545-Q557 PolarHBondContact O-NE2 2.99Å; A545-Q557 VanDerWaalsContact O-NE2 3.1Å; Q557-Y687 VanDerWaalsContact O-CZ 3.3Å; Q557-Y687 PolarHBondContact O-OH 2.88Å
558	N	89.8	Confident	94.3	Very high	38 Å²	38	28.2 Å²	28.2	20%	0.203	16%	0.157	C	C	.	.			trans	-125.9	110.6	-178.4	-166.9	-48.8	0	0	0	112.7	R542 G555 T560 S561 L562	R542-N558 PolarHBondContact NH1-ND2 3.35Å; G555-N558 VanDerWaalsContact CA-O 3.31Å; G555-N558 WeakPolarHBondContact CA-O 3.49Å; N558-T560 VanDerWaalsContact C-N 3.34Å; N558-T560 PolarHBondContact O-N 3.32Å; N558-T560 WeakPolarHBondContact OD1-CB 3.42Å; N558-T560 PolarHBondContact OD1-N 3.47Å; N558-S561 PolarHBondContact O-N 3.02Å; N558-S561 PolarHBondContact OD1-N 3.46Å; N558-L562 PolarHBondContact O-N 3.11Å; N558-L562 VanDerWaalsContact O-N 3.11Å
559	S	91.7	Very high	94.4	Very high	33 Å²	33	29 Å²	29	23%	0.231	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-32.2	-179.1	54.7	0	0	0	0	113.6	L562 L563	S559-L562 WeakPolarHBondContact O-CB 3.28Å; S559-L562 PolarHBondContact O-N 3.33Å; S559-L563 PolarHBondContact O-N 3.2Å
560	T	92.9	Very high	94.6	Very high	99 Å²	99	29.1 Å²	29.1	61%	0.607	16%	0.162	S	C	*	.	H	α-helix	trans	-65.6	-44.4	176.9	-52.4	0	0	0	0	110.9	N558 L563 A564	N558-T560 VanDerWaalsContact C-N 3.34Å; N558-T560 PolarHBondContact O-N 3.32Å; N558-T560 WeakPolarHBondContact OD1-CB 3.42Å; N558-T560 PolarHBondContact OD1-N 3.47Å; T560-L563 PolarHBondContact O-N 3.06Å; T560-A564 PolarHBondContact O-N 3.46Å
561	S	94.5	Very high	94.7	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.028	18%	0.177	C	C	.	.	H	α-helix	trans	-66.7	-37.5	177.5	-54.1	0	0	0	0	112.1	V554 N558 F565	V554-S561 VanDerWaalsContact CG2-CB 3.46Å; N558-S561 PolarHBondContact O-N 3.02Å; N558-S561 PolarHBondContact OD1-N 3.46Å; S561-F565 WeakPolarHBondContact O-CB 3.32Å; S561-F565 WeakPolarHBondContact O-CD2 3.47Å; S561-F565 PolarHBondContact O-N 3.02Å
562	L	95.5	Very high	94.8	Very high	12 Å²	12	34.7 Å²	34.7	6%	0.063	19%	0.193	C	C	.	.	H	α-helix	trans	-59.3	-45.6	173.2	179.6	63.9	0	0	0	111.5	N558 S559 I566 L567 N683	N558-L562 PolarHBondContact O-N 3.11Å; N558-L562 VanDerWaalsContact O-N 3.11Å; S559-L562 WeakPolarHBondContact O-CB 3.28Å; S559-L562 PolarHBondContact O-N 3.33Å; L562-I566 HydrophobicContact CD1-CB 4.07Å; L562-I566 HydrophobicContact CD1-CD1 4.04Å; L562-I566 HydrophobicContact CD1-CG1 4.46Å; L562-I566 HydrophobicContact CD1-CG2 4.29Å; L562-I566 WeakPolarHBondContact O-CA 3.48Å; L562-I566 WeakPolarHBondContact O-CB 3.42Å; L562-I566 PolarHBondContact O-N 3.25Å; L562-I566 VanDerWaalsContact O-N 3.1Å; L562-L567 HydrophobicContact CG-CD1 4.36Å; L562-L567 PolarHBondContact O-N 3.3Å; L562-N683 HydrophobicContact CD2-CB 4.22Å
563	L	96.2	Very high	94.9	Very high	69 Å²	69	36 Å²	36	36%	0.361	20%	0.198	S	C	.	.	I	π-helix	trans	-63.4	-54.3	179	-178.5	63.5	0	0	0	111.7	S559 T560 L567 L568 Y684	S559-L563 PolarHBondContact O-N 3.2Å; T560-L563 PolarHBondContact O-N 3.06Å; L563-L567 HydrophobicContact CD1-CB 4.27Å; L563-L567 HydrophobicContact CD1-CD1 4.28Å; L563-L568 WeakPolarHBondContact O-CB 3.3Å; L563-L568 PolarHBondContact O-N 3.47Å; L563-Y684 HydrophobicContact CB-CD2 4.24Å; L563-Y684 HydrophobicContact CB-CE2 3.87Å; L563-Y684 HydrophobicContact CD1-CE2 4.48Å; L563-Y684 HydrophobicContact CD2-CE2 4.17Å; L563-Y684 HydrophobicContact CG-CE2 4.4Å
564	A	95.3	Very high	95	Very high	43 Å²	43	35.5 Å²	35.5	36%	0.355	20%	0.196	S	C	.	.	I	π-helix	trans	-71.8	-43	-171.9	0	0	0	0	0	113.2	T560 P569	T560-A564 PolarHBondContact O-N 3.46Å; A564-P569 VanDerWaalsContact O-CD 3.27Å; A564-P569 WeakPolarHBondContact O-CD 3.47Å
565	F	96.5	Very high	95.1	Very high	36 Å²	36	40.6 Å²	40.6	16%	0.158	22%	0.222	C	C	.	.	I	π-helix	trans	-101.6	-9.7	-172.2	-59.4	-66.2	0	0	0	114.2	K533 I536 I537 M540 V554 S561	K533-F565 WeakPolarHBondContact CE-O 3.37Å; K533-F565 PolarHBondContact NZ-O 3.48Å; I536-F565 HydrophobicContact CG2-CE1 4.01Å; I536-F565 HydrophobicContact CG2-CZ 4.45Å; I537-F565 HydrophobicContact CD1-CB 3.98Å; I537-F565 HydrophobicContact CD1-CD1 4.16Å; I537-F565 HydrophobicContact CD1-CG 4.08Å; I537-F565 HydrophobicContact CG1-CB 4.34Å; I537-F565 HydrophobicContact CG1-CD1 3.84Å; I537-F565 HydrophobicContact CG1-CD2 4.39Å; I537-F565 HydrophobicContact CG1-CE1 4.38Å; I537-F565 HydrophobicContact CG1-CG 3.9Å; M540-F565 HydrophobicContact CE-CD1 4.46Å; M540-F565 HydrophobicContact CE-CD2 4.15Å; M540-F565 HydrophobicContact CE-CE1 3.66Å; M540-F565 HydrophobicContact CE-CE2 3.27Å; M540-F565 HydrophobicContact CE-CZ 3.03Å; M540-F565 HydrophobicContact SD-CE1 4.45Å; M540-F565 HydrophobicContact SD-CE2 4.04Å; M540-F565 HydrophobicContact SD-CZ 3.57Å; M540-F565 VanDerWaalsContact SD-CZ 3.57Å; V554-F565 HydrophobicContact CG1-CB 3.97Å; V554-F565 HydrophobicContact CG2-CB 4.17Å; V554-F565 HydrophobicContact CG2-CD2 4.03Å; V554-F565 HydrophobicContact CG2-CG 4.45Å; S561-F565 WeakPolarHBondContact O-CB 3.32Å; S561-F565 WeakPolarHBondContact O-CD2 3.47Å; S561-F565 PolarHBondContact O-N 3.02Å
566	I	96.9	Very high	95.3	Very high	9 Å²	9	42 Å²	42	5%	0.046	23%	0.228	C	C	.	.	I	π-helix	trans	-120.7	-65.8	177.2	-60.3	-171	0	0	0	110.3	F485 V554 L562 Q570 N680	F485-I566 HydrophobicContact CE2-CG1 4.45Å; V554-I566 HydrophobicContact CG1-CD1 3.85Å; V554-I566 HydrophobicContact CG1-CG1 3.81Å; V554-I566 WeakPolarHBondContact O-CD1 3.2Å; L562-I566 HydrophobicContact CD1-CB 4.07Å; L562-I566 HydrophobicContact CD1-CD1 4.04Å; L562-I566 HydrophobicContact CD1-CG1 4.46Å; L562-I566 HydrophobicContact CD1-CG2 4.29Å; L562-I566 WeakPolarHBondContact O-CA 3.48Å; L562-I566 WeakPolarHBondContact O-CB 3.42Å; L562-I566 PolarHBondContact O-N 3.25Å; L562-I566 VanDerWaalsContact O-N 3.1Å; I566-Q570 VanDerWaalsContact O-CB 3.31Å; I566-Q570 WeakPolarHBondContact O-CB 3.36Å; I566-Q570 WeakPolarHBondContact O-CG 3.05Å; I566-Q570 PolarHBondContact O-N 3.22Å; I566-Q570 VanDerWaalsContact O-N 3.11Å; I566-N680 WeakPolarHBondContact CG2-ND2 3.35Å
567	L	97.1	Very high	95.5	Very high	9 Å²	9	38.7 Å²	38.7	5%	0.047	22%	0.215	C	C	.	.	I	π-helix	trans	-62.3	-56	-170.2	-79.5	171.8	0	0	0	113.3	L562 L563 Q570 V571 I677 N680 I681 Y684	L562-L567 HydrophobicContact CG-CD1 4.36Å; L562-L567 PolarHBondContact O-N 3.3Å; L563-L567 HydrophobicContact CD1-CB 4.27Å; L563-L567 HydrophobicContact CD1-CD1 4.28Å; L567-Q570 PolarHBondContact O-N 3.32Å; L567-V571 WeakPolarHBondContact O-CB 3.3Å; L567-V571 VanDerWaalsContact O-CG2 3.31Å; L567-V571 WeakPolarHBondContact O-CG2 3.43Å; L567-V571 PolarHBondContact O-N 3.2Å; L567-I677 HydrophobicContact CD2-CG2 4.4Å; L567-N680 HydrophobicContact CD2-CB 3.38Å; L567-N680 HydrophobicContact CG-CB 4Å; L567-I681 HydrophobicContact CD2-CG1 3.65Å; L567-Y684 HydrophobicContact CD1-CD2 4.46Å; L567-Y684 HydrophobicContact CD1-CG 4.04Å
568	L	97	Very high	95.8	Very high	98 Å²	98	39.6 Å²	39.6	51%	0.513	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-49	-173.8	178.1	141.2	0	0	0	112.1	L563 Q570 V571 I572	L563-L568 WeakPolarHBondContact O-CB 3.3Å; L563-L568 PolarHBondContact O-N 3.47Å; L568-Q570 PolarHBondContact O-N 2.87Å; L568-V571 PolarHBondContact O-N 3.23Å; L568-I572 HydrophobicContact CD2-CD1 3.64Å; L568-I572 HydrophobicContact CG-CD1 4.04Å; L568-I572 WeakPolarHBondContact O-CD1 3.18Å; L568-I572 VanDerWaalsContact O-CG1 3.25Å; L568-I572 WeakPolarHBondContact O-CG1 3.26Å; L568-I572 PolarHBondContact O-N 3.46Å
569	P	96.9	Very high	96	Very high	15 Å²	15	40.5 Å²	40.5	10%	0.097	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-42.5	174.5	-26.7	37.3	0	0	0	113.8	A564 V571 I572 Y573	A564-P569 VanDerWaalsContact O-CD 3.27Å; A564-P569 WeakPolarHBondContact O-CD 3.47Å; P569-V571 PolarHBondContact O-N 3.06Å; P569-I572 PolarHBondContact O-N 3.27Å; P569-Y573 HydrophobicContact CB-CE2 4Å; P569-Y573 WeakPolarHBondContact O-CD1 3.14Å; P569-Y573 WeakPolarHBondContact O-CD2 3.41Å; P569-Y573 PolarHBondContact O-N 2.87Å
570	Q	97.1	Very high	96.2	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-40.9	-179.5	-75.3	178	-12.1	0	0	112.2	Y492 I566 L567 L568 Y573 L574 I677 N680	Y492-Q570 HydrophobicContact CD1-CG 4.36Å; Y492-Q570 HydrophobicContact CE1-CB 4.16Å; Y492-Q570 HydrophobicContact CE1-CG 4Å; Y492-Q570 HydrophobicContact CE2-CG 4.28Å; I566-Q570 VanDerWaalsContact O-CB 3.31Å; I566-Q570 WeakPolarHBondContact O-CB 3.36Å; I566-Q570 WeakPolarHBondContact O-CG 3.05Å; I566-Q570 PolarHBondContact O-N 3.22Å; I566-Q570 VanDerWaalsContact O-N 3.11Å; L567-Q570 PolarHBondContact O-N 3.32Å; L568-Q570 PolarHBondContact O-N 2.87Å; Q570-Y573 PolarHBondContact O-N 3.35Å; Q570-L574 WeakPolarHBondContact O-CB 3.16Å; Q570-L574 PolarHBondContact O-N 2.94Å; Q570-I677 HydrophobicContact CB-CD1 3.88Å; Q570-I677 HydrophobicContact CB-CG1 3.8Å; Q570-N680 PolarHBondContact OE1-ND2 3.16Å
571	V	97.7	Very high	96.2	Very high	52 Å²	52	35.5 Å²	35.5	32%	0.315	19%	0.19	S	C	.	.	H	α-helix	trans	-63	-47.5	175	171.6	0	0	0	0	110.4	L567 L568 P569 Y573 L574 L575 I677	L567-V571 WeakPolarHBondContact O-CB 3.3Å; L567-V571 VanDerWaalsContact O-CG2 3.31Å; L567-V571 WeakPolarHBondContact O-CG2 3.43Å; L567-V571 PolarHBondContact O-N 3.2Å; L568-V571 PolarHBondContact O-N 3.23Å; P569-V571 PolarHBondContact O-N 3.06Å; V571-Y573 VanDerWaalsContact C-N 3.33Å; V571-Y573 PolarHBondContact O-N 3.08Å; V571-L574 PolarHBondContact O-N 2.77Å; V571-L575 HydrophobicContact CG1-CD1 3.86Å; V571-L575 HydrophobicContact CG1-CG 4.24Å; V571-L575 WeakPolarHBondContact O-CG 3.09Å; V571-L575 PolarHBondContact O-N 3.22Å; V571-I677 HydrophobicContact CG2-CG2 3.77Å
572	I	97.6	Very high	96	Very high	69 Å²	69	40.2 Å²	40.2	35%	0.354	22%	0.215	S	C	.	.	H	α-helix	trans	-56.5	-47.9	176.6	-69.2	165.6	0	0	0	110.7	L568 P569 L574 L575 L576	L568-I572 HydrophobicContact CD2-CD1 3.64Å; L568-I572 HydrophobicContact CG-CD1 4.04Å; L568-I572 WeakPolarHBondContact O-CD1 3.18Å; L568-I572 VanDerWaalsContact O-CG1 3.25Å; L568-I572 WeakPolarHBondContact O-CG1 3.26Å; L568-I572 PolarHBondContact O-N 3.46Å; P569-I572 PolarHBondContact O-N 3.27Å; I572-L574 PolarHBondContact O-N 3.21Å; I572-L575 PolarHBondContact O-N 2.97Å; I572-L576 HydrophobicContact CG2-CD1 3.76Å; I572-L576 HydrophobicContact CG2-CG 4.32Å; I572-L576 WeakPolarHBondContact O-CB 3.2Å; I572-L576 VanDerWaalsContact O-CG 3.27Å; I572-L576 WeakPolarHBondContact O-CG 3.24Å; I572-L576 PolarHBondContact O-N 3.11Å
573	Y	97.5	Very high	95.9	Very high	26 Å²	26	42.6 Å²	42.6	10%	0.102	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-42.5	178.9	-58.3	-27.3	0	0	0	112.2	Y492 L493 W495 V496 V529 P569 Q570 V571 G577	Y492-Y573 HydrophobicContact CD1-CD2 4.37Å; Y492-Y573 HydrophobicContact CG-CD2 4.29Å; L493-Y573 HydrophobicContact CD2-CD1 3.85Å; L493-Y573 HydrophobicContact CD2-CE1 3.54Å; L493-Y573 HydrophobicContact CD2-CE2 4.38Å; L493-Y573 HydrophobicContact CD2-CG 4.41Å; L493-Y573 HydrophobicContact CG-CE1 4.28Å; L493-Y573 HydrophobicContact CG-CE2 4.25Å; W495-Y573 WeakPolarHBondContact CZ3-O 3.19Å; V496-Y573 WeakPolarHBondContact CG2-O 3.19Å; V529-Y573 WeakPolarHBondContact CG1-OH 3.33Å; P569-Y573 HydrophobicContact CB-CE2 4Å; P569-Y573 WeakPolarHBondContact O-CD1 3.14Å; P569-Y573 WeakPolarHBondContact O-CD2 3.41Å; P569-Y573 PolarHBondContact O-N 2.87Å; Q570-Y573 PolarHBondContact O-N 3.35Å; V571-Y573 VanDerWaalsContact C-N 3.33Å; V571-Y573 PolarHBondContact O-N 3.08Å; Y573-G577 PolarHBondContact O-N 3.48Å
574	L	96.7	Very high	95.5	Very high	21 Å²	21	39.3 Å²	39.3	11%	0.11	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-49.4	177.6	-175.8	67.2	0	0	0	111.1	W495 Q570 V571 I572 G577 I578 V670 K673 A674 I677	W495-L574 HydrophobicContact CH2-CD1 4.04Å; W495-L574 HydrophobicContact CZ3-CD1 4.39Å; Q570-L574 WeakPolarHBondContact O-CB 3.16Å; Q570-L574 PolarHBondContact O-N 2.94Å; V571-L574 PolarHBondContact O-N 2.77Å; I572-L574 PolarHBondContact O-N 3.21Å; L574-G577 PolarHBondContact O-N 3.13Å; L574-I578 HydrophobicContact CD1-CD1 4.05Å; L574-I578 HydrophobicContact CD1-CG1 4.43Å; L574-I578 HydrophobicContact CD2-CD1 4.38Å; L574-I578 HydrophobicContact CG-CD1 3.81Å; L574-I578 HydrophobicContact CG-CG1 4.5Å; L574-I578 WeakPolarHBondContact O-CB 3.3Å; L574-I578 VanDerWaalsContact O-CG1 3.29Å; L574-I578 WeakPolarHBondContact O-CG1 3.44Å; L574-I578 PolarHBondContact O-N 2.93Å; L574-V670 HydrophobicContact CD1-CG1 4.19Å; L574-K673 HydrophobicContact CD1-CB 4.07Å; L574-A674 HydrophobicContact CD2-CB 4.25Å; L574-I677 HydrophobicContact CB-CD1 3.91Å; L574-I677 HydrophobicContact CD2-CD1 3.78Å; L574-I677 HydrophobicContact CG-CD1 4.38Å
575	L	97.1	Very high	95.2	Very high	107 Å²	107	42.2 Å²	42.2	56%	0.56	22%	0.217	S	C	*	.	H	α-helix	trans	-62.2	-45.5	179.6	-68.2	176.8	0	0	0	111.7	V571 I572 G577 I578 L579	V571-L575 HydrophobicContact CG1-CD1 3.86Å; V571-L575 HydrophobicContact CG1-CG 4.24Å; V571-L575 WeakPolarHBondContact O-CG 3.09Å; V571-L575 PolarHBondContact O-N 3.22Å; I572-L575 PolarHBondContact O-N 2.97Å; L575-G577 PolarHBondContact O-N 2.72Å; L575-I578 PolarHBondContact O-N 2.98Å; L575-L579 VanDerWaalsContact O-CB 3.31Å; L575-L579 WeakPolarHBondContact O-CB 3.2Å; L575-L579 PolarHBondContact O-N 3.37Å
576	L	96.6	Very high	94.8	Very high	36 Å²	36	46.8 Å²	46.8	19%	0.188	24%	0.239	C	C	.	.	H	α-helix	trans	-59.5	-46.5	176.3	-74.5	173.2	0	0	0	111.7	L23 V496 I572 L579 F580	L23-L576 HydrophobicContact CD2-CD2 4.47Å; V496-L576 HydrophobicContact CG1-CB 4.48Å; I572-L576 HydrophobicContact CG2-CD1 3.76Å; I572-L576 HydrophobicContact CG2-CG 4.32Å; I572-L576 WeakPolarHBondContact O-CB 3.2Å; I572-L576 VanDerWaalsContact O-CG 3.27Å; I572-L576 WeakPolarHBondContact O-CG 3.24Å; I572-L576 PolarHBondContact O-N 3.11Å; L576-L579 WeakPolarHBondContact O-CB 3.47Å; L576-L579 PolarHBondContact O-N 3.03Å; L576-F580 WeakPolarHBondContact O-CD2 3.28Å; L576-F580 PolarHBondContact O-N 3.01Å; L576-F580 VanDerWaalsContact O-N 3.12Å
577	G	95.5	Very high	94.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-41.8	178.9	0	0	0	0	0	112.8	Y573 L574 L575 F580 L581	Y573-G577 PolarHBondContact O-N 3.48Å; L574-G577 PolarHBondContact O-N 3.13Å; L575-G577 PolarHBondContact O-N 2.72Å; G577-F580 PolarHBondContact O-N 3.22Å; G577-L581 WeakPolarHBondContact O-CB 3.32Å; G577-L581 WeakPolarHBondContact O-CG 3.39Å; G577-L581 PolarHBondContact O-N 3.27Å
578	I	95.6	Very high	93.7	Very high	49 Å²	49	48.6 Å²	48.6	25%	0.251	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-44.7	174.4	-70.1	170.6	0	0	0	110.5	W495 L574 L575 F580 L581 L582 V670	W495-I578 HydrophobicContact CH2-CG1 4.45Å; L574-I578 HydrophobicContact CD1-CD1 4.05Å; L574-I578 HydrophobicContact CD1-CG1 4.43Å; L574-I578 HydrophobicContact CD2-CD1 4.38Å; L574-I578 HydrophobicContact CG-CD1 3.81Å; L574-I578 HydrophobicContact CG-CG1 4.5Å; L574-I578 WeakPolarHBondContact O-CB 3.3Å; L574-I578 VanDerWaalsContact O-CG1 3.29Å; L574-I578 WeakPolarHBondContact O-CG1 3.44Å; L574-I578 PolarHBondContact O-N 2.93Å; L575-I578 PolarHBondContact O-N 2.98Å; I578-F580 PolarHBondContact O-N 2.98Å; I578-L581 PolarHBondContact O-N 3.47Å; I578-L582 HydrophobicContact CG2-CD1 3.62Å; I578-L582 HydrophobicContact CG2-CG 3.97Å; I578-L582 WeakPolarHBondContact O-CB 3.4Å; I578-L582 VanDerWaalsContact O-CG 3.3Å; I578-L582 WeakPolarHBondContact O-CG 3.46Å; I578-L582 PolarHBondContact O-N 3.01Å; I578-V670 HydrophobicContact CD1-CG1 3.96Å; I578-V670 HydrophobicContact CG1-CG1 4.26Å; I578-V670 HydrophobicContact CG1-CG2 4.15Å
579	L	95.2	Very high	93.1	Very high	57 Å²	57	48.2 Å²	48.2	30%	0.298	25%	0.249	S	C	.	.	H	α-helix	trans	-55.1	-54.4	177.5	174.2	68	0	0	0	111.3	I22 L575 L576 L581 L582 V583	I22-L579 HydrophobicContact CD1-CD2 4.15Å; I22-L579 HydrophobicContact CG2-CD2 3.86Å; L575-L579 VanDerWaalsContact O-CB 3.31Å; L575-L579 WeakPolarHBondContact O-CB 3.2Å; L575-L579 PolarHBondContact O-N 3.37Å; L576-L579 WeakPolarHBondContact O-CB 3.47Å; L576-L579 PolarHBondContact O-N 3.03Å; L579-L581 VanDerWaalsContact C-N 3.29Å; L579-L581 PolarHBondContact O-N 2.98Å; L579-L582 PolarHBondContact O-N 3.19Å; L579-V583 HydrophobicContact CD1-CG2 4.19Å; L579-V583 VanDerWaalsContact O-CG2 3.26Å; L579-V583 WeakPolarHBondContact O-CG2 2.92Å; L579-V583 PolarHBondContact O-N 2.79Å
580	F	94.6	Very high	92.6	Very high	28 Å²	28	49.7 Å²	49.7	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-62.2	-37.9	178.9	-74.2	-62.1	0	0	0	112.6	V19 A499 I500 F503 L576 G577 I578 G584	V19-F580 HydrophobicContact CG2-CZ 4.18Å; A499-F580 HydrophobicContact CB-CB 4.16Å; I500-F580 HydrophobicContact CD1-CD2 4.36Å; I500-F580 HydrophobicContact CD1-CE2 3.98Å; I500-F580 HydrophobicContact CD1-CZ 4.45Å; I500-F580 HydrophobicContact CG1-CD1 4.42Å; I500-F580 HydrophobicContact CG1-CD2 3.58Å; I500-F580 HydrophobicContact CG1-CE1 4.42Å; I500-F580 HydrophobicContact CG1-CE2 3.6Å; I500-F580 HydrophobicContact CG1-CG 4.03Å; I500-F580 HydrophobicContact CG1-CZ 4.04Å; F503-F580 HydrophobicContact CB-CB 4.13Å; F503-F580 HydrophobicContact CB-CD1 4.25Å; F503-F580 AromaticContact CD1-CD1 3.73Å; F503-F580 HydrophobicContact CD1-CD1 3.73Å; F503-F580 HydrophobicContact CD1-CE1 4.17Å; F503-F580 HydrophobicContact CE1-CD1 4.25Å; F503-F580 HydrophobicContact CE1-CE1 4.36Å; F503-F580 AromaticContact CG-CD1 3.9Å; F503-F580 HydrophobicContact CG-CD1 3.9Å; L576-F580 WeakPolarHBondContact O-CD2 3.28Å; L576-F580 PolarHBondContact O-N 3.01Å; L576-F580 VanDerWaalsContact O-N 3.12Å; G577-F580 PolarHBondContact O-N 3.22Å; I578-F580 PolarHBondContact O-N 2.98Å; F580-G584 PolarHBondContact O-N 2.85Å
581	L	92.7	Very high	91.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-41.2	177.6	-81.6	177.7	0	0	0	112.8	W495 A499 W502 G577 I578 L579 F585 M667 V670	W495-L581 HydrophobicContact CH2-CD1 4.48Å; W495-L581 HydrophobicContact CZ2-CD1 3.74Å; A499-L581 HydrophobicContact CB-CD1 4.47Å; A499-L581 HydrophobicContact CB-CD2 4.29Å; A499-L581 HydrophobicContact CB-CG 3.88Å; W502-L581 HydrophobicContact CD2-CD2 4.38Å; W502-L581 HydrophobicContact CE3-CD2 3.84Å; W502-L581 HydrophobicContact CZ3-CD2 4.05Å; W502-L581 WeakPolarHBondContact CZ3-O 3.26Å; G577-L581 WeakPolarHBondContact O-CB 3.32Å; G577-L581 WeakPolarHBondContact O-CG 3.39Å; G577-L581 PolarHBondContact O-N 3.27Å; I578-L581 PolarHBondContact O-N 3.47Å; L579-L581 VanDerWaalsContact C-N 3.29Å; L579-L581 PolarHBondContact O-N 2.98Å; L581-F585 VanDerWaalsContact O-CB 3.26Å; L581-F585 WeakPolarHBondContact O-CB 3.35Å; L581-F585 PolarHBondContact O-N 3.34Å; L581-M667 HydrophobicContact CB-CE 3.46Å; L581-M667 VanDerWaalsContact CB-CE 3.46Å; L581-M667 HydrophobicContact CB-SD 3.9Å; L581-M667 HydrophobicContact CD1-CE 4.37Å; L581-M667 HydrophobicContact CD1-SD 3.81Å; L581-M667 HydrophobicContact CD2-CE 4.19Å; L581-M667 HydrophobicContact CG-CE 4.21Å; L581-M667 HydrophobicContact CG-SD 4.3Å; L581-V670 HydrophobicContact CD1-CG2 4.48Å
582	L	91.7	Very high	90.8	Very high	103 Å²	103	54.7 Å²	54.7	54%	0.539	28%	0.277	S	S	.	.	H	α-helix	trans	-69.1	-46.1	176.6	-71.4	176.7	0	0	0	111.5	I578 L579 G584 F585 H586	I578-L582 HydrophobicContact CG2-CD1 3.62Å; I578-L582 HydrophobicContact CG2-CG 3.97Å; I578-L582 WeakPolarHBondContact O-CB 3.4Å; I578-L582 VanDerWaalsContact O-CG 3.3Å; I578-L582 WeakPolarHBondContact O-CG 3.46Å; I578-L582 PolarHBondContact O-N 3.01Å; L579-L582 PolarHBondContact O-N 3.19Å; L582-G584 PolarHBondContact O-N 3.46Å; L582-F585 PolarHBondContact O-N 3.48Å; L582-H586 WeakPolarHBondContact O-CB 3.36Å; L582-H586 PolarHBondContact O-N 3.38Å
583	V	92.2	Very high	90	Very high	62 Å²	62	53.6 Å²	53.6	38%	0.376	28%	0.276	S	S	.	.	H	α-helix	trans	-62.3	-45.3	178.2	-179.7	0	0	0	0	110.4	F503 L579 F585 H586 S587	F503-V583 HydrophobicContact CD2-CB 4.23Å; F503-V583 HydrophobicContact CD2-CG1 4.02Å; F503-V583 HydrophobicContact CE2-CB 4.14Å; F503-V583 HydrophobicContact CE2-CG1 3.48Å; F503-V583 VanDerWaalsContact CE2-CG1 3.48Å; F503-V583 HydrophobicContact CZ-CG1 4.43Å; L579-V583 HydrophobicContact CD1-CG2 4.19Å; L579-V583 VanDerWaalsContact O-CG2 3.26Å; L579-V583 WeakPolarHBondContact O-CG2 2.92Å; L579-V583 PolarHBondContact O-N 2.79Å; V583-F585 VanDerWaalsContact C-N 3.29Å; V583-F585 PolarHBondContact O-N 3.28Å; V583-H586 PolarHBondContact O-N 3.1Å; V583-S587 PolarHBondContact O-N 2.79Å; V583-S587 PolarHBondContact O-OG 3.17Å
584	G	89.1	Confident	89.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-34.2	176.3	0	0	0	0	0	113.1	W502 S507 F580 L582 L588	W502-G584 VanDerWaalsContact CZ3-C 3.46Å; S507-G584 WeakPolarHBondContact OG-CA 3.26Å; F580-G584 PolarHBondContact O-N 2.85Å; L582-G584 PolarHBondContact O-N 3.46Å; G584-L588 WeakPolarHBondContact O-CG 3.22Å; G584-L588 PolarHBondContact O-N 3.16Å; G584-L588 VanDerWaalsContact O-N 3.1Å
585	F	88.2	Confident	88.3	Confident	103 Å²	103	59.6 Å²	59.6	45%	0.452	31%	0.309	S	S	.	.	H	α-helix	trans	-71.9	-43.2	178.6	-166.6	-106.2	0	0	0	111.3	W502 L581 L582 V583 S587 L588 I589	W502-F585 HydrophobicContact CH2-CB 3.97Å; L581-F585 VanDerWaalsContact O-CB 3.26Å; L581-F585 WeakPolarHBondContact O-CB 3.35Å; L581-F585 PolarHBondContact O-N 3.34Å; L582-F585 PolarHBondContact O-N 3.48Å; V583-F585 VanDerWaalsContact C-N 3.29Å; V583-F585 PolarHBondContact O-N 3.28Å; F585-S587 VanDerWaalsContact C-N 3.34Å; F585-S587 PolarHBondContact O-N 3.14Å; F585-L588 PolarHBondContact O-N 3.48Å; F585-I589 HydrophobicContact CD1-CD1 3.55Å; F585-I589 HydrophobicContact CD1-CG1 4.36Å; F585-I589 HydrophobicContact CE1-CD1 3.23Å; F585-I589 HydrophobicContact CE1-CG1 4.2Å; F585-I589 HydrophobicContact CG-CD1 4.47Å; F585-I589 HydrophobicContact CZ-CD1 3.91Å; F585-I589 WeakPolarHBondContact O-CG1 3.45Å; F585-I589 PolarHBondContact O-N 2.86Å
586	H	88.6	Confident	87.4	Confident	133 Å²	133	61.4 Å²	61.4	62%	0.616	31%	0.313	S	S	*	.	H	α-helix	trans	-58.7	-44.9	174.2	-177.1	-95.6	0	0	0	111.4	L582 V583 L588 I589 S590	L582-H586 WeakPolarHBondContact O-CB 3.36Å; L582-H586 PolarHBondContact O-N 3.38Å; V583-H586 PolarHBondContact O-N 3.1Å; H586-L588 PolarHBondContact O-N 3.35Å; H586-I589 PolarHBondContact O-N 3.16Å; H586-S590 WeakPolarHBondContact O-CB 3.17Å; H586-S590 PolarHBondContact O-N 2.92Å
587	S	86.9	Confident	86.4	Confident	35 Å²	35	65.7 Å²	65.7	25%	0.245	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-42.5	175.6	-62.4	0	0	0	0	112.8	S507 V583 F585 S590 L591	S507-S587 WeakPolarHBondContact CB-OG 3.48Å; S507-S587 WeakPolarHBondContact OG-CB 3.44Å; S507-S587 PolarHBondContact OG-OG 3.31Å; V583-S587 PolarHBondContact O-N 2.79Å; V583-S587 PolarHBondContact O-OG 3.17Å; F585-S587 VanDerWaalsContact C-N 3.34Å; F585-S587 PolarHBondContact O-N 3.14Å; S587-S590 PolarHBondContact O-N 2.87Å; S587-L591 WeakPolarHBondContact O-CB 3.14Å; S587-L591 PolarHBondContact O-N 3.04Å
588	L	82.6	Confident	85.3	Confident	21 Å²	21	71.8 Å²	71.8	11%	0.11	36%	0.36	C	S	.	.	H	α-helix	trans	-66.2	-40.2	177.3	-72.8	171.2	0	0	0	112.5	W502 A506 G584 F585 H586 R592	W502-L588 HydrophobicContact CH2-CD1 4.06Å; W502-L588 HydrophobicContact CZ2-CD1 3.41Å; W502-L588 VanDerWaalsContact CZ2-CD1 3.41Å; A506-L588 HydrophobicContact CB-CD1 3.96Å; A506-L588 HydrophobicContact CB-CD2 3.97Å; A506-L588 HydrophobicContact CB-CG 3.83Å; G584-L588 WeakPolarHBondContact O-CG 3.22Å; G584-L588 PolarHBondContact O-N 3.16Å; G584-L588 VanDerWaalsContact O-N 3.1Å; F585-L588 PolarHBondContact O-N 3.48Å; H586-L588 PolarHBondContact O-N 3.35Å; L588-R592 WeakPolarHBondContact O-CB 3.32Å; L588-R592 VanDerWaalsContact O-CG 3.3Å; L588-R592 WeakPolarHBondContact O-CG 3.41Å; L588-R592 PolarHBondContact O-N 2.91Å; L588-R592 VanDerWaalsContact O-N 3.09Å
589	I	84.5	Confident	84.4	Confident	90 Å²	90	73.8 Å²	73.8	46%	0.462	37%	0.374	S	S	.	.	H	α-helix	trans	-66.3	-48	176.3	-70.6	175	0	0	0	110.2	F585 H586 L591 R592 S593	F585-I589 HydrophobicContact CD1-CD1 3.55Å; F585-I589 HydrophobicContact CD1-CG1 4.36Å; F585-I589 HydrophobicContact CE1-CD1 3.23Å; F585-I589 HydrophobicContact CE1-CG1 4.2Å; F585-I589 HydrophobicContact CG-CD1 4.47Å; F585-I589 HydrophobicContact CZ-CD1 3.91Å; F585-I589 WeakPolarHBondContact O-CG1 3.45Å; F585-I589 PolarHBondContact O-N 2.86Å; H586-I589 PolarHBondContact O-N 3.16Å; I589-L591 VanDerWaalsContact C-N 3.35Å; I589-L591 PolarHBondContact O-N 3.33Å; I589-R592 PolarHBondContact O-N 3.43Å; I589-S593 WeakPolarHBondContact O-CB 3.45Å; I589-S593 PolarHBondContact O-N 2.72Å; I589-S593 PolarHBondContact O-OG 2.9Å
590	S	86.2	Confident	83.5	Confident	46 Å²	46	78.6 Å²	78.6	32%	0.322	39%	0.393	S	S	.	.	H	α-helix	trans	-56.2	-49.9	178.9	-179.2	0	0	0	0	110.7	H586 S587 R592 S593 N594	H586-S590 WeakPolarHBondContact O-CB 3.17Å; H586-S590 PolarHBondContact O-N 2.92Å; S587-S590 PolarHBondContact O-N 2.87Å; S590-R592 PolarHBondContact O-N 2.92Å; S590-S593 WeakPolarHBondContact CA-OG 3.19Å; S590-S593 PolarHBondContact O-N 3.23Å; S590-S593 VanDerWaalsContact O-N 3.16Å; S590-S593 PolarHBondContact O-OG 3.48Å; S590-N594 PolarHBondContact O-N 3.33Å; S590-N594 PolarHBondContact O-ND2 3.14Å; S590-N594 VanDerWaalsContact O-ND2 3.09Å
591	L	77.9	Confident	82.4	Confident	72 Å²	72	81.7 Å²	81.7	38%	0.377	42%	0.418	S	S	.	.	H	α-helix	trans	-58.1	-45	177.2	-178	62.4	0	0	0	112.4	S587 I589 L595	S587-L591 WeakPolarHBondContact O-CB 3.14Å; S587-L591 PolarHBondContact O-N 3.04Å; I589-L591 VanDerWaalsContact C-N 3.35Å; I589-L591 PolarHBondContact O-N 3.33Å; L591-L595 HydrophobicContact CD1-CD1 4.28Å; L591-L595 HydrophobicContact CG-CD1 4.08Å; L591-L595 WeakPolarHBondContact O-CB 3.42Å; L591-L595 WeakPolarHBondContact O-CD1 3.43Å; L591-L595 VanDerWaalsContact O-CG 3.3Å; L591-L595 WeakPolarHBondContact O-CG 3.2Å; L591-L595 PolarHBondContact O-N 3.48Å
592	R	80.2	Confident	81.1	Confident	90 Å²	90	88.5 Å²	88.5	34%	0.34	45%	0.453	S	S	.	.	H	α-helix	trans	-68.2	-35.2	178.3	-75.1	179.4	177.5	-178.2	5	112.8	L588 I589 S590 K596 D656 I660	L588-R592 WeakPolarHBondContact O-CB 3.32Å; L588-R592 VanDerWaalsContact O-CG 3.3Å; L588-R592 WeakPolarHBondContact O-CG 3.41Å; L588-R592 PolarHBondContact O-N 2.91Å; L588-R592 VanDerWaalsContact O-N 3.09Å; I589-R592 PolarHBondContact O-N 3.43Å; S590-R592 PolarHBondContact O-N 2.92Å; R592-K596 WeakPolarHBondContact O-CB 3.45Å; R592-K596 VanDerWaalsContact O-CG 3.27Å; R592-K596 WeakPolarHBondContact O-CG 3.39Å; R592-K596 PolarHBondContact O-N 2.92Å; R592-D656 IonicContact NH2-OD1 2.82Å; R592-I660 VanDerWaalsContact NH1-CD1 3.3Å; R592-I660 VanDerWaalsContact NH2-CD1 3.26Å
593	S	80.9	Confident	79.3	Confident	47 Å²	47	89.2 Å²	89.2	33%	0.329	46%	0.457	S	S	.	.	H	α-helix	trans	-66.8	-44.7	177.7	71.9	0	0	0	0	111.1	I589 S590 K596 Q597	I589-S593 WeakPolarHBondContact O-CB 3.45Å; I589-S593 PolarHBondContact O-N 2.72Å; I589-S593 PolarHBondContact O-OG 2.9Å; S590-S593 WeakPolarHBondContact CA-OG 3.19Å; S590-S593 PolarHBondContact O-N 3.23Å; S590-S593 VanDerWaalsContact O-N 3.16Å; S590-S593 PolarHBondContact O-OG 3.48Å; S593-K596 PolarHBondContact O-N 3.5Å; S593-Q597 WeakPolarHBondContact O-CG 3.45Å; S593-Q597 PolarHBondContact O-N 3.04Å
594	N	81.2	Confident	77.4	Confident	72 Å²	72	92 Å²	92	39%	0.385	48%	0.477	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176.7	-67.4	-35.6	0	0	0	111.7	S590 K596 Q597 H598	S590-N594 PolarHBondContact O-N 3.33Å; S590-N594 PolarHBondContact O-ND2 3.14Å; S590-N594 VanDerWaalsContact O-ND2 3.09Å; N594-K596 PolarHBondContact O-N 3.27Å; N594-Q597 PolarHBondContact O-N 3.45Å; N594-H598 PolarHBondContact O-CD2 2.98Å; N594-H598 PolarHBondContact O-N 3.31Å
595	L	76.5	Confident	75.4	Confident	100 Å²	100	98 Å²	98	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-62.7	-41.2	174.5	-74.2	165.6	0	0	0	112	L591 V599	L591-L595 HydrophobicContact CD1-CD1 4.28Å; L591-L595 HydrophobicContact CG-CD1 4.08Å; L591-L595 WeakPolarHBondContact O-CB 3.42Å; L591-L595 WeakPolarHBondContact O-CD1 3.43Å; L591-L595 VanDerWaalsContact O-CG 3.3Å; L591-L595 WeakPolarHBondContact O-CG 3.2Å; L591-L595 PolarHBondContact O-N 3.48Å; L595-V599 VanDerWaalsContact O-CG2 3.28Å; L595-V599 WeakPolarHBondContact O-CG2 3.4Å; L595-V599 PolarHBondContact O-N 3.36Å
596	K	78.4	Confident	73.2	Confident	145 Å²	145	97.6 Å²	97.6	63%	0.63	53%	0.528	S	S	*	.	H	α-helix	trans	-66.1	-37.2	176.3	-78.1	178	179.7	-175.4	0	112.3	R592 S593 N594 V599 K600	R592-K596 WeakPolarHBondContact O-CB 3.45Å; R592-K596 VanDerWaalsContact O-CG 3.27Å; R592-K596 WeakPolarHBondContact O-CG 3.39Å; R592-K596 PolarHBondContact O-N 2.92Å; S593-K596 PolarHBondContact O-N 3.5Å; N594-K596 PolarHBondContact O-N 3.27Å; K596-V599 PolarHBondContact O-N 3.47Å; K596-K600 WeakPolarHBondContact O-CB 3.47Å; K596-K600 WeakPolarHBondContact O-CG 3.46Å; K596-K600 PolarHBondContact O-N 3.16Å
597	Q	75.1	Confident	70.8	Confident	126 Å²	126	98 Å²	98	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-66.2	-46.4	176.5	-75.9	177.6	-7.5	0	0	111.3	S593 N594 V599 K600 S601	S593-Q597 WeakPolarHBondContact O-CG 3.45Å; S593-Q597 PolarHBondContact O-N 3.04Å; N594-Q597 PolarHBondContact O-N 3.45Å; Q597-V599 VanDerWaalsContact C-N 3.31Å; Q597-V599 PolarHBondContact O-N 3.28Å; Q597-K600 PolarHBondContact O-N 3.47Å; Q597-K600 VanDerWaalsContact O-N 3.15Å; Q597-S601 PolarHBondContact O-N 3.11Å; Q597-S601 PolarHBondContact O-OG 3.41Å
598	H	73.4	Confident	68.7	Low	129 Å²	129	102.2 Å²	102.2	60%	0.597	56%	0.56	S	S	*	*	H	α-helix	trans	-60.8	-37.8	175.1	-80.3	-57.8	0	0	0	113.1	N594 S601 L602	N594-H598 PolarHBondContact O-CD2 2.98Å; N594-H598 PolarHBondContact O-N 3.31Å; H598-S601 PolarHBondContact O-OG 3.46Å; H598-L602 VanDerWaalsContact O-CD1 3.32Å; H598-L602 WeakPolarHBondContact O-CD1 3.35Å; H598-L602 VanDerWaalsContact O-CG 3.26Å; H598-L602 WeakPolarHBondContact O-CG 3.4Å; H598-L602 PolarHBondContact O-N 3.29Å
599	V	76.8	Confident	66.7	Low	91 Å²	91	106.8 Å²	106.8	55%	0.552	59%	0.589	S	S	*	*	H	α-helix	trans	-69.6	-36.9	175.5	173.2	0	0	0	0	111.6	L595 K596 Q597 L602	L595-V599 VanDerWaalsContact O-CG2 3.28Å; L595-V599 WeakPolarHBondContact O-CG2 3.4Å; L595-V599 PolarHBondContact O-N 3.36Å; K596-V599 PolarHBondContact O-N 3.47Å; Q597-V599 VanDerWaalsContact C-N 3.31Å; Q597-V599 PolarHBondContact O-N 3.28Å; V599-L602 PolarHBondContact O-N 2.96Å
600	K	75.2	Confident	64.4	Low	158 Å²	158	109.3 Å²	109.3	69%	0.687	61%	0.608	S	S	*	*	H	α-helix	trans	-69.4	-38.6	176.5	-78	-177.7	179.2	-171	0	112.9	K596 Q597 L602 L603	K596-K600 WeakPolarHBondContact O-CB 3.47Å; K596-K600 WeakPolarHBondContact O-CG 3.46Å; K596-K600 PolarHBondContact O-N 3.16Å; Q597-K600 PolarHBondContact O-N 3.47Å; Q597-K600 VanDerWaalsContact O-N 3.15Å; K600-L602 PolarHBondContact O-N 3.38Å; K600-L603 PolarHBondContact O-N 3.07Å; K600-L603 VanDerWaalsContact O-N 3.12Å
601	S	71.3	Confident	62	Low	93 Å²	93	110.6 Å²	110.6	65%	0.65	63%	0.629	S	S	*	*	H	α-helix	trans	-67.2	-21.2	176.8	60.7	0	0	0	0	112.9	Q597 H598	Q597-S601 PolarHBondContact O-N 3.11Å; Q597-S601 PolarHBondContact O-OG 3.41Å; H598-S601 PolarHBondContact O-OG 3.46Å
602	L	67.2	Low	60	Low	142 Å²	142	115 Å²	115	74%	0.743	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.7	175.2	-69.8	166.1	0	0	0	113.1	H598 V599 K600	H598-L602 VanDerWaalsContact O-CD1 3.32Å; H598-L602 WeakPolarHBondContact O-CD1 3.35Å; H598-L602 VanDerWaalsContact O-CG 3.26Å; H598-L602 WeakPolarHBondContact O-CG 3.4Å; H598-L602 PolarHBondContact O-N 3.29Å; V599-L602 PolarHBondContact O-N 2.96Å; K600-L602 PolarHBondContact O-N 3.38Å
603	L	53.8	Low	57.8	Low	118 Å²	118	115.1 Å²	115.1	62%	0.618	67%	0.672	S	S	*	*	S	Bend	trans	-96	117.7	175.5	-72.3	165.7	0	0	0	109.5	K600 V605	K600-L603 PolarHBondContact O-N 3.07Å; K600-L603 VanDerWaalsContact O-N 3.12Å; L603-V605 PolarHBondContact O-N 2.98Å
604	P	51.1	Low	55.6	Low	121 Å²	121	120.3 Å²	120.3	79%	0.786	70%	0.697	S	S	*	*			trans	-67.5	130.9	-178.8	25.6	-31.1	0	0	0	111.3	A606	P604-A606 PolarHBondContact O-N 3.47Å; P604-A606 VanDerWaalsContact O-N 3.1Å
605	V	48.3	Very low	53.2	Low	127 Å²	127	122.7 Å²	122.7	77%	0.77	72%	0.717	S	S	*	*			trans	-66.2	100.5	169.3	175.7	0	0	0	0	108.2	L603 N607	L603-V605 PolarHBondContact O-N 2.98Å; V605-N607 HydrophobicContact CG1-CB 4.49Å; V605-N607 PolarHBondContact O-N 3.17Å
606	A	41.9	Very low	51	Low	93 Å²	93	128.3 Å²	128.3	77%	0.769	73%	0.733	S	S	*	*			trans	-91.3	83.8	169	0	0	0	0	0	109.5	P604 T608	P604-A606 PolarHBondContact O-N 3.47Å; P604-A606 VanDerWaalsContact O-N 3.1Å; A606-T608 PolarHBondContact O-N 2.88Å
607	N	38.2	Very low	48.7	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	74%	0.743	S	S	*	*			trans	-87.1	85.2	162	-87.8	-4.7	0	0	0	108.8	V605	V605-N607 HydrophobicContact CG1-CB 4.49Å; V605-N607 PolarHBondContact O-N 3.17Å
608	T	41.8	Very low	46.7	Very low	124 Å²	124	128.2 Å²	128.2	76%	0.761	75%	0.753	S	S	*	*			trans	-168.3	116.7	151.8	8.8	0	0	0	0	110.3	A606	A606-T608 PolarHBondContact O-N 2.88Å
609	T	41	Very low	44.9	Very low	116 Å²	116	131 Å²	131	71%	0.712	77%	0.766	S	S	*	*			trans	50.4	108.6	142	49.5	0	0	0	0	119.4
610	T	35.4	Very low	42.8	Very low	143 Å²	143	137.2 Å²	137.2	88%	0.877	79%	0.786	S	S	*	*	S	Bend	trans	55.7	106.6	139.3	53	0	0	0	0	118.1
611	G	36.2	Very low	40.8	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	79%	0.789	S	S	*	*			trans	127.7	45.2	149.3	0	0	0	0	0	117.7
612	L	36.5	Very low	39.1	Very low	164 Å²	164	142.8 Å²	142.8	86%	0.859	79%	0.793	S	S	*	*			trans	-155.7	42.2	163.7	-101.5	142.9	0	0	0	112.5	N614	L612-N614 PolarHBondContact O-N 3.41Å
613	A	32.7	Very low	37.5	Very low	93 Å²	93	142.5 Å²	142.5	77%	0.769	79%	0.792	S	S	*	*			trans	-91.6	80.3	157.3	0	0	0	0	0	107.1
614	N	35.1	Very low	36.7	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	80%	0.798	S	S	*	*			trans	177.8	66.9	164	-88.2	-17.4	0	0	0	110.1	L612	L612-N614 PolarHBondContact O-N 3.41Å
615	C	31.7	Very low	35.8	Very low	122 Å²	122	142.3 Å²	142.3	82%	0.824	80%	0.798	S	S	*	*			trans	-154.4	52.4	160.4	-124.1	0	0	0	0	110.3
616	Y	30.4	Very low	35.4	Very low	218 Å²	218	140.6 Å²	140.6	86%	0.855	80%	0.797	S	S	*	*	S	Bend	trans	-136.2	57.7	168.4	-161.8	-93.8	0	0	0	109.4
617	N	29.5	Very low	35.1	Very low	156 Å²	156	142 Å²	142	83%	0.834	80%	0.796	S	S	*	*	S	Bend	trans	175	147.2	152.9	-107.2	-37.9	0	0	0	108.6
618	S	32.8	Very low	35	Very low	113 Å²	113	142.7 Å²	142.7	79%	0.79	80%	0.799	S	S	*	*	S	Bend	trans	78.7	94.1	178.3	-162.5	0	0	0	0	114.6
619	Q	35.5	Very low	34.9	Very low	187 Å²	187	140.7 Å²	140.7	87%	0.874	80%	0.795	S	S	*	*				-178.5	-7.8	125.4	-98.8	-160.6	5.3	0	0	115	K621	Q619-K621 VanDerWaalsContact C-N 3.26Å; Q619-K621 PolarHBondContact O-N 3.36Å
620	F	33.8	Very low	34.9	Very low	222 Å²	222	141.1 Å²	141.1	97%	0.974	80%	0.798	S	S	*	*			trans	-87	61.4	177.4	-147.6	-97.8	0	0	0	112.8
621	K	32.7	Very low	35.2	Very low	171 Å²	171	139 Å²	139	74%	0.743	79%	0.789	S	S	*	*			trans	-146.1	111.6	167.5	-143.2	-178.5	-171.9	-178.2	0	109.5	Q619	Q619-K621 VanDerWaalsContact C-N 3.26Å; Q619-K621 PolarHBondContact O-N 3.36Å
622	R	35.2	Very low	35.5	Very low	196 Å²	196	141.8 Å²	141.8	74%	0.74	79%	0.792	S	S	*	*			trans	88.9	114.4	159.5	-71	179.1	-83.9	-173.2	-4.5	118.9
623	N	33.8	Very low	35.8	Very low	136 Å²	136	140 Å²	140	73%	0.727	79%	0.788	S	S	*	*				88.9	118.3	117.9	-70	4.8	0	0	0	120.7
624	V	36.8	Very low	36.2	Very low	123 Å²	123	140.7 Å²	140.7	75%	0.745	79%	0.785	S	S	*	*				85.2	109.5	123.8	178.9	0	0	0	0	117.8
625	S	33.8	Very low	36.6	Very low	112 Å²	112	141 Å²	141	78%	0.783	78%	0.784	S	S	*	*			trans	37.7	118.1	134.9	-46.9	0	0	0	0	120.3
626	A	38.4	Very low	36.8	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	79%	0.787	S	S	*	*				162.9	111.7	118.8	0	0	0	0	0	112.9
627	T	35.8	Very low	37.3	Very low	123 Å²	123	139.2 Å²	139.2	76%	0.755	78%	0.782	S	S	*	*				60.1	128.7	118.4	-35.8	0	0	0	0	123.6
628	L	36.8	Very low	37.4	Very low	156 Å²	156	138.6 Å²	138.6	82%	0.817	78%	0.783	S	S	*	*			trans	73.7	110.2	152	-101.7	63.9	0	0	0	119.4
629	A	40.1	Very low	37.8	Very low	82 Å²	82	139.2 Å²	139.2	68%	0.678	78%	0.783	S	S	*	*				71.6	126.5	89.8	0	0	0	0	0	112.3
630	T	39.5	Very low	37.6	Very low	125 Å²	125	139 Å²	139	77%	0.767	79%	0.787	S	S	*	*				-173.7	146.4	57.2	31.8	0	0	0	0	111.3
631	S	42.2	Very low	37.7	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	78%	0.779	S	S	*	*			trans	39.2	133.6	139.8	72.8	0	0	0	0	120.7
632	T	42.1	Very low	37.8	Very low	130 Å²	130	132 Å²	132	80%	0.798	78%	0.781	S	S	*	*			cis	-168.7	156.6	47.3	27	0	0	0	0	111.1
633	T	43.6	Very low	38	Very low	127 Å²	127	127.7 Å²	127.7	78%	0.779	78%	0.779	S	S	*	*			trans	-49	-177.3	177.5	46.7	0	0	0	0	118.6
634	P	41.3	Very low	38.4	Very low	108 Å²	108	127.8 Å²	127.8	70%	0.701	78%	0.784	S	S	*	*			cis	-141.4	-171.7	3.2	25.2	2.4	0	0	0	117.4
635	I	43.9	Very low	38.6	Very low	162 Å²	162	127.9 Å²	127.9	83%	0.831	78%	0.779	S	S	*	*			trans	103.7	113.3	152.9	-47.4	172	0	0	0	116.8
636	Q	35.2	Very low	38.8	Very low	190 Å²	190	128.3 Å²	128.3	89%	0.888	78%	0.779	S	S	*	*			trans	-139.3	132.2	172.3	-142.6	177.7	-1.4	0	0	111.5
637	P	39.9	Very low	38.9	Very low	114 Å²	114	129.5 Å²	129.5	74%	0.74	77%	0.772	S	S	*	*			trans	-89.5	151.1	175.7	32.6	-28.1	0	0	0	112.9
638	T	33.1	Very low	39.5	Very low	142 Å²	142	128.4 Å²	128.4	87%	0.871	76%	0.762	S	S	*	*			trans	-62.6	121.6	178.2	43.8	0	0	0	0	113.5
639	T	39.6	Very low	40.5	Very low	127 Å²	127	126.1 Å²	126.1	78%	0.779	75%	0.751	S	S	*	*			trans	-145.9	132.5	157.1	45.4	0	0	0	0	112.5
640	L	31.3	Very low	41.5	Very low	182 Å²	182	124.1 Å²	124.1	95%	0.953	74%	0.737	S	S	*	*			trans	-21.4	115.1	167.4	-140.2	75.4	0	0	0	115.6
641	T	35.9	Very low	42.7	Very low	132 Å²	132	122.5 Å²	122.5	81%	0.81	72%	0.724	S	S	*	*			trans	-130.3	103.1	168.3	49.3	0	0	0	0	111.2
642	S	35.2	Very low	43.9	Very low	113 Å²	113	121.3 Å²	121.3	79%	0.79	71%	0.709	S	S	*	*			trans	-68.4	131.1	154.8	-79	0	0	0	0	108.3	V644	S642-V644 PolarHBondContact O-N 2.66Å
643	P	40	Very low	45.2	Very low	107 Å²	107	122.6 Å²	122.6	70%	0.695	70%	0.7	S	S	*	*			trans	-79	111.2	-174.7	30.3	-30.8	0	0	0	110.3	I645	P643-I645 PolarHBondContact O-N 3.37Å
644	V	42.5	Very low	46.4	Very low	138 Å²	138	125.3 Å²	125.3	84%	0.836	70%	0.695	S	S	*	*			trans	-69.1	104.7	162.4	179.8	0	0	0	0	107.3	S642 P646	S642-V644 PolarHBondContact O-N 2.66Å; V644-P646 WeakPolarHBondContact O-CD 3.45Å
645	I	39.8	Very low	47.7	Very low	125 Å²	125	125.1 Å²	125.1	64%	0.641	69%	0.688	S	S	*	*			trans	-63.6	122.5	173	-62.7	170.1	0	0	0	107.9	P643 L647	P643-I645 PolarHBondContact O-N 3.37Å; I645-L647 PolarHBondContact O-N 2.82Å
646	P	38.7	Very low	49.1	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	66%	0.664	S	S	*	*			trans	-71	99	175.6	28.4	-30.8	0	0	0	108.7	V644 N648	V644-P646 WeakPolarHBondContact O-CD 3.45Å; P646-N648 PolarHBondContact O-N 3.26Å
647	L	40.5	Very low	51.3	Low	116 Å²	116	118 Å²	118	61%	0.607	65%	0.651	S	S	*	*			trans	-55.7	134.9	171.3	-133.6	75.8	0	0	0	109	I645 N649 I652	I645-L647 PolarHBondContact O-N 2.82Å; L647-N649 PolarHBondContact O-N 3.1Å; L647-N649 PolarHBondContact O-OD1 2.68Å; L647-I652 HydrophobicContact CB-CD1 4.45Å; L647-I652 HydrophobicContact CD2-CD1 3.28Å; L647-I652 HydrophobicContact CG-CD1 3.84Å
648	N	48.6	Very low	53.2	Low	100 Å²	100	115.3 Å²	115.3	54%	0.535	63%	0.63	S	S	.	*			trans	-63.4	83.4	178.1	-176.8	-6.7	0	0	0	110.8	P646 G650 N651	P646-N648 PolarHBondContact O-N 3.26Å; N648-G650 PolarHBondContact O-N 2.97Å; N648-G650 PolarHBondContact OD1-N 3.09Å; N648-N651 PolarHBondContact ND2-ND2 3.26Å; N648-N651 PolarHBondContact O-N 3.12Å
649	N	58.5	Low	55.5	Low	108 Å²	108	109.3 Å²	109.3	58%	0.578	59%	0.593	S	S	*	*	H	α-helix	trans	-59	-20.7	-175.6	-80.9	-22.7	0	0	0	112.9	L647 R653	L647-N649 PolarHBondContact O-N 3.1Å; L647-N649 PolarHBondContact O-OD1 2.68Å; N649-R653 WeakPolarHBondContact O-CB 3.36Å; N649-R653 PolarHBondContact O-N 3.05Å
650	G	60.9	Low	57.6	Low	39 Å²	39	106.5 Å²	106.5	40%	0.402	57%	0.572	S	S	.	*	H	α-helix	trans	-71.2	-48.8	-179.6	0	0	0	0	0	113.1	N648 R654	N648-G650 PolarHBondContact O-N 2.97Å; N648-G650 PolarHBondContact OD1-N 3.09Å; G650-R654 WeakPolarHBondContact O-CG 3.34Å; G650-R654 PolarHBondContact O-N 3.39Å; G650-R654 VanDerWaalsContact O-N 3.11Å
651	N	64.2	Low	60.1	Low	91 Å²	91	101.7 Å²	101.7	49%	0.487	54%	0.543	S	S	.	.	H	α-helix	trans	-72.7	-39.5	-176.9	-76.1	-15.1	0	0	0	112.1	N648 R653 R654 L655	N648-N651 PolarHBondContact ND2-ND2 3.26Å; N648-N651 PolarHBondContact O-N 3.12Å; N651-R653 VanDerWaalsContact C-N 3.34Å; N651-R653 PolarHBondContact O-N 2.99Å; N651-R654 PolarHBondContact O-N 3.36Å; N651-L655 PolarHBondContact O-N 3.27Å
652	I	67.7	Low	62.5	Low	75 Å²	75	95.5 Å²	95.5	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-62.6	-44.2	176	-62	170.7	0	0	0	110.2	L647 R654 L655 D656	L647-I652 HydrophobicContact CB-CD1 4.45Å; L647-I652 HydrophobicContact CD2-CD1 3.28Å; L647-I652 HydrophobicContact CG-CD1 3.84Å; I652-R654 VanDerWaalsContact C-N 3.28Å; I652-R654 PolarHBondContact O-N 3.07Å; I652-L655 PolarHBondContact O-N 3.29Å; I652-D656 WeakPolarHBondContact O-CB 3.46Å; I652-D656 PolarHBondContact O-N 3.34Å
653	R	68.5	Low	64.9	Low	158 Å²	158	90.3 Å²	90.3	60%	0.596	47%	0.469	S	S	*	.	H	α-helix	trans	-65.2	-30	177.1	-167	179.1	-59.7	-133.4	0.6	112.8	N649 N651 K657	N649-R653 WeakPolarHBondContact O-CB 3.36Å; N649-R653 PolarHBondContact O-N 3.05Å; N651-R653 VanDerWaalsContact C-N 3.34Å; N651-R653 PolarHBondContact O-N 2.99Å; R653-K657 VanDerWaalsContact O-CG 3.23Å; R653-K657 WeakPolarHBondContact O-CG 3.21Å; R653-K657 PolarHBondContact O-N 2.91Å
654	R	70.1	Confident	67.1	Low	183 Å²	183	88.8 Å²	88.8	69%	0.691	46%	0.458	S	S	*	.	H	α-helix	trans	-72.4	-43.5	173.9	-75.9	174.9	177.9	177.2	0.8	111.5	G650 N651 I652 K657 L658	G650-R654 WeakPolarHBondContact O-CG 3.34Å; G650-R654 PolarHBondContact O-N 3.39Å; G650-R654 VanDerWaalsContact O-N 3.11Å; N651-R654 PolarHBondContact O-N 3.36Å; I652-R654 VanDerWaalsContact C-N 3.28Å; I652-R654 PolarHBondContact O-N 3.07Å; R654-K657 PolarHBondContact O-N 3.01Å; R654-L658 PolarHBondContact O-N 3.15Å
655	L	68.2	Low	69.1	Low	105 Å²	105	85 Å²	85	55%	0.55	43%	0.43	S	S	.	.	H	α-helix	trans	-63.8	-44.4	176.9	-173.1	64	0	0	0	111.3	N651 I652 K657 L658 M659	N651-L655 PolarHBondContact O-N 3.27Å; I652-L655 PolarHBondContact O-N 3.29Å; L655-K657 VanDerWaalsContact C-N 3.31Å; L655-K657 PolarHBondContact O-N 3.02Å; L655-L658 PolarHBondContact O-N 3.06Å; L655-L658 VanDerWaalsContact O-N 3.15Å; L655-M659 HydrophobicContact CG-CG 4.47Å; L655-M659 WeakPolarHBondContact O-CB 3.26Å; L655-M659 WeakPolarHBondContact O-CG 3.38Å; L655-M659 PolarHBondContact O-N 3.3Å
656	D	73.3	Confident	71.3	Confident	62 Å²	62	79.1 Å²	79.1	33%	0.332	40%	0.4	S	S	.	.	H	α-helix	trans	-57.2	-43.6	174.4	-88.4	-32.2	0	0	0	112.4	R592 I652 M659 I660	R592-D656 IonicContact NH2-OD1 2.82Å; I652-D656 WeakPolarHBondContact O-CB 3.46Å; I652-D656 PolarHBondContact O-N 3.34Å; D656-M659 PolarHBondContact O-N 3.22Å; D656-I660 WeakPolarHBondContact O-CD1 3.44Å; D656-I660 WeakPolarHBondContact O-CG1 3.33Å; D656-I660 PolarHBondContact O-N 3.12Å
657	K	80.6	Confident	73.6	Confident	139 Å²	139	76.1 Å²	76.1	60%	0.604	38%	0.376	S	S	*	.	H	α-helix	trans	-63.2	-44	177	-77.9	175.8	-179.4	-172.6	0	111.2	R653 R654 L655 K661	R653-K657 VanDerWaalsContact O-CG 3.23Å; R653-K657 WeakPolarHBondContact O-CG 3.21Å; R653-K657 PolarHBondContact O-N 2.91Å; R654-K657 PolarHBondContact O-N 3.01Å; L655-K657 VanDerWaalsContact C-N 3.31Å; L655-K657 PolarHBondContact O-N 3.02Å; K657-K661 VanDerWaalsContact O-CB 3.3Å; K657-K661 WeakPolarHBondContact O-CB 3.24Å; K657-K661 PolarHBondContact O-N 3.44Å
658	L	79.4	Confident	75.9	Confident	59 Å²	59	75.1 Å²	75.1	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-46.3	177.2	-178.3	64.6	0	0	0	111.4	R654 L655 I660 K661 I662	R654-L658 PolarHBondContact O-N 3.15Å; L655-L658 PolarHBondContact O-N 3.06Å; L655-L658 VanDerWaalsContact O-N 3.15Å; L658-I660 PolarHBondContact O-N 3.25Å; L658-K661 WeakPolarHBondContact O-CA 3.3Å; L658-K661 WeakPolarHBondContact O-CB 3.39Å; L658-K661 PolarHBondContact O-N 3.3Å; L658-K661 VanDerWaalsContact O-N 3.08Å; L658-I662 HydrophobicContact CD1-CD1 4.24Å; L658-I662 HydrophobicContact CD1-CG1 4.44Å; L658-I662 HydrophobicContact CG-CD1 4.02Å; L658-I662 WeakPolarHBondContact O-CG1 3.18Å; L658-I662 PolarHBondContact O-N 3.09Å
659	M	81.6	Confident	78	Confident	16 Å²	16	70.8 Å²	70.8	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-41.7	179.9	-73.8	-60.7	-67.3	0	0	112.7	P398 W502 S505 A506 L655 D656 K661 A663	P398-M659 HydrophobicContact CG-SD 3.88Å; W502-M659 HydrophobicContact CG-CE 4.3Å; W502-M659 PolarHBondContact NE1-O 3.4Å; S505-M659 VanDerWaalsContact CB-CE 3.43Å; A506-M659 HydrophobicContact CB-CE 4.05Å; L655-M659 HydrophobicContact CG-CG 4.47Å; L655-M659 WeakPolarHBondContact O-CB 3.26Å; L655-M659 WeakPolarHBondContact O-CG 3.38Å; L655-M659 PolarHBondContact O-N 3.3Å; D656-M659 PolarHBondContact O-N 3.22Å; M659-K661 VanDerWaalsContact C-N 3.33Å; M659-A663 WeakPolarHBondContact O-CB 3.33Å; M659-A663 PolarHBondContact O-N 2.87Å
660	I	83.4	Confident	79.8	Confident	67 Å²	67	67 Å²	67	34%	0.344	33%	0.328	S	S	.	.	H	α-helix	trans	-62.6	-43.9	172	-64.3	164.5	0	0	0	110.1	R592 D656 L658 I662 A663 V664	R592-I660 VanDerWaalsContact NH1-CD1 3.3Å; R592-I660 VanDerWaalsContact NH2-CD1 3.26Å; D656-I660 WeakPolarHBondContact O-CD1 3.44Å; D656-I660 WeakPolarHBondContact O-CG1 3.33Å; D656-I660 PolarHBondContact O-N 3.12Å; L658-I660 PolarHBondContact O-N 3.25Å; I660-I662 VanDerWaalsContact C-N 3.35Å; I660-I662 PolarHBondContact O-N 2.86Å; I660-A663 WeakPolarHBondContact O-CB 3.5Å; I660-A663 PolarHBondContact O-N 3.24Å; I660-V664 HydrophobicContact CG2-CG2 4.2Å; I660-V664 WeakPolarHBondContact O-CG2 3.47Å; I660-V664 PolarHBondContact O-N 2.98Å
661	K	84.8	Confident	81.4	Confident	82 Å²	82	69.7 Å²	69.7	36%	0.357	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-45.5	-177.3	-149.2	-159.1	164.4	-137.4	0	110.5	K657 L658 M659 F665 W746	K657-K661 VanDerWaalsContact O-CB 3.3Å; K657-K661 WeakPolarHBondContact O-CB 3.24Å; K657-K661 PolarHBondContact O-N 3.44Å; L658-K661 WeakPolarHBondContact O-CA 3.3Å; L658-K661 WeakPolarHBondContact O-CB 3.39Å; L658-K661 PolarHBondContact O-N 3.3Å; L658-K661 VanDerWaalsContact O-N 3.08Å; M659-K661 VanDerWaalsContact C-N 3.33Å; K661-F665 VanDerWaalsContact O-CD2 3.27Å; K661-F665 WeakPolarHBondContact O-CD2 3.5Å; K661-F665 PolarHBondContact O-N 2.91Å; K661-W746 HydrophobicContact CB-CH2 3.61Å; K661-W746 HydrophobicContact CB-CZ3 4.21Å; K661-W746 HydrophobicContact CD-CE3 4.35Å; K661-W746 HydrophobicContact CD-CH2 3.12Å; K661-W746 HydrophobicContact CD-CZ2 3.85Å; K661-W746 HydrophobicContact CD-CZ3 3.38Å; K661-W746 HydrophobicContact CG-CH2 3.23Å; K661-W746 HydrophobicContact CG-CZ2 4.35Å; K661-W746 HydrophobicContact CG-CZ3 3.39Å; K661-W746 VanDerWaalsContact NZ-CH2 3.27Å
662	I	85.6	Confident	82.9	Confident	2 Å²	2	66 Å²	66	1%	0.01	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-42.9	176.7	-65.6	168.7	0	0	0	110.7	P398 E399 L498 L658 I660 V664 F665 S666 W746	P398-I662 HydrophobicContact CG-CD1 4.17Å; E399-I662 HydrophobicContact CB-CD1 4Å; L498-I662 HydrophobicContact CD1-CG2 3.98Å; L658-I662 HydrophobicContact CD1-CD1 4.24Å; L658-I662 HydrophobicContact CD1-CG1 4.44Å; L658-I662 HydrophobicContact CG-CD1 4.02Å; L658-I662 WeakPolarHBondContact O-CG1 3.18Å; L658-I662 PolarHBondContact O-N 3.09Å; I660-I662 VanDerWaalsContact C-N 3.35Å; I660-I662 PolarHBondContact O-N 2.86Å; I662-V664 PolarHBondContact O-N 3.46Å; I662-F665 PolarHBondContact O-N 3.39Å; I662-S666 WeakPolarHBondContact O-CB 3.16Å; I662-S666 PolarHBondContact O-N 3.43Å; I662-W746 HydrophobicContact CG1-CH2 4.5Å; I662-W746 HydrophobicContact CG1-CZ2 4.24Å
663	A	86.9	Confident	84.2	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.033	30%	0.3	C	S	.	.	H	α-helix	trans	-56.7	-52	177.6	0	0	0	0	0	111.6	W502 M659 I660 F665 S666 M667	W502-A663 VanDerWaalsContact CE2-CB 3.47Å; W502-A663 HydrophobicContact CH2-CB 4.16Å; W502-A663 HydrophobicContact CZ2-CB 3.27Å; M659-A663 WeakPolarHBondContact O-CB 3.33Å; M659-A663 PolarHBondContact O-N 2.87Å; I660-A663 WeakPolarHBondContact O-CB 3.5Å; I660-A663 PolarHBondContact O-N 3.24Å; A663-F665 VanDerWaalsContact C-N 3.31Å; A663-F665 PolarHBondContact O-N 3.1Å; A663-S666 PolarHBondContact O-N 2.87Å; A663-M667 VanDerWaalsContact O-CG 3.24Å; A663-M667 WeakPolarHBondContact O-CG 3.3Å; A663-M667 PolarHBondContact O-N 3.19Å
664	V	84.9	Confident	85.6	Confident	74 Å²	74	56.6 Å²	56.6	45%	0.448	28%	0.283	S	S	.	.	H	α-helix	trans	-58.8	-44	-178.3	171.2	0	0	0	0	110.7	I660 I662 M667 L668	I660-V664 HydrophobicContact CG2-CG2 4.2Å; I660-V664 WeakPolarHBondContact O-CG2 3.47Å; I660-V664 PolarHBondContact O-N 2.98Å; I662-V664 PolarHBondContact O-N 3.46Å; V664-M667 PolarHBondContact O-N 3.26Å; V664-L668 HydrophobicContact CG1-CD1 4.24Å; V664-L668 VanDerWaalsContact O-CG 3.3Å; V664-L668 WeakPolarHBondContact O-CG 3.46Å; V664-L668 PolarHBondContact O-N 3.36Å
665	F	84.7	Confident	86.9	Confident	60 Å²	60	49 Å²	49	26%	0.263	26%	0.259	S	S	.	.	H	α-helix	trans	-70.9	-37.7	179.6	-84.1	-104.5	0	0	0	112.9	K661 I662 A663 M667 L668 Y669 W746	K661-F665 VanDerWaalsContact O-CD2 3.27Å; K661-F665 WeakPolarHBondContact O-CD2 3.5Å; K661-F665 PolarHBondContact O-N 2.91Å; I662-F665 PolarHBondContact O-N 3.39Å; A663-F665 VanDerWaalsContact C-N 3.31Å; A663-F665 PolarHBondContact O-N 3.1Å; F665-M667 VanDerWaalsContact C-N 3.28Å; F665-M667 PolarHBondContact O-N 3.16Å; F665-L668 PolarHBondContact O-N 3.33Å; F665-Y669 WeakPolarHBondContact O-CD1 3.43Å; F665-Y669 PolarHBondContact O-N 3.49Å; F665-Y669 VanDerWaalsContact O-N 3.11Å; F665-W746 HydrophobicContact CB-CE3 4.49Å; F665-W746 HydrophobicContact CB-CZ3 4.24Å; F665-W746 HydrophobicContact CD1-CD2 4.37Å; F665-W746 AromaticContact CD1-CE3 3.57Å; F665-W746 HydrophobicContact CD1-CE3 3.57Å; F665-W746 AromaticContact CD1-CZ3 3.98Å; F665-W746 HydrophobicContact CD1-CZ3 3.98Å; F665-W746 AromaticContact CD2-CE3 3.57Å; F665-W746 HydrophobicContact CD2-CE3 3.57Å; F665-W746 HydrophobicContact CD2-CH2 4.04Å; F665-W746 AromaticContact CD2-CZ3 3.08Å; F665-W746 HydrophobicContact CD2-CZ3 3.08Å; F665-W746 HydrophobicContact CE1-CB 4.42Å; F665-W746 HydrophobicContact CE1-CD2 4.47Å; F665-W746 AromaticContact CE1-CE3 3.51Å; F665-W746 HydrophobicContact CE1-CE3 3.51Å; F665-W746 HydrophobicContact CE1-CZ3 4.09Å; F665-W746 AromaticContact CE2-CE3 3.49Å; F665-W746 HydrophobicContact CE2-CE3 3.49Å; F665-W746 VanDerWaalsContact CE2-CE3 3.49Å; F665-W746 HydrophobicContact CE2-CH2 4.43Å; F665-W746 AromaticContact CE2-CZ3 3.21Å; F665-W746 HydrophobicContact CE2-CZ3 3.21Å; F665-W746 HydrophobicContact CG-CD2 4.49Å; F665-W746 AromaticContact CG-CE3 3.57Å; F665-W746 HydrophobicContact CG-CE3 3.57Å; F665-W746 HydrophobicContact CG-CH2 4.34Å; F665-W746 AromaticContact CG-CZ3 3.47Å; F665-W746 HydrophobicContact CG-CZ3 3.47Å; F665-W746 VanDerWaalsContact CG-CZ3 3.47Å; F665-W746 AromaticContact CZ-CE3 3.45Å; F665-W746 HydrophobicContact CZ-CE3 3.45Å; F665-W746 VanDerWaalsContact CZ-CE3 3.45Å; F665-W746 AromaticContact CZ-CZ3 3.72Å; F665-W746 HydrophobicContact CZ-CZ3 3.72Å
666	S	87.3	Confident	88.2	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.9	-37.5	174.2	-164.2	0	0	0	0	111.8	W495 I662 A663 Y669	W495-S666 PolarHBondContact NE1-O 2.92Å; W495-S666 VanDerWaalsContact NE1-O 3.1Å; W495-S666 PolarHBondContact NE1-OG 3.22Å; I662-S666 WeakPolarHBondContact O-CB 3.16Å; I662-S666 PolarHBondContact O-N 3.43Å; A663-S666 PolarHBondContact O-N 2.87Å; S666-Y669 PolarHBondContact O-N 3.35Å
667	M	86.6	Confident	89.4	Confident	59 Å²	59	41.7 Å²	41.7	29%	0.291	22%	0.22	S	C	.	.	H	α-helix	trans	-68	-39.1	172.5	-66	-65.5	-173.8	0	0	112.3	L581 A663 V664 F665 Y669 V670	L581-M667 HydrophobicContact CB-CE 3.46Å; L581-M667 VanDerWaalsContact CB-CE 3.46Å; L581-M667 HydrophobicContact CB-SD 3.9Å; L581-M667 HydrophobicContact CD1-CE 4.37Å; L581-M667 HydrophobicContact CD1-SD 3.81Å; L581-M667 HydrophobicContact CD2-CE 4.19Å; L581-M667 HydrophobicContact CG-CE 4.21Å; L581-M667 HydrophobicContact CG-SD 4.3Å; A663-M667 VanDerWaalsContact O-CG 3.24Å; A663-M667 WeakPolarHBondContact O-CG 3.3Å; A663-M667 PolarHBondContact O-N 3.19Å; V664-M667 PolarHBondContact O-N 3.26Å; F665-M667 VanDerWaalsContact C-N 3.28Å; F665-M667 PolarHBondContact O-N 3.16Å; M667-Y669 PolarHBondContact O-N 2.84Å; M667-V670 WeakPolarHBondContact O-CB 3.5Å; M667-V670 WeakPolarHBondContact O-CG2 3.27Å; M667-V670 PolarHBondContact O-N 2.89Å
668	L	89.2	Confident	90.2	Very high	94 Å²	94	38.4 Å²	38.4	49%	0.492	21%	0.214	S	C	.	.	H	α-helix	trans	-61.1	-30.3	175.2	-73	171.2	0	0	0	111.9	V664 F665 V670 V671 P672	V664-L668 HydrophobicContact CG1-CD1 4.24Å; V664-L668 VanDerWaalsContact O-CG 3.3Å; V664-L668 WeakPolarHBondContact O-CG 3.46Å; V664-L668 PolarHBondContact O-N 3.36Å; F665-L668 PolarHBondContact O-N 3.33Å; L668-V670 PolarHBondContact O-N 3.34Å; L668-V671 PolarHBondContact O-N 3.11Å; L668-P672 WeakPolarHBondContact O-CD 3.42Å
669	Y	92.5	Very high	91	Very high	10 Å²	10	36 Å²	36	4%	0.039	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-14.1	175.5	-70.4	1.6	0	0	0	114	I405 W495 F665 S666 M667 V671 K673 V739 T742 S743	I405-Y669 HydrophobicContact CD1-CE2 4.33Å; W495-Y669 AromaticContact CD1-CD2 3.79Å; F665-Y669 WeakPolarHBondContact O-CD1 3.43Å; F665-Y669 PolarHBondContact O-N 3.49Å; F665-Y669 VanDerWaalsContact O-N 3.11Å; S666-Y669 PolarHBondContact O-N 3.35Å; M667-Y669 PolarHBondContact O-N 2.84Å; Y669-V671 VanDerWaalsContact C-N 3.26Å; Y669-V671 PolarHBondContact O-N 2.97Å; Y669-K673 VanDerWaalsContact O-CG 3.28Å; Y669-K673 WeakPolarHBondContact O-CG 3.31Å; Y669-K673 PolarHBondContact O-N 2.97Å; Y669-V739 HydrophobicContact CD1-CG1 4.23Å; Y669-V739 HydrophobicContact CD2-CG1 3.92Å; Y669-V739 HydrophobicContact CE1-CG1 4.15Å; Y669-V739 HydrophobicContact CE2-CG1 3.86Å; Y669-V739 HydrophobicContact CG-CG1 4.13Å; Y669-T742 WeakPolarHBondContact CE1-OG1 3.44Å; Y669-S743 WeakPolarHBondContact OH-CA 3.2Å; Y669-S743 WeakPolarHBondContact OH-CB 3.21Å; Y669-S743 PolarHBondContact OH-N 3.02Å
670	V	95	Very high	91.7	Very high	29 Å²	29	35.5 Å²	35.5	18%	0.176	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-39.3	170.9	177.4	0	0	0	0	110	W495 L574 I578 L581 M667 L668 K673 A674	W495-V670 HydrophobicContact CH2-CG2 4.32Å; W495-V670 HydrophobicContact CZ2-CG2 3.74Å; L574-V670 HydrophobicContact CD1-CG1 4.19Å; I578-V670 HydrophobicContact CD1-CG1 3.96Å; I578-V670 HydrophobicContact CG1-CG1 4.26Å; I578-V670 HydrophobicContact CG1-CG2 4.15Å; L581-V670 HydrophobicContact CD1-CG2 4.48Å; M667-V670 WeakPolarHBondContact O-CB 3.5Å; M667-V670 WeakPolarHBondContact O-CG2 3.27Å; M667-V670 PolarHBondContact O-N 2.89Å; L668-V670 PolarHBondContact O-N 3.34Å; V670-K673 PolarHBondContact O-N 3.29Å; V670-A674 WeakPolarHBondContact O-CB 3.43Å; V670-A674 PolarHBondContact O-N 3.25Å
671	V	95.4	Very high	92.4	Very high	94 Å²	94	35.6 Å²	35.6	57%	0.57	20%	0.2	S	C	*	.	H	α-helix	trans	-63.8	-54.3	-174	175.8	0	0	0	0	112.4	L668 Y669 K673 A674 C675	L668-V671 PolarHBondContact O-N 3.11Å; Y669-V671 VanDerWaalsContact C-N 3.26Å; Y669-V671 PolarHBondContact O-N 2.97Å; V671-K673 VanDerWaalsContact C-N 3.31Å; V671-K673 PolarHBondContact O-N 2.9Å; V671-A674 PolarHBondContact O-N 3.05Å; V671-C675 WeakPolarHBondContact O-CB 3.39Å; V671-C675 PolarHBondContact O-N 3.35Å
672	P	95.9	Very high	92.9	Very high	14 Å²	14	35 Å²	35	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-37.1	178.3	-20.9	31.9	0	0	0	112.8	L668 C675 V676 M735 V738 V739	L668-P672 WeakPolarHBondContact O-CD 3.42Å; P672-C675 PolarHBondContact O-N 3.21Å; P672-V676 WeakPolarHBondContact O-CG2 3.33Å; P672-V676 PolarHBondContact O-N 3.06Å; P672-M735 HydrophobicContact CB-CB 4.16Å; P672-M735 WeakPolarHBondContact CB-O 3.4Å; P672-M735 HydrophobicContact CB-SD 4.26Å; P672-V738 HydrophobicContact CB-CG1 3.87Å; P672-V738 HydrophobicContact CG-CG1 3.78Å; P672-V739 HydrophobicContact CB-CG2 3.76Å; P672-V739 HydrophobicContact CG-CG2 4.01Å
673	K	94.9	Very high	93.4	Very high	4 Å²	4	35.9 Å²	35.9	2%	0.017	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-45.7	178	-70.7	-179.3	173.6	-147.8	0	112.8	Y492 W495 L574 Y669 V670 V671 C675 V676 I677	Y492-K673 HydrophobicContact CD1-CD 4.25Å; Y492-K673 HydrophobicContact CE1-CB 4.15Å; Y492-K673 HydrophobicContact CE1-CD 4.07Å; Y492-K673 HydrophobicContact CE1-CG 3.98Å; Y492-K673 PolarHBondContact O-NZ 3.24Å; W495-K673 HydrophobicContact CD2-CD 4.06Å; W495-K673 HydrophobicContact CE3-CD 4.14Å; W495-K673 HydrophobicContact CG-CD 4.43Å; W495-K673 HydrophobicContact CZ3-CD 4.49Å; L574-K673 HydrophobicContact CD1-CB 4.07Å; Y669-K673 VanDerWaalsContact O-CG 3.28Å; Y669-K673 WeakPolarHBondContact O-CG 3.31Å; Y669-K673 PolarHBondContact O-N 2.97Å; V670-K673 PolarHBondContact O-N 3.29Å; V671-K673 VanDerWaalsContact C-N 3.31Å; V671-K673 PolarHBondContact O-N 2.9Å; K673-C675 VanDerWaalsContact C-N 3.27Å; K673-C675 PolarHBondContact O-N 3.36Å; K673-V676 PolarHBondContact O-N 3.26Å; K673-I677 WeakPolarHBondContact O-CG1 3.42Å; K673-I677 PolarHBondContact O-N 3.42Å
674	A	96.7	Very high	93.8	Very high	31 Å²	31	40 Å²	40	26%	0.256	22%	0.216	S	C	.	.	H	α-helix	trans	-61.9	-38.2	175.3	0	0	0	0	0	111	L574 V670 V671 I677 S678	L574-A674 HydrophobicContact CD2-CB 4.25Å; V670-A674 WeakPolarHBondContact O-CB 3.43Å; V670-A674 PolarHBondContact O-N 3.25Å; V671-A674 PolarHBondContact O-N 3.05Å; A674-I677 PolarHBondContact O-N 2.85Å; A674-S678 WeakPolarHBondContact O-CB 3.4Å; A674-S678 PolarHBondContact O-N 3.47Å; A674-S678 PolarHBondContact O-OG 3.18Å
675	C	97.2	Very high	94.3	Very high	25 Å²	25	40.9 Å²	40.9	17%	0.169	22%	0.218	C	C	.	.	H	α-helix	trans	-63.7	-48	175.6	-170.5	0	0	0	0	112	V671 P672 K673 I677 S678 V679 L731 M735	V671-C675 WeakPolarHBondContact O-CB 3.39Å; V671-C675 PolarHBondContact O-N 3.35Å; P672-C675 PolarHBondContact O-N 3.21Å; K673-C675 VanDerWaalsContact C-N 3.27Å; K673-C675 PolarHBondContact O-N 3.36Å; C675-I677 VanDerWaalsContact C-N 3.33Å; C675-I677 PolarHBondContact O-N 2.99Å; C675-S678 WeakPolarHBondContact O-CB 3.38Å; C675-S678 PolarHBondContact O-N 3.26Å; C675-S678 VanDerWaalsContact O-N 3.13Å; C675-V679 PolarHBondContact O-N 3.42Å; C675-L731 VanDerWaalsContact SG-CD2 3.59Å; C675-M735 HydrophobicContact CB-CB 4.25Å; C675-M735 HydrophobicContact CB-CG 3.93Å
676	V	97.2	Very high	94.8	Very high	5 Å²	5	39 Å²	39	3%	0.03	21%	0.21	C	C	.	.	H	α-helix	trans	-58.1	-44.8	175.7	169.8	0	0	0	0	111.4	P672 K673 V679 N680 Q732 M735 S736	P672-V676 WeakPolarHBondContact O-CG2 3.33Å; P672-V676 PolarHBondContact O-N 3.06Å; K673-V676 PolarHBondContact O-N 3.26Å; V676-V679 PolarHBondContact O-N 3.05Å; V676-N680 PolarHBondContact O-N 3.34Å; V676-N680 PolarHBondContact O-ND2 2.93Å; V676-Q732 HydrophobicContact CG1-CG 4.18Å; V676-Q732 HydrophobicContact CG2-CG 4.35Å; V676-M735 HydrophobicContact CG2-CB 3.99Å; V676-S736 WeakPolarHBondContact CG2-OG 3.46Å
677	I	97.3	Very high	95	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-63.1	-42.1	176.1	-68.6	169	0	0	0	110.9	Y492 L567 Q570 V571 L574 K673 A674 C675 V679 N680 I681	Y492-I677 HydrophobicContact CE1-CD1 4.49Å; L567-I677 HydrophobicContact CD2-CG2 4.4Å; Q570-I677 HydrophobicContact CB-CD1 3.88Å; Q570-I677 HydrophobicContact CB-CG1 3.8Å; V571-I677 HydrophobicContact CG2-CG2 3.77Å; L574-I677 HydrophobicContact CB-CD1 3.91Å; L574-I677 HydrophobicContact CD2-CD1 3.78Å; L574-I677 HydrophobicContact CG-CD1 4.38Å; K673-I677 WeakPolarHBondContact O-CG1 3.42Å; K673-I677 PolarHBondContact O-N 3.42Å; A674-I677 PolarHBondContact O-N 2.85Å; C675-I677 VanDerWaalsContact C-N 3.33Å; C675-I677 PolarHBondContact O-N 2.99Å; I677-V679 VanDerWaalsContact C-N 3.34Å; I677-V679 PolarHBondContact O-N 3.24Å; I677-N680 WeakPolarHBondContact O-CB 3.02Å; I677-N680 PolarHBondContact O-N 3.48Å; I677-I681 HydrophobicContact CG2-CD1 3.87Å; I677-I681 HydrophobicContact CG2-CG1 4.36Å; I677-I681 WeakPolarHBondContact O-CG1 3.49Å; I677-I681 PolarHBondContact O-N 3.33Å
678	S	97.5	Very high	95.3	Very high	69 Å²	69	41.6 Å²	41.6	48%	0.483	23%	0.226	S	C	.	.	H	α-helix	trans	-62.7	-40.1	179.7	-58.8	0	0	0	0	112.1	A674 C675 I681 Y682	A674-S678 WeakPolarHBondContact O-CB 3.4Å; A674-S678 PolarHBondContact O-N 3.47Å; A674-S678 PolarHBondContact O-OG 3.18Å; C675-S678 WeakPolarHBondContact O-CB 3.38Å; C675-S678 PolarHBondContact O-N 3.26Å; C675-S678 VanDerWaalsContact O-N 3.13Å; S678-I681 PolarHBondContact O-N 2.96Å; S678-Y682 WeakPolarHBondContact O-CB 3.4Å; S678-Y682 PolarHBondContact O-N 3.13Å
679	V	97	Very high	95.4	Very high	9 Å²	9	41.4 Å²	41.4	6%	0.055	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-40.8	174.2	177.7	0	0	0	0	111.1	C675 V676 I677 I681 Y682 N683 A728 Q732	C675-V679 PolarHBondContact O-N 3.42Å; V676-V679 PolarHBondContact O-N 3.05Å; I677-V679 VanDerWaalsContact C-N 3.34Å; I677-V679 PolarHBondContact O-N 3.24Å; V679-I681 VanDerWaalsContact C-N 3.29Å; V679-I681 PolarHBondContact O-N 2.99Å; V679-Y682 WeakPolarHBondContact O-CB 3.49Å; V679-Y682 PolarHBondContact O-N 2.98Å; V679-N683 PolarHBondContact O-N 3.35Å; V679-A728 HydrophobicContact CG1-CB 4.01Å; V679-A728 WeakPolarHBondContact CG1-O 3.15Å; V679-A728 HydrophobicContact CG2-CB 4.39Å; V679-Q732 HydrophobicContact CB-CB 4.03Å; V679-Q732 HydrophobicContact CB-CG 4.46Å; V679-Q732 HydrophobicContact CG1-CB 3.88Å; V679-Q732 HydrophobicContact CG1-CG 4.43Å; V679-Q732 HydrophobicContact CG2-CB 4.21Å
680	N	96.4	Very high	95.4	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.027	22%	0.222	C	C	.	.	H	α-helix	trans	-61.8	-37.4	174.3	-74.2	-31.1	0	0	0	112.1	I566 L567 Q570 V676 I677 N683 Y684 Q732	I566-N680 WeakPolarHBondContact CG2-ND2 3.35Å; L567-N680 HydrophobicContact CD2-CB 3.38Å; L567-N680 HydrophobicContact CG-CB 4Å; Q570-N680 PolarHBondContact OE1-ND2 3.16Å; V676-N680 PolarHBondContact O-N 3.34Å; V676-N680 PolarHBondContact O-ND2 2.93Å; I677-N680 WeakPolarHBondContact O-CB 3.02Å; I677-N680 PolarHBondContact O-N 3.48Å; N680-N683 PolarHBondContact O-N 3.18Å; N680-Y684 WeakPolarHBondContact O-CB 3.38Å; N680-Y684 PolarHBondContact O-N 3.5Å; N680-Q732 PolarHBondContact OD1-NE2 3.32Å
681	I	97.2	Very high	95.2	Very high	69 Å²	69	42.5 Å²	42.5	35%	0.354	22%	0.224	S	C	.	.	H	α-helix	trans	-65.8	-44.4	173.8	-69.3	169.8	0	0	0	110.1	L567 I677 S678 V679 N683 Y684 I685	L567-I681 HydrophobicContact CD2-CG1 3.65Å; I677-I681 HydrophobicContact CG2-CD1 3.87Å; I677-I681 HydrophobicContact CG2-CG1 4.36Å; I677-I681 WeakPolarHBondContact O-CG1 3.49Å; I677-I681 PolarHBondContact O-N 3.33Å; S678-I681 PolarHBondContact O-N 2.96Å; V679-I681 VanDerWaalsContact C-N 3.29Å; V679-I681 PolarHBondContact O-N 2.99Å; I681-N683 VanDerWaalsContact C-N 3.31Å; I681-N683 PolarHBondContact O-N 2.92Å; I681-Y684 PolarHBondContact O-N 3.39Å; I681-I685 HydrophobicContact CG2-CD1 3.52Å; I681-I685 HydrophobicContact CG2-CG1 4.2Å; I681-I685 VanDerWaalsContact O-CG1 3.32Å; I681-I685 WeakPolarHBondContact O-CG1 3.47Å; I681-I685 PolarHBondContact O-N 3.33Å
682	Y	96.3	Very high	95	Very high	71 Å²	71	45 Å²	45	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-56.3	-44.9	174.2	165.3	-90.5	0	0	0	111.7	S678 V679 N686 W690 S725 A728	S678-Y682 WeakPolarHBondContact O-CB 3.4Å; S678-Y682 PolarHBondContact O-N 3.13Å; V679-Y682 WeakPolarHBondContact O-CB 3.49Å; V679-Y682 PolarHBondContact O-N 2.98Å; Y682-N686 WeakPolarHBondContact CD2-ND2 3.5Å; Y682-N686 VanDerWaalsContact CE2-ND2 3.25Å; Y682-N686 WeakPolarHBondContact CE2-ND2 3.3Å; Y682-N686 WeakPolarHBondContact O-CB 3.22Å; Y682-N686 PolarHBondContact O-N 2.99Å; Y682-N686 VanDerWaalsContact O-N 3.07Å; Y682-N686 PolarHBondContact O-ND2 3.12Å; Y682-W690 HydrophobicContact CD1-CH2 4.36Å; Y682-W690 HydrophobicContact CD1-CZ2 4.43Å; Y682-W690 AromaticContact CE1-CH2 3.86Å; Y682-W690 HydrophobicContact CE1-CH2 3.86Å; Y682-W690 AromaticContact CE1-CZ2 3.62Å; Y682-W690 HydrophobicContact CE1-CZ2 3.62Å; Y682-W690 AromaticContact CZ-CZ2 3.85Å; Y682-S725 WeakPolarHBondContact CE1-OG 3.24Å; Y682-S725 PolarHBondContact OH-N 3.01Å; Y682-S725 PolarHBondContact OH-OG 3.13Å; Y682-A728 HydrophobicContact CD1-CB 4.27Å; Y682-A728 HydrophobicContact CE1-CB 4.23Å
683	N	94.9	Very high	94.7	Very high	20 Å²	20	44.8 Å²	44.8	11%	0.107	23%	0.226	C	C	.	.	H	α-helix	trans	-62.9	-46.9	176.4	-70.7	-19.6	0	0	0	111.1	L562 V679 N680 I681 I685 Y687 W690	L562-N683 HydrophobicContact CD2-CB 4.22Å; V679-N683 PolarHBondContact O-N 3.35Å; N680-N683 PolarHBondContact O-N 3.18Å; I681-N683 VanDerWaalsContact C-N 3.31Å; I681-N683 PolarHBondContact O-N 2.92Å; N683-I685 PolarHBondContact O-N 3.46Å; N683-Y687 WeakPolarHBondContact O-CB 3.49Å; N683-Y687 PolarHBondContact O-N 3.43Å; N683-W690 HydrophobicContact CB-CH2 4.36Å; N683-W690 WeakPolarHBondContact OD1-CH2 3.13Å
684	Y	96.1	Very high	94.4	Very high	89 Å²	89	44.7 Å²	44.7	35%	0.349	23%	0.226	S	C	.	.	H	α-helix	trans	-60.5	-46.1	178.5	177.1	-100.6	0	0	0	113	L563 L567 N680 I681	L563-Y684 HydrophobicContact CB-CD2 4.24Å; L563-Y684 HydrophobicContact CB-CE2 3.87Å; L563-Y684 HydrophobicContact CD1-CE2 4.48Å; L563-Y684 HydrophobicContact CD2-CE2 4.17Å; L563-Y684 HydrophobicContact CG-CE2 4.4Å; L567-Y684 HydrophobicContact CD1-CD2 4.46Å; L567-Y684 HydrophobicContact CD1-CG 4.04Å; N680-Y684 WeakPolarHBondContact O-CB 3.38Å; N680-Y684 PolarHBondContact O-N 3.5Å; I681-Y684 PolarHBondContact O-N 3.39Å
685	I	95.6	Very high	94	Very high	94 Å²	94	45.8 Å²	45.8	48%	0.482	23%	0.227	S	C	.	.	H	α-helix	trans	-69.3	-40.2	-177.3	-67.9	171.7	0	0	0	111.8	I681 N683	I681-I685 HydrophobicContact CG2-CD1 3.52Å; I681-I685 HydrophobicContact CG2-CG1 4.2Å; I681-I685 VanDerWaalsContact O-CG1 3.32Å; I681-I685 WeakPolarHBondContact O-CG1 3.47Å; I681-I685 PolarHBondContact O-N 3.33Å; N683-I685 PolarHBondContact O-N 3.46Å
686	N	94.8	Very high	93.6	Very high	20 Å²	20	49.8 Å²	49.8	11%	0.107	24%	0.242	C	C	.	.	H	α-helix	trans	-91.7	-14.2	-173.6	-64.5	-61.9	0	0	0	113.5	Y682 K689 W690	Y682-N686 WeakPolarHBondContact CD2-ND2 3.5Å; Y682-N686 VanDerWaalsContact CE2-ND2 3.25Å; Y682-N686 WeakPolarHBondContact CE2-ND2 3.3Å; Y682-N686 WeakPolarHBondContact O-CB 3.22Å; Y682-N686 PolarHBondContact O-N 2.99Å; Y682-N686 VanDerWaalsContact O-N 3.07Å; Y682-N686 PolarHBondContact O-ND2 3.12Å; N686-K689 WeakPolarHBondContact O-CA 3.3Å; N686-K689 VanDerWaalsContact O-CB 3.3Å; N686-K689 WeakPolarHBondContact O-CB 3.34Å; N686-K689 PolarHBondContact O-N 2.77Å; N686-K689 PolarHBondContact OD1-NZ 2.84Å; N686-W690 HydrophobicContact CB-CD2 4.3Å; N686-W690 HydrophobicContact CB-CH2 4.19Å; N686-W690 HydrophobicContact CB-CZ2 3.48Å; N686-W690 VanDerWaalsContact CB-CZ2 3.48Å; N686-W690 PolarHBondContact O-N 3.46Å
687	Y	92.3	Very high	93.1	Very high	45 Å²	45	49.6 Å²	49.6	18%	0.176	24%	0.24	C	C	.	.	H	α-helix	trans	-49.8	-48.9	178	-179.9	-82.8	0	0	0	113.8	Q557 N683 K689 W690 M691	Q557-Y687 VanDerWaalsContact O-CZ 3.3Å; Q557-Y687 PolarHBondContact O-OH 2.88Å; N683-Y687 WeakPolarHBondContact O-CB 3.49Å; N683-Y687 PolarHBondContact O-N 3.43Å; Y687-K689 PolarHBondContact O-N 2.9Å; Y687-W690 PolarHBondContact O-N 3.44Å; Y687-M691 HydrophobicContact CD1-CG 4.13Å; Y687-M691 HydrophobicContact CD2-CE 4.33Å; Y687-M691 HydrophobicContact CE1-CE 4.46Å; Y687-M691 HydrophobicContact CE1-CG 3.62Å; Y687-M691 HydrophobicContact CE1-SD 4.3Å; Y687-M691 HydrophobicContact CE2-CE 3.92Å; Y687-M691 WeakPolarHBondContact O-CG 3.47Å; Y687-M691 PolarHBondContact O-N 3.49Å
688	P	91.6	Very high	92.6	Very high	68 Å²	68	50.6 Å²	50.6	44%	0.442	25%	0.25	S	S	.	.	H	α-helix	trans	-63.2	-30	176.9	-21.7	34	0	0	0	113.4	K692	P688-K692 WeakPolarHBondContact O-CG 3.44Å; P688-K692 PolarHBondContact O-N 2.99Å; P688-K692 VanDerWaalsContact O-N 3.08Å
689	K	92.7	Very high	92	Very high	91 Å²	91	54 Å²	54	40%	0.396	26%	0.256	S	S	.	.	H	α-helix	trans	-70.2	-42.6	176.7	-56.1	-178.1	-169.9	162.6	0	110.7	N686 Y687 M691 K692 T693	N686-K689 WeakPolarHBondContact O-CA 3.3Å; N686-K689 VanDerWaalsContact O-CB 3.3Å; N686-K689 WeakPolarHBondContact O-CB 3.34Å; N686-K689 PolarHBondContact O-N 2.77Å; N686-K689 PolarHBondContact OD1-NZ 2.84Å; Y687-K689 PolarHBondContact O-N 2.9Å; K689-M691 VanDerWaalsContact C-N 3.32Å; K689-M691 PolarHBondContact O-N 3.08Å; K689-K692 WeakPolarHBondContact O-CB 3.39Å; K689-K692 PolarHBondContact O-N 3.41Å; K689-T693 PolarHBondContact O-N 3.39Å; K689-T693 PolarHBondContact O-OG1 2.8Å
690	W	92.2	Very high	91.5	Very high	16 Å²	16	57 Å²	57	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-63	-39.2	175.7	-54.9	-30.5	0	0	0	111.8	F357 Y682 N683 N686 Y687 K692 T693 L694 F723 P724	F357-W690 HydrophobicContact CE1-CB 4.04Å; F357-W690 HydrophobicContact CZ-CB 4.27Å; Y682-W690 HydrophobicContact CD1-CH2 4.36Å; Y682-W690 HydrophobicContact CD1-CZ2 4.43Å; Y682-W690 AromaticContact CE1-CH2 3.86Å; Y682-W690 HydrophobicContact CE1-CH2 3.86Å; Y682-W690 AromaticContact CE1-CZ2 3.62Å; Y682-W690 HydrophobicContact CE1-CZ2 3.62Å; Y682-W690 AromaticContact CZ-CZ2 3.85Å; N683-W690 HydrophobicContact CB-CH2 4.36Å; N683-W690 WeakPolarHBondContact OD1-CH2 3.13Å; N686-W690 HydrophobicContact CB-CD2 4.3Å; N686-W690 HydrophobicContact CB-CH2 4.19Å; N686-W690 HydrophobicContact CB-CZ2 3.48Å; N686-W690 VanDerWaalsContact CB-CZ2 3.48Å; N686-W690 PolarHBondContact O-N 3.46Å; Y687-W690 PolarHBondContact O-N 3.44Å; W690-K692 PolarHBondContact O-N 2.97Å; W690-T693 WeakPolarHBondContact O-CB 3.34Å; W690-T693 PolarHBondContact O-N 3.16Å; W690-L694 PolarHBondContact O-N 3.35Å; W690-F723 PolarHBondContact NE1-O 2.92Å; W690-P724 HydrophobicContact CD2-CB 3.94Å; W690-P724 HydrophobicContact CD2-CG 4.42Å; W690-P724 HydrophobicContact CE3-CB 4.01Å; W690-P724 HydrophobicContact CH2-CB 3.67Å; W690-P724 VanDerWaalsContact CZ2-CA 3.49Å; W690-P724 HydrophobicContact CZ2-CB 3.6Å; W690-P724 HydrophobicContact CZ3-CB 3.89Å
691	M	90.2	Very high	90.9	Very high	45 Å²	45	60.1 Å²	60.1	22%	0.222	29%	0.289	C	S	.	.	H	α-helix	trans	-64.9	-38.1	174	-63.6	-51.1	107.3	0	0	112.2	R350 F357 Y687 K689 T693 L694 D695	R350-M691 VanDerWaalsContact NH2-CE 3.35Å; R350-M691 PolarHBondContact NH2-SD 3.09Å; F357-M691 HydrophobicContact CE2-CE 4.04Å; F357-M691 HydrophobicContact CZ-CE 3.55Å; Y687-M691 HydrophobicContact CD1-CG 4.13Å; Y687-M691 HydrophobicContact CD2-CE 4.33Å; Y687-M691 HydrophobicContact CE1-CE 4.46Å; Y687-M691 HydrophobicContact CE1-CG 3.62Å; Y687-M691 HydrophobicContact CE1-SD 4.3Å; Y687-M691 HydrophobicContact CE2-CE 3.92Å; Y687-M691 WeakPolarHBondContact O-CG 3.47Å; Y687-M691 PolarHBondContact O-N 3.49Å; K689-M691 VanDerWaalsContact C-N 3.32Å; K689-M691 PolarHBondContact O-N 3.08Å; M691-T693 VanDerWaalsContact C-N 3.35Å; M691-L694 HydrophobicContact CE-CD1 4.29Å; M691-L694 WeakPolarHBondContact O-CB 3.47Å; M691-L694 PolarHBondContact O-N 2.76Å; M691-L694 HydrophobicContact SD-CD1 4.16Å; M691-D695 PolarHBondContact O-N 2.95Å; M691-D695 VanDerWaalsContact O-N 3.1Å
692	K	90.5	Very high	90.1	Very high	148 Å²	148	62.1 Å²	62.1	64%	0.643	30%	0.3	S	S	*	.	H	α-helix	trans	-64.5	-37.4	171.9	-73.1	176.1	-178.9	-175.6	0	112.3	P688 K689 W690 L694 D695 K696	P688-K692 WeakPolarHBondContact O-CG 3.44Å; P688-K692 PolarHBondContact O-N 2.99Å; P688-K692 VanDerWaalsContact O-N 3.08Å; K689-K692 WeakPolarHBondContact O-CB 3.39Å; K689-K692 PolarHBondContact O-N 3.41Å; W690-K692 PolarHBondContact O-N 2.97Å; K692-L694 VanDerWaalsContact C-N 3.32Å; K692-D695 PolarHBondContact O-N 2.72Å; K692-K696 WeakPolarHBondContact O-CG 3.48Å; K692-K696 PolarHBondContact O-N 3.48Å; K692-K696 VanDerWaalsContact O-N 3.08Å
693	T	90.1	Very high	89.7	Confident	8 Å²	8	58.7 Å²	58.7	5%	0.049	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-44.3	172.6	-61.6	0	0	0	0	110.7	K689 W690 M691 D695 K696 L697 N721 Q722 F723	K689-T693 PolarHBondContact O-N 3.39Å; K689-T693 PolarHBondContact O-OG1 2.8Å; W690-T693 WeakPolarHBondContact O-CB 3.34Å; W690-T693 PolarHBondContact O-N 3.16Å; M691-T693 VanDerWaalsContact C-N 3.35Å; T693-D695 PolarHBondContact O-N 3.19Å; T693-K696 WeakPolarHBondContact O-CB 3.27Å; T693-K696 PolarHBondContact O-N 3.33Å; T693-L697 HydrophobicContact CG2-CD1 4.01Å; T693-L697 HydrophobicContact CG2-CG 4.37Å; T693-L697 WeakPolarHBondContact O-CG 3.43Å; T693-L697 PolarHBondContact O-N 3.22Å; T693-N721 HydrophobicContact CG2-CB 3.63Å; T693-Q722 PolarHBondContact OG1-O 3.21Å; T693-F723 HydrophobicContact CG2-CE1 4.19Å; T693-F723 HydrophobicContact CG2-CE2 4.24Å; T693-F723 HydrophobicContact CG2-CZ 3.94Å
694	L	88.6	Confident	89.3	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-60.9	-43.9	176.3	-69	-173.1	0	0	0	113	L356 F357 W690 M691 K692 K696 L697 A698	L356-L694 HydrophobicContact CD1-CD2 3.42Å; L356-L694 VanDerWaalsContact CD1-CD2 3.42Å; L356-L694 HydrophobicContact CD2-CD1 3.86Å; L356-L694 HydrophobicContact CD2-CD2 4.04Å; L356-L694 HydrophobicContact CG-CD1 4.47Å; L356-L694 HydrophobicContact CG-CD2 3.74Å; F357-L694 HydrophobicContact CD1-CD2 4.46Å; F357-L694 HydrophobicContact CE1-CD1 4.05Å; F357-L694 HydrophobicContact CE1-CD2 3.69Å; F357-L694 HydrophobicContact CE1-CG 3.75Å; F357-L694 HydrophobicContact CE2-CD1 4.14Å; F357-L694 HydrophobicContact CZ-CD1 3.4Å; F357-L694 VanDerWaalsContact CZ-CD1 3.4Å; F357-L694 HydrophobicContact CZ-CD2 3.9Å; F357-L694 HydrophobicContact CZ-CG 3.64Å; W690-L694 PolarHBondContact O-N 3.35Å; M691-L694 HydrophobicContact CE-CD1 4.29Å; M691-L694 WeakPolarHBondContact O-CB 3.47Å; M691-L694 PolarHBondContact O-N 2.76Å; M691-L694 HydrophobicContact SD-CD1 4.16Å; K692-L694 VanDerWaalsContact C-N 3.32Å; L694-K696 VanDerWaalsContact C-N 3.3Å; L694-K696 PolarHBondContact O-N 3.09Å; L694-L697 HydrophobicContact CD2-CD1 4.33Å; L694-L697 PolarHBondContact O-N 3.06Å; L694-A698 WeakPolarHBondContact O-CB 3.34Å; L694-A698 PolarHBondContact O-N 3.49Å
695	D	87.9	Confident	88.7	Confident	55 Å²	55	56.7 Å²	56.7	29%	0.294	28%	0.284	S	S	.	.	H	α-helix	trans	-58.5	-41.9	175.6	175.9	57.8	0	0	0	111.7	Y331 M691 K692 T693 A698 K699	Y331-D695 WeakPolarHBondContact OH-CB 3.5Å; M691-D695 PolarHBondContact O-N 2.95Å; M691-D695 VanDerWaalsContact O-N 3.1Å; K692-D695 PolarHBondContact O-N 2.72Å; T693-D695 PolarHBondContact O-N 3.19Å; D695-A698 PolarHBondContact O-N 3.43Å; D695-K699 VanDerWaalsContact CG-NZ 3.27Å; D695-K699 WeakPolarHBondContact O-CG 3.31Å; D695-K699 PolarHBondContact O-N 2.97Å; D695-K699 WeakPolarHBondContact OD1-CE 3.34Å; D695-K699 IonicContact OD1-NZ 2.69Å; D695-K699 PolarHBondContact OD1-NZ 3.44Å; D695-K699 VanDerWaalsContact OD1-NZ 3.09Å; D695-K699 IonicContact OD2-NZ 2.86Å; D695-K699 PolarHBondContact OD2-NZ 3.47Å
696	K	88.5	Confident	88	Confident	109 Å²	109	56.3 Å²	56.3	47%	0.474	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-47.4	174.2	-69.9	177.7	179.6	-174.2	0	112.2	K692 T693 L694 A698 K699 Q700	K692-K696 WeakPolarHBondContact O-CG 3.48Å; K692-K696 PolarHBondContact O-N 3.48Å; K692-K696 VanDerWaalsContact O-N 3.08Å; T693-K696 WeakPolarHBondContact O-CB 3.27Å; T693-K696 PolarHBondContact O-N 3.33Å; L694-K696 VanDerWaalsContact C-N 3.3Å; L694-K696 PolarHBondContact O-N 3.09Å; K696-A698 VanDerWaalsContact C-N 3.31Å; K696-A698 PolarHBondContact O-N 3.48Å; K696-K699 PolarHBondContact O-N 2.95Å; K696-Q700 PolarHBondContact O-N 3Å; K696-Q700 VanDerWaalsContact O-N 3.12Å
697	L	87.9	Confident	87.4	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.9	-37.3	-179.8	-69.9	170.2	0	0	0	112	T693 L694 K699 Q700 C703 T709 C717 F723	T693-L697 HydrophobicContact CG2-CD1 4.01Å; T693-L697 HydrophobicContact CG2-CG 4.37Å; T693-L697 WeakPolarHBondContact O-CG 3.43Å; T693-L697 PolarHBondContact O-N 3.22Å; L694-L697 HydrophobicContact CD2-CD1 4.33Å; L694-L697 PolarHBondContact O-N 3.06Å; L697-K699 VanDerWaalsContact C-N 3.34Å; L697-Q700 PolarHBondContact O-N 3.45Å; L697-C703 HydrophobicContact CB-CB 4.47Å; L697-C703 HydrophobicContact CD2-CB 3.91Å; L697-T709 HydrophobicContact CD1-CG2 4.21Å; L697-T709 HydrophobicContact CD2-CG2 4.49Å; L697-C717 HydrophobicContact CD2-CB 3.99Å; L697-C717 VanDerWaalsContact CD2-O 3.23Å; L697-C717 WeakPolarHBondContact CD2-O 3.45Å; L697-F723 HydrophobicContact CD1-CE1 3.97Å; L697-F723 HydrophobicContact CD1-CZ 3.86Å
698	A	86.2	Confident	87.1	Confident	30 Å²	30	62 Å²	62	25%	0.248	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-36.7	176.8	0	0	0	0	0	112.5	R322 Y331 L694 D695 K696 L704	R322-A698 PolarHBondContact NH2-O 3.08Å; R322-A698 VanDerWaalsContact NH2-O 3.15Å; Y331-A698 HydrophobicContact CD1-CB 3.3Å; Y331-A698 HydrophobicContact CE1-CB 3.58Å; Y331-A698 HydrophobicContact CG-CB 4.31Å; L694-A698 WeakPolarHBondContact O-CB 3.34Å; L694-A698 PolarHBondContact O-N 3.49Å; D695-A698 PolarHBondContact O-N 3.43Å; K696-A698 VanDerWaalsContact C-N 3.31Å; K696-A698 PolarHBondContact O-N 3.48Å; A698-L704 HydrophobicContact CB-CD2 3.94Å
699	K	86	Confident	86.8	Confident	139 Å²	139	59.1 Å²	59.1	60%	0.604	28%	0.283	S	S	*	.	H	α-helix	trans	-71.9	-28.7	176.9	-71.7	168.2	-179.5	166.4	0	112.8	R322 D695 K696 L697	R322-K699 PolarHBondContact NH2-O 3Å; D695-K699 VanDerWaalsContact CG-NZ 3.27Å; D695-K699 WeakPolarHBondContact O-CG 3.31Å; D695-K699 PolarHBondContact O-N 2.97Å; D695-K699 WeakPolarHBondContact OD1-CE 3.34Å; D695-K699 IonicContact OD1-NZ 2.69Å; D695-K699 PolarHBondContact OD1-NZ 3.44Å; D695-K699 VanDerWaalsContact OD1-NZ 3.09Å; D695-K699 IonicContact OD2-NZ 2.86Å; D695-K699 PolarHBondContact OD2-NZ 3.47Å; K696-K699 PolarHBondContact O-N 2.95Å; L697-K699 VanDerWaalsContact C-N 3.34Å
700	Q	84.9	Confident	86.5	Confident	72 Å²	72	57 Å²	57	34%	0.336	28%	0.276	S	S	.	.	S	Bend	trans	-81.1	134.1	177.2	-70.3	178.8	-38.4	0	0	112.5	R322 K696 L697 C703	R322-Q700 PolarHBondContact NH2-O 2.87Å; K696-Q700 PolarHBondContact O-N 3Å; K696-Q700 VanDerWaalsContact O-N 3.12Å; L697-Q700 PolarHBondContact O-N 3.45Å; Q700-C703 HydrophobicContact CB-CB 3.95Å; Q700-C703 VanDerWaalsContact CB-SG 3.53Å; Q700-C703 PolarHBondContact OE1-SG 2.91Å
701	T	83.8	Confident	86.1	Confident	71 Å²	71	58.6 Å²	58.6	44%	0.436	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	136.1	177.1	45.7	0	0	0	0	110.5	C703	T701-C703 PolarHBondContact O-N 3.23Å; T701-C703 VanDerWaalsContact O-N 3.12Å
702	N	81.5	Confident	85.6	Confident	111 Å²	111	61.2 Å²	61.2	59%	0.594	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	4.4	175.2	-55.2	-25.3	0	0	0	116.7	N710	N702-N710 WeakPolarHBondContact O-CB 3.4Å; N702-N710 PolarHBondContact O-ND2 3.49Å
703	C	86.9	Confident	85.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-32	176.9	-70.5	0	0	0	0	113.5	L697 Q700 T701 T709 N710 C717	L697-C703 HydrophobicContact CB-CB 4.47Å; L697-C703 HydrophobicContact CD2-CB 3.91Å; Q700-C703 HydrophobicContact CB-CB 3.95Å; Q700-C703 VanDerWaalsContact CB-SG 3.53Å; Q700-C703 PolarHBondContact OE1-SG 2.91Å; T701-C703 PolarHBondContact O-N 3.23Å; T701-C703 VanDerWaalsContact O-N 3.12Å; C703-T709 WeakPolarHBondContact O-CA 2.99Å; C703-N710 PolarHBondContact O-N 3.15Å; C703-C717 WeakPolarHBondContact CA-SG 3.45Å; C703-C717 HydrophobicContact CB-CB 3.69Å; C703-C717 WeakPolarHBondContact CB-SG 3.42Å; C703-C717 VanDerWaalsContact SG-CA 3.53Å; C703-C717 WeakPolarHBondContact SG-CB 3.36Å; C703-C717 CovalentContact SG-SG 2.03Å; C703-C717 PolarHBondContact SG-SG 2.96Å
704	L	87	Confident	84.5	Confident	19 Å²	19	59.1 Å²	59.1	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.8	177.5	-167	65.6	0	0	0	109.8	V332 V333 L356 A698	V332-L704 HydrophobicContact CG1-CB 4.22Å; V332-L704 HydrophobicContact CG1-CD2 3.95Å; V332-L704 HydrophobicContact CG1-CG 3.72Å; V333-L704 HydrophobicContact CB-CD1 4.14Å; V333-L704 HydrophobicContact CB-CG 4.41Å; V333-L704 HydrophobicContact CG1-CD1 4.13Å; V333-L704 HydrophobicContact CG1-CD2 4.12Å; V333-L704 HydrophobicContact CG1-CG 4.45Å; L356-L704 HydrophobicContact CD1-CD1 3.61Å; A698-L704 HydrophobicContact CB-CD2 3.94Å
705	T	84.1	Confident	83.9	Confident	48 Å²	48	64.8 Å²	64.8	29%	0.294	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	173.7	178.4	69.6	0	0	0	0	109.9	Y707 G708	T705-Y707 PolarHBondContact O-N 2.95Å; T705-Y707 PolarHBondContact OG1-N 3.38Å; T705-G708 PolarHBondContact N-O 3.42Å; T705-G708 PolarHBondContact O-N 3.24Å; T705-G708 PolarHBondContact OG1-O 3.15Å
706	E	80.7	Confident	83.6	Confident	86 Å²	86	66.6 Å²	66.6	40%	0.402	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.8	173.5	-163.3	175.4	-177	0	0	112.7	R351 G708	R351-E706 VanDerWaalsContact CD-CG 3.49Å; R351-E706 VanDerWaalsContact CD-O 3.32Å; R351-E706 WeakPolarHBondContact CD-O 3.37Å; R351-E706 VanDerWaalsContact CZ-CG 3.4Å; R351-E706 IonicContact CZ-OE1 2.79Å; R351-E706 IonicContact NE-OE1 2.99Å; R351-E706 PolarHBondContact NE-OE1 3.06Å; R351-E706 IonicContact NH2-OE1 2.75Å; R351-E706 PolarHBondContact NH2-OE1 2.89Å; E706-G708 VanDerWaalsContact C-N 3.27Å; E706-G708 PolarHBondContact O-N 3.31Å
707	Y	81	Confident	83.3	Confident	183 Å²	183	61.4 Å²	61.4	72%	0.718	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-1.1	177.2	-55.5	-71.6	0	0	0	113.6	A354 H355 T705	A354-Y707 CarbonylContact C-O 3.52Å; A354-Y707 WeakPolarHBondContact CA-O 3.4Å; H355-Y707 PolarHBondContact N-O 3.47Å; T705-Y707 PolarHBondContact O-N 2.95Å; T705-Y707 PolarHBondContact OG1-N 3.38Å
708	G	86	Confident	82.9	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.01	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	109.5	-155.9	-177.8	0	0	0	0	0	113.6	T705 E706	T705-G708 PolarHBondContact N-O 3.42Å; T705-G708 PolarHBondContact O-N 3.24Å; T705-G708 PolarHBondContact OG1-O 3.15Å; E706-G708 VanDerWaalsContact C-N 3.27Å; E706-G708 PolarHBondContact O-N 3.31Å
709	T	86.4	Confident	82.2	Confident	7 Å²	7	64.7 Å²	64.7	4%	0.043	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	136	-177.7	-58.6	0	0	0	0	109.9	H355 L356 L697 C703 W711 L718	H355-T709 PolarHBondContact O-N 3.25Å; L356-T709 PolarHBondContact O-OG1 2.87Å; L697-T709 HydrophobicContact CD1-CG2 4.21Å; L697-T709 HydrophobicContact CD2-CG2 4.49Å; C703-T709 WeakPolarHBondContact O-CA 2.99Å; T709-W711 VanDerWaalsContact C-N 3.34Å; T709-W711 HydrophobicContact CG2-CD2 4.44Å; T709-W711 HydrophobicContact CG2-CZ2 4.49Å; T709-W711 PolarHBondContact O-N 3.11Å; T709-W711 PolarHBondContact O-NE1 3.04Å; T709-L718 HydrophobicContact CG2-CD2 3.92Å
710	N	85.8	Confident	81.7	Confident	47 Å²	47	65.5 Å²	65.5	25%	0.251	35%	0.351	S	S	.	.			trans	-77.3	86.5	174.8	-170	-9	0	0	0	110.6	N702 C703 S712 L713	N702-N710 WeakPolarHBondContact O-CB 3.4Å; N702-N710 PolarHBondContact O-ND2 3.49Å; C703-N710 PolarHBondContact O-N 3.15Å; N710-S712 PolarHBondContact O-N 3.43Å; N710-S712 VanDerWaalsContact O-N 3.15Å; N710-S712 WeakPolarHBondContact OD1-CB 3.44Å; N710-S712 PolarHBondContact OD1-N 3.14Å; N710-S712 PolarHBondContact OD1-OG 3.41Å; N710-L713 PolarHBondContact O-N 3.22Å
711	W	83.7	Confident	81.3	Confident	49 Å²	49	63.3 Å²	63.3	19%	0.186	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-12.3	-178.5	-63.2	98.4	0	0	0	114.5	H355 F357 K359 T709 L713 V714 L718 F723	H355-W711 PolarHBondContact O-NE1 2.95Å; H355-W711 VanDerWaalsContact O-NE1 3.07Å; F357-W711 WeakPolarHBondContact O-CH2 3.31Å; K359-W711 HydrophobicContact CG-CD2 3.89Å; K359-W711 HydrophobicContact CG-CE3 4.28Å; K359-W711 HydrophobicContact CG-CG 4.04Å; T709-W711 VanDerWaalsContact C-N 3.34Å; T709-W711 HydrophobicContact CG2-CD2 4.44Å; T709-W711 HydrophobicContact CG2-CZ2 4.49Å; T709-W711 PolarHBondContact O-N 3.11Å; T709-W711 PolarHBondContact O-NE1 3.04Å; W711-L713 VanDerWaalsContact C-N 3.32Å; W711-V714 WeakPolarHBondContact O-CG2 3.29Å; W711-L718 HydrophobicContact CE3-CD1 3.6Å; W711-L718 HydrophobicContact CE3-CD2 3.94Å; W711-L718 HydrophobicContact CE3-CG 4.47Å; W711-L718 HydrophobicContact CZ3-CD1 4.03Å; W711-L718 HydrophobicContact CZ3-CD2 3.87Å; W711-F723 AromaticContact CH2-CD1 3.9Å; W711-F723 HydrophobicContact CH2-CD1 3.9Å; W711-F723 AromaticContact CH2-CE1 3.98Å; W711-F723 HydrophobicContact CH2-CE1 3.98Å; W711-F723 HydrophobicContact CH2-CG 4.3Å; W711-F723 HydrophobicContact CH2-CZ 4.42Å
712	S	80.4	Confident	81.3	Confident	100 Å²	100	64.8 Å²	64.8	70%	0.699	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-26	175.5	72.4	0	0	0	0	112.4	N710 V714	N710-S712 PolarHBondContact O-N 3.43Å; N710-S712 VanDerWaalsContact O-N 3.15Å; N710-S712 WeakPolarHBondContact OD1-CB 3.44Å; N710-S712 PolarHBondContact OD1-N 3.14Å; N710-S712 PolarHBondContact OD1-OG 3.41Å; S712-V714 PolarHBondContact O-N 2.93Å
713	L	82.1	Confident	81.7	Confident	49 Å²	49	61.3 Å²	61.3	26%	0.257	32%	0.323	S	S	.	.			trans	-98.3	58.4	-173.8	-160.1	62.6	0	0	0	111.6	N710 W711 T715 Q716 C717	N710-L713 PolarHBondContact O-N 3.22Å; W711-L713 VanDerWaalsContact C-N 3.32Å; L713-T715 PolarHBondContact O-N 3.23Å; L713-Q716 HydrophobicContact CD1-CB 4.47Å; L713-Q716 HydrophobicContact CD2-CB 3.97Å; L713-Q716 HydrophobicContact CD2-CG 4.43Å; L713-Q716 VanDerWaalsContact CD2-OE1 3.3Å; L713-Q716 HydrophobicContact CG-CB 3.79Å; L713-Q716 PolarHBondContact O-N 3.38Å; L713-C717 WeakPolarHBondContact O-CB 3.45Å; L713-C717 PolarHBondContact O-N 2.88Å
714	V	75.3	Confident	82	Confident	63 Å²	63	61.9 Å²	61.9	38%	0.382	33%	0.326	S	S	.	.	I	π-helix	trans	-57.6	-46.5	-171.6	-177.5	0	0	0	0	112.3	W711 S712 Q716 L718 S719	W711-V714 WeakPolarHBondContact O-CG2 3.29Å; S712-V714 PolarHBondContact O-N 2.93Å; V714-Q716 PolarHBondContact O-N 2.75Å; V714-L718 HydrophobicContact CB-CD1 4.21Å; V714-L718 HydrophobicContact CG1-CB 4.27Å; V714-L718 HydrophobicContact CG1-CD1 4.17Å; V714-L718 HydrophobicContact CG2-CD1 4.04Å; V714-L718 WeakPolarHBondContact O-CA 2.99Å; V714-L718 WeakPolarHBondContact O-CB 3.31Å; V714-L718 PolarHBondContact O-N 3.33Å; V714-S719 PolarHBondContact O-N 3.11Å
715	T	76.8	Confident	82.2	Confident	121 Å²	121	62.3 Å²	62.3	74%	0.742	33%	0.331	S	S	*	.	I	π-helix	trans	-66.6	-34.7	-174.9	45.9	0	0	0	0	113.2	L713	L713-T715 PolarHBondContact O-N 3.23Å
716	Q	80.5	Confident	82.7	Confident	93 Å²	93	60.7 Å²	60.7	44%	0.435	32%	0.321	S	S	.	.	I	π-helix	trans	-91.7	-40.5	-177	-168.2	175.8	-11.4	0	0	113	L713 V714	L713-Q716 HydrophobicContact CD1-CB 4.47Å; L713-Q716 HydrophobicContact CD2-CB 3.97Å; L713-Q716 HydrophobicContact CD2-CG 4.43Å; L713-Q716 VanDerWaalsContact CD2-OE1 3.3Å; L713-Q716 HydrophobicContact CG-CB 3.79Å; L713-Q716 PolarHBondContact O-N 3.38Å; V714-Q716 PolarHBondContact O-N 2.75Å
717	C	82.2	Confident	83.3	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.332	C	S	.	.	I	π-helix	trans	-100.5	-27.6	-169.8	-56.3	0	0	0	0	113.1	L697 C703 L713 N721	L697-C717 HydrophobicContact CD2-CB 3.99Å; L697-C717 VanDerWaalsContact CD2-O 3.23Å; L697-C717 WeakPolarHBondContact CD2-O 3.45Å; C703-C717 WeakPolarHBondContact CA-SG 3.45Å; C703-C717 HydrophobicContact CB-CB 3.69Å; C703-C717 WeakPolarHBondContact CB-SG 3.42Å; C703-C717 VanDerWaalsContact SG-CA 3.53Å; C703-C717 WeakPolarHBondContact SG-CB 3.36Å; C703-C717 CovalentContact SG-SG 2.03Å; C703-C717 PolarHBondContact SG-SG 2.96Å; L713-C717 WeakPolarHBondContact O-CB 3.45Å; L713-C717 PolarHBondContact O-N 2.88Å; C717-N721 PolarHBondContact O-ND2 3.4Å
718	L	80.5	Confident	84	Confident	31 Å²	31	55.1 Å²	55.1	16%	0.162	30%	0.304	C	S	.	.	I	π-helix	trans	-105.9	-20.3	-171.2	-53.1	179.9	0	0	0	113.2	T709 W711 V714 D720 N721 F723	T709-L718 HydrophobicContact CG2-CD2 3.92Å; W711-L718 HydrophobicContact CE3-CD1 3.6Å; W711-L718 HydrophobicContact CE3-CD2 3.94Å; W711-L718 HydrophobicContact CE3-CG 4.47Å; W711-L718 HydrophobicContact CZ3-CD1 4.03Å; W711-L718 HydrophobicContact CZ3-CD2 3.87Å; V714-L718 HydrophobicContact CB-CD1 4.21Å; V714-L718 HydrophobicContact CG1-CB 4.27Å; V714-L718 HydrophobicContact CG1-CD1 4.17Å; V714-L718 HydrophobicContact CG2-CD1 4.04Å; V714-L718 WeakPolarHBondContact O-CA 2.99Å; V714-L718 WeakPolarHBondContact O-CB 3.31Å; V714-L718 PolarHBondContact O-N 3.33Å; L718-D720 PolarHBondContact O-N 3.38Å; L718-N721 PolarHBondContact O-N 2.98Å; L718-F723 HydrophobicContact CD2-CE2 3.7Å; L718-F723 HydrophobicContact CD2-CZ 3.59Å
719	S	71.6	Confident	84.4	Confident	69 Å²	69	55.6 Å²	55.6	48%	0.483	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	132.4	177.9	102.1	0	0	0	0	110.5	V714 N721	V714-S719 PolarHBondContact O-N 3.11Å; S719-N721 PolarHBondContact O-N 2.9Å
720	D	75.4	Confident	84.8	Confident	156 Å²	156	55.7 Å²	55.7	83%	0.834	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	0.3	-175.7	-63.2	-27.3	0	0	0	118.1	L718	L718-D720 PolarHBondContact O-N 3.38Å
721	N	75.5	Confident	85.2	Confident	25 Å²	25	56.2 Å²	56.2	13%	0.134	31%	0.309	C	S	.	.			trans	-92.7	134.1	-177.5	-79.7	-29.6	0	0	0	112.4	T693 C717 L718 S719 F723	T693-N721 HydrophobicContact CG2-CB 3.63Å; C717-N721 PolarHBondContact O-ND2 3.4Å; L718-N721 PolarHBondContact O-N 2.98Å; S719-N721 PolarHBondContact O-N 2.9Å; N721-F723 HydrophobicContact CB-CD2 4.46Å; N721-F723 HydrophobicContact CB-CE2 3.73Å; N721-F723 HydrophobicContact CB-CZ 4.35Å
722	Q	84	Confident	85.8	Confident	102 Å²	102	55.4 Å²	55.4	48%	0.477	31%	0.307	S	S	.	.			trans	-93.5	126.4	177.3	-67.5	-176.5	0.3	0	0	110.2	T693	T693-Q722 PolarHBondContact OG1-O 3.21Å
723	F	89.1	Confident	86.6	Confident	39 Å²	39	51.5 Å²	51.5	17%	0.171	28%	0.278	C	S	.	.			trans	-115.1	157.9	174.6	-67.5	-91.8	0	0	0	109.8	F357 W690 T693 L697 W711 L718 N721	F357-F723 HydrophobicContact CD1-CD1 4.02Å; W690-F723 PolarHBondContact NE1-O 2.92Å; T693-F723 HydrophobicContact CG2-CE1 4.19Å; T693-F723 HydrophobicContact CG2-CE2 4.24Å; T693-F723 HydrophobicContact CG2-CZ 3.94Å; L697-F723 HydrophobicContact CD1-CE1 3.97Å; L697-F723 HydrophobicContact CD1-CZ 3.86Å; W711-F723 AromaticContact CH2-CD1 3.9Å; W711-F723 HydrophobicContact CH2-CD1 3.9Å; W711-F723 AromaticContact CH2-CE1 3.98Å; W711-F723 HydrophobicContact CH2-CE1 3.98Å; W711-F723 HydrophobicContact CH2-CG 4.3Å; W711-F723 HydrophobicContact CH2-CZ 4.42Å; L718-F723 HydrophobicContact CD2-CE2 3.7Å; L718-F723 HydrophobicContact CD2-CZ 3.59Å; N721-F723 HydrophobicContact CB-CD2 4.46Å; N721-F723 HydrophobicContact CB-CE2 3.73Å; N721-F723 HydrophobicContact CB-CZ 4.35Å
724	P	93	Very high	87.3	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.071	28%	0.276	C	S	.	.			trans	-66.4	133.2	174.1	28.3	-35.4	0	0	0	111.1	F357 Y358 W690	F357-P724 HydrophobicContact CB-CG 3.58Å; F357-P724 HydrophobicContact CD1-CG 4.01Å; F357-P724 HydrophobicContact CD2-CG 4.45Å; F357-P724 HydrophobicContact CG-CG 3.78Å; Y358-P724 HydrophobicContact CE1-CB 4.37Å; Y358-P724 HydrophobicContact CE1-CG 3.95Å; Y358-P724 WeakPolarHBondContact CE1-O 3.28Å; Y358-P724 HydrophobicContact CE2-CG 4.19Å; Y358-P724 WeakPolarHBondContact OH-CB 3.44Å; Y358-P724 WeakPolarHBondContact OH-CG 3.46Å; W690-P724 HydrophobicContact CD2-CB 3.94Å; W690-P724 HydrophobicContact CD2-CG 4.42Å; W690-P724 HydrophobicContact CE3-CB 4.01Å; W690-P724 HydrophobicContact CH2-CB 3.67Å; W690-P724 VanDerWaalsContact CZ2-CA 3.49Å; W690-P724 HydrophobicContact CZ2-CB 3.6Å; W690-P724 HydrophobicContact CZ3-CB 3.89Å
725	S	92.9	Very high	88.3	Confident	29 Å²	29	50.1 Å²	50.1	20%	0.203	27%	0.266	C	S	.	.			trans	-73.7	127	179.1	57.6	0	0	0	0	111.8	Y682 E727 A728 N729	Y682-S725 WeakPolarHBondContact CE1-OG 3.24Å; Y682-S725 PolarHBondContact OH-N 3.01Å; Y682-S725 PolarHBondContact OH-OG 3.13Å; S725-E727 VanDerWaalsContact C-N 3.27Å; S725-E727 WeakPolarHBondContact CB-OE2 3.26Å; S725-E727 PolarHBondContact O-N 3.31Å; S725-A728 WeakPolarHBondContact OG-CB 3.27Å; S725-N729 PolarHBondContact O-ND2 3.03Å
726	V	93.7	Very high	89.2	Confident	13 Å²	13	44.9 Å²	44.9	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-63.5	-38.4	173.8	177.4	0	0	0	0	110.1	Y358 E362 L548 A728 N729 M730	Y358-V726 HydrophobicContact CD1-CG2 3.34Å; Y358-V726 HydrophobicContact CE1-CG2 3.59Å; Y358-V726 HydrophobicContact CG-CG2 4.5Å; E362-V726 HydrophobicContact CB-CG1 4.5Å; E362-V726 HydrophobicContact CB-CG2 4Å; E362-V726 HydrophobicContact CG-CG2 4.14Å; L548-V726 HydrophobicContact CD1-CG1 4.35Å; L548-V726 HydrophobicContact CD1-CG2 4.36Å; L548-V726 HydrophobicContact CD2-CG1 4.32Å; V726-A728 PolarHBondContact O-N 3.32Å; V726-N729 PolarHBondContact O-N 3.01Å; V726-M730 HydrophobicContact CG1-CE 4.3Å; V726-M730 HydrophobicContact CG1-CG 4.07Å; V726-M730 WeakPolarHBondContact O-CG 3.43Å; V726-M730 PolarHBondContact O-N 3.31Å
727	E	94.1	Very high	90	Very high	137 Å²	137	40.4 Å²	40.4	64%	0.64	21%	0.214	S	C	*	.	H	α-helix	trans	-61.4	-41.6	-176.7	-56.9	78.6	-174.2	0	0	111.7	S725 M730 L731	S725-E727 VanDerWaalsContact C-N 3.27Å; S725-E727 WeakPolarHBondContact CB-OE2 3.26Å; S725-E727 PolarHBondContact O-N 3.31Å; E727-M730 PolarHBondContact O-N 2.92Å; E727-L731 VanDerWaalsContact O-CB 3.27Å; E727-L731 WeakPolarHBondContact O-CB 3.28Å; E727-L731 PolarHBondContact O-N 3.05Å
728	A	94.9	Very high	90.6	Very high	16 Å²	16	41.8 Å²	41.8	13%	0.132	22%	0.222	C	C	.	.	H	α-helix	trans	-64.4	-42.5	176.9	0	0	0	0	0	111.6	V679 Y682 S725 V726 L731 Q732	V679-A728 HydrophobicContact CG1-CB 4.01Å; V679-A728 WeakPolarHBondContact CG1-O 3.15Å; V679-A728 HydrophobicContact CG2-CB 4.39Å; Y682-A728 HydrophobicContact CD1-CB 4.27Å; Y682-A728 HydrophobicContact CE1-CB 4.23Å; S725-A728 WeakPolarHBondContact OG-CB 3.27Å; V726-A728 PolarHBondContact O-N 3.32Å; A728-L731 PolarHBondContact O-N 3.04Å; A728-Q732 WeakPolarHBondContact O-CB 3.43Å; A728-Q732 PolarHBondContact O-N 2.95Å
729	N	93.6	Very high	91.2	Very high	11 Å²	11	40.4 Å²	40.4	6%	0.059	22%	0.215	C	C	.	.	H	α-helix	trans	-64.2	-41.9	176	-73.3	-74.7	0	0	0	111.5	Y358 L548 S725 V726 L731 Q732 I733	Y358-N729 PolarHBondContact OH-ND2 3.46Å; L548-N729 HydrophobicContact CD2-CB 3.65Å; S725-N729 PolarHBondContact O-ND2 3.03Å; V726-N729 PolarHBondContact O-N 3.01Å; N729-L731 PolarHBondContact O-N 2.98Å; N729-Q732 WeakPolarHBondContact O-CB 3.49Å; N729-Q732 PolarHBondContact O-N 2.97Å; N729-I733 WeakPolarHBondContact O-CG1 3.19Å; N729-I733 PolarHBondContact O-N 3.23Å; N729-I733 VanDerWaalsContact O-N 3.12Å
730	M	95.1	Very high	92.2	Very high	9 Å²	9	37.1 Å²	37.1	4%	0.044	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-40.7	176.1	-66.7	-50.2	109.4	0	0	112.3	F365 A366 W369 L548 V726 E727 I733 F734	F365-M730 HydrophobicContact CE1-CG 4.27Å; A366-M730 HydrophobicContact CB-CE 3.35Å; A366-M730 HydrophobicContact CB-SD 3.88Å; W369-M730 HydrophobicContact CB-SD 4.04Å; W369-M730 VanDerWaalsContact CD1-SD 3.52Å; W369-M730 HydrophobicContact CG-SD 3.88Å; W369-M730 PolarHBondContact NE1-O 3.48Å; L548-M730 HydrophobicContact CD2-CE 3.61Å; L548-M730 HydrophobicContact CG-CE 4.17Å; V726-M730 HydrophobicContact CG1-CE 4.3Å; V726-M730 HydrophobicContact CG1-CG 4.07Å; V726-M730 WeakPolarHBondContact O-CG 3.43Å; V726-M730 PolarHBondContact O-N 3.31Å; E727-M730 PolarHBondContact O-N 2.92Å; M730-I733 HydrophobicContact CE-CD1 4.45Å; M730-I733 PolarHBondContact O-N 3.23Å; M730-F734 WeakPolarHBondContact O-CB 3.46Å; M730-F734 PolarHBondContact O-N 2.97Å
731	L	95.6	Very high	93	Very high	58 Å²	58	30.8 Å²	30.8	30%	0.304	16%	0.158	S	C	.	.	H	α-helix	trans	-62.1	-43.8	175.1	179.7	65	0	0	0	111.1	C675 E727 A728 N729 I733 F734 M735	C675-L731 VanDerWaalsContact SG-CD2 3.59Å; E727-L731 VanDerWaalsContact O-CB 3.27Å; E727-L731 WeakPolarHBondContact O-CB 3.28Å; E727-L731 PolarHBondContact O-N 3.05Å; A728-L731 PolarHBondContact O-N 3.04Å; N729-L731 PolarHBondContact O-N 2.98Å; L731-I733 VanDerWaalsContact C-N 3.35Å; L731-I733 PolarHBondContact O-N 3.13Å; L731-F734 HydrophobicContact CD1-CD1 4.43Å; L731-F734 PolarHBondContact O-N 3.04Å; L731-M735 HydrophobicContact CD1-CE 3.63Å; L731-M735 HydrophobicContact CD1-CG 3.92Å; L731-M735 HydrophobicContact CG-CG 4.29Å; L731-M735 VanDerWaalsContact O-CB 3.32Å; L731-M735 WeakPolarHBondContact O-CB 3.27Å; L731-M735 VanDerWaalsContact O-CG 3.24Å; L731-M735 WeakPolarHBondContact O-CG 3.39Å; L731-M735 PolarHBondContact O-N 3.38Å
732	Q	96.5	Very high	93.8	Very high	31 Å²	31	31.7 Å²	31.7	15%	0.145	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-45.4	177	178.8	176.5	7.4	0	0	112	V676 V679 N680 A728 N729 S736	V676-Q732 HydrophobicContact CG1-CG 4.18Å; V676-Q732 HydrophobicContact CG2-CG 4.35Å; V679-Q732 HydrophobicContact CB-CB 4.03Å; V679-Q732 HydrophobicContact CB-CG 4.46Å; V679-Q732 HydrophobicContact CG1-CB 3.88Å; V679-Q732 HydrophobicContact CG1-CG 4.43Å; V679-Q732 HydrophobicContact CG2-CB 4.21Å; N680-Q732 PolarHBondContact OD1-NE2 3.32Å; A728-Q732 WeakPolarHBondContact O-CB 3.43Å; A728-Q732 PolarHBondContact O-N 2.95Å; N729-Q732 WeakPolarHBondContact O-CB 3.49Å; N729-Q732 PolarHBondContact O-N 2.97Å; Q732-S736 WeakPolarHBondContact O-CB 3.44Å; Q732-S736 PolarHBondContact O-N 2.88Å; Q732-S736 PolarHBondContact O-OG 3.23Å
733	I	95.7	Very high	93.8	Very high	18 Å²	18	26.9 Å²	26.9	9%	0.092	14%	0.142	C	C	.	.	H	α-helix	trans	-68.1	-45	-179.8	-62.5	168.8	0	0	0	110.6	M370 F416 T549 N729 M730 L731 M735 S736 L737	M370-I733 HydrophobicContact CG-CD1 3.6Å; M370-I733 HydrophobicContact CG-CG2 4.1Å; M370-I733 HydrophobicContact SD-CD1 3.6Å; M370-I733 VanDerWaalsContact SD-CD1 3.6Å; F416-I733 HydrophobicContact CE1-CG2 4.12Å; F416-I733 HydrophobicContact CZ-CG2 4.31Å; T549-I733 HydrophobicContact CG2-CD1 4.1Å; N729-I733 WeakPolarHBondContact O-CG1 3.19Å; N729-I733 PolarHBondContact O-N 3.23Å; N729-I733 VanDerWaalsContact O-N 3.12Å; M730-I733 HydrophobicContact CE-CD1 4.45Å; M730-I733 PolarHBondContact O-N 3.23Å; L731-I733 VanDerWaalsContact C-N 3.35Å; L731-I733 PolarHBondContact O-N 3.13Å; I733-M735 PolarHBondContact O-N 3.03Å; I733-S736 WeakPolarHBondContact O-CB 3.44Å; I733-S736 PolarHBondContact O-N 3.15Å; I733-S736 VanDerWaalsContact O-N 3.16Å; I733-L737 HydrophobicContact CG2-CD1 3.86Å; I733-L737 PolarHBondContact O-N 3.36Å
734	F	96.5	Very high	93.4	Very high	47 Å²	47	25 Å²	25	21%	0.206	13%	0.134	C	C	.	.	H	α-helix	trans	-56.6	-51.1	175.7	168.6	-109.2	0	0	0	111.7	W369 W373 M730 L731 S736 L737 V738	W369-F734 HydrophobicContact CZ2-CB 4.1Å; W369-F734 HydrophobicContact CZ2-CG 4.4Å; W373-F734 AromaticContact CD2-CD2 3.79Å; W373-F734 HydrophobicContact CD2-CD2 3.79Å; W373-F734 HydrophobicContact CD2-CE2 4.21Å; W373-F734 AromaticContact CE2-CD2 3.52Å; W373-F734 AromaticContact CE2-CE2 3.89Å; W373-F734 HydrophobicContact CE3-CD2 4.12Å; W373-F734 HydrophobicContact CE3-CE2 4.14Å; W373-F734 HydrophobicContact CG-CD2 4.37Å; W373-F734 HydrophobicContact CH2-CD2 4.02Å; W373-F734 AromaticContact CH2-CE2 3.48Å; W373-F734 HydrophobicContact CH2-CE2 3.48Å; W373-F734 VanDerWaalsContact CH2-CE2 3.48Å; W373-F734 AromaticContact CZ2-CD2 3.65Å; W373-F734 HydrophobicContact CZ2-CD2 3.65Å; W373-F734 AromaticContact CZ2-CE2 3.52Å; W373-F734 HydrophobicContact CZ2-CE2 3.52Å; W373-F734 HydrophobicContact CZ3-CD2 4.23Å; W373-F734 AromaticContact CZ3-CE2 3.8Å; W373-F734 HydrophobicContact CZ3-CE2 3.8Å; W373-F734 AromaticContact NE1-CD2 3.92Å; M730-F734 WeakPolarHBondContact O-CB 3.46Å; M730-F734 PolarHBondContact O-N 2.97Å; L731-F734 HydrophobicContact CD1-CD1 4.43Å; L731-F734 PolarHBondContact O-N 3.04Å; F734-S736 PolarHBondContact O-N 3.33Å; F734-L737 PolarHBondContact O-N 3.17Å; F734-L737 VanDerWaalsContact O-N 3.14Å; F734-V738 HydrophobicContact CE2-CB 4.48Å; F734-V738 HydrophobicContact CE2-CG2 4.46Å; F734-V738 HydrophobicContact CZ-CB 4.49Å; F734-V738 HydrophobicContact CZ-CG2 4.27Å; F734-V738 WeakPolarHBondContact O-CB 3.21Å; F734-V738 PolarHBondContact O-N 3.3Å
735	M	96.5	Very high	92.8	Very high	36 Å²	36	29.3 Å²	29.3	18%	0.177	15%	0.154	C	C	.	.	H	α-helix	trans	-67.3	-24.1	179.3	-67.9	-64	178.6	0	0	112.7	P672 C675 V676 L731 I733 V738	P672-M735 HydrophobicContact CB-CB 4.16Å; P672-M735 WeakPolarHBondContact CB-O 3.4Å; P672-M735 HydrophobicContact CB-SD 4.26Å; C675-M735 HydrophobicContact CB-CB 4.25Å; C675-M735 HydrophobicContact CB-CG 3.93Å; V676-M735 HydrophobicContact CG2-CB 3.99Å; L731-M735 HydrophobicContact CD1-CE 3.63Å; L731-M735 HydrophobicContact CD1-CG 3.92Å; L731-M735 HydrophobicContact CG-CG 4.29Å; L731-M735 VanDerWaalsContact O-CB 3.32Å; L731-M735 WeakPolarHBondContact O-CB 3.27Å; L731-M735 VanDerWaalsContact O-CG 3.24Å; L731-M735 WeakPolarHBondContact O-CG 3.39Å; L731-M735 PolarHBondContact O-N 3.38Å; I733-M735 PolarHBondContact O-N 3.03Å; M735-V738 HydrophobicContact SD-CG1 4.32Å
736	S	96.2	Very high	92.1	Very high	11 Å²	11	28.9 Å²	28.9	8%	0.077	15%	0.148	C	C	.	.	H	α-helix	trans	-70.1	-44.8	170.6	-60	0	0	0	0	111.4	Y409 V676 Q732 I733 F734	Y409-S736 WeakPolarHBondContact CE1-O 3.44Å; Y409-S736 PolarHBondContact OH-O 2.86Å; V676-S736 WeakPolarHBondContact CG2-OG 3.46Å; Q732-S736 WeakPolarHBondContact O-CB 3.44Å; Q732-S736 PolarHBondContact O-N 2.88Å; Q732-S736 PolarHBondContact O-OG 3.23Å; I733-S736 WeakPolarHBondContact O-CB 3.44Å; I733-S736 PolarHBondContact O-N 3.15Å; I733-S736 VanDerWaalsContact O-N 3.16Å; F734-S736 PolarHBondContact O-N 3.33Å
737	L	96.6	Very high	91.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-81.5	-28	-174.3	-67.3	167.7	0	0	0	113.8	W373 C377 Y412 F416 I733 F734 V739 G740 I741	W373-L737 HydrophobicContact CB-CB 4.43Å; W373-L737 HydrophobicContact CB-CD1 3.55Å; C377-L737 HydrophobicContact CB-CB 4.28Å; C377-L737 HydrophobicContact CB-CD2 4.03Å; Y412-L737 HydrophobicContact CD1-CD2 3.97Å; Y412-L737 HydrophobicContact CE1-CD2 4.13Å; F416-L737 HydrophobicContact CD2-CD2 4.36Å; F416-L737 HydrophobicContact CE2-CD2 4.25Å; I733-L737 HydrophobicContact CG2-CD1 3.86Å; I733-L737 PolarHBondContact O-N 3.36Å; F734-L737 PolarHBondContact O-N 3.17Å; F734-L737 VanDerWaalsContact O-N 3.14Å; L737-V739 PolarHBondContact O-N 3.24Å; L737-V739 VanDerWaalsContact O-N 3.16Å; L737-G740 PolarHBondContact O-N 3.5Å; L737-G740 VanDerWaalsContact O-N 3.14Å; L737-I741 PolarHBondContact O-N 3.5Å
738	V	95.2	Very high	90.6	Very high	28 Å²	28	28.1 Å²	28.1	17%	0.17	14%	0.138	C	C	.	.	H	α-helix	trans	-60.5	-28.3	-177.4	76	0	0	0	0	113.1	P672 F734 M735 I741 T742	P672-V738 HydrophobicContact CB-CG1 3.87Å; P672-V738 HydrophobicContact CG-CG1 3.78Å; F734-V738 HydrophobicContact CE2-CB 4.48Å; F734-V738 HydrophobicContact CE2-CG2 4.46Å; F734-V738 HydrophobicContact CZ-CB 4.49Å; F734-V738 HydrophobicContact CZ-CG2 4.27Å; F734-V738 WeakPolarHBondContact O-CB 3.21Å; F734-V738 PolarHBondContact O-N 3.3Å; M735-V738 HydrophobicContact SD-CG1 4.32Å; V738-I741 PolarHBondContact O-N 2.95Å; V738-T742 HydrophobicContact CG2-CG2 4.22Å; V738-T742 WeakPolarHBondContact O-CB 3.26Å; V738-T742 WeakPolarHBondContact O-CG2 3.15Å; V738-T742 PolarHBondContact O-N 3.02Å; V738-T742 PolarHBondContact O-OG1 2.98Å
739	V	93	Very high	89.8	Confident	2 Å²	2	32.4 Å²	32.4	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.9	-178.7	0	0	0	0	111	I405 Y409 Y669 P672 L737 T742 S743	I405-V739 HydrophobicContact CG2-CG1 4.25Å; Y409-V739 HydrophobicContact CD2-CB 4.47Å; Y409-V739 HydrophobicContact CD2-CG1 4.29Å; Y409-V739 HydrophobicContact CE1-CB 4.44Å; Y409-V739 HydrophobicContact CE2-CB 3.65Å; Y409-V739 HydrophobicContact CE2-CG1 3.44Å; Y409-V739 VanDerWaalsContact CE2-CG1 3.44Å; Y409-V739 WeakPolarHBondContact OH-CB 3.3Å; Y669-V739 HydrophobicContact CD1-CG1 4.23Å; Y669-V739 HydrophobicContact CD2-CG1 3.92Å; Y669-V739 HydrophobicContact CE1-CG1 4.15Å; Y669-V739 HydrophobicContact CE2-CG1 3.86Å; Y669-V739 HydrophobicContact CG-CG1 4.13Å; P672-V739 HydrophobicContact CB-CG2 3.76Å; P672-V739 HydrophobicContact CG-CG2 4.01Å; L737-V739 PolarHBondContact O-N 3.24Å; L737-V739 VanDerWaalsContact O-N 3.16Å; V739-T742 WeakPolarHBondContact CA-OG1 3.25Å; V739-T742 PolarHBondContact O-N 3.34Å; V739-T742 PolarHBondContact O-OG1 2.6Å; V739-S743 PolarHBondContact O-N 2.79Å; V739-S743 PolarHBondContact O-OG 3.07Å
740	G	93.2	Very high	88.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-68.2	-34.9	175.5	0	0	0	0	0	113.2	L737 S743 G744	L737-G740 PolarHBondContact O-N 3.5Å; L737-G740 VanDerWaalsContact O-N 3.14Å; G740-S743 PolarHBondContact O-OG 2.79Å; G740-G744 PolarHBondContact O-N 2.83Å
741	I	93.1	Very high	87.8	Confident	24 Å²	24	43.3 Å²	43.3	12%	0.123	21%	0.21	C	C	.	.	H	α-helix	trans	-64.9	-49.8	175.1	-62.7	172	0	0	0	110	W373 L376 C377 S380 L737 V738 S743 G744 M745	W373-I741 HydrophobicContact CE3-CD1 3.72Å; W373-I741 HydrophobicContact CZ3-CD1 3.95Å; L376-I741 HydrophobicContact CB-CD1 4.03Å; C377-I741 HydrophobicContact CB-CD1 4.49Å; C377-I741 HydrophobicContact CB-CG1 4.03Å; S380-I741 PolarHBondContact OG-O 3.21Å; S380-I741 VanDerWaalsContact OG-O 3.06Å; L737-I741 PolarHBondContact O-N 3.5Å; V738-I741 PolarHBondContact O-N 2.95Å; I741-S743 PolarHBondContact O-N 2.98Å; I741-G744 PolarHBondContact O-N 2.93Å; I741-M745 HydrophobicContact CG2-CG 4.39Å; I741-M745 HydrophobicContact CG2-SD 4.04Å; I741-M745 WeakPolarHBondContact O-CG 3.4Å; I741-M745 PolarHBondContact O-N 3.37Å
742	T	90.6	Very high	86.7	Confident	44 Å²	44	47 Å²	47	27%	0.27	22%	0.224	S	C	.	.	H	α-helix	trans	-67.3	-34	-177.9	54.3	0	0	0	0	113.2	Y669 V738 V739 W746	Y669-T742 WeakPolarHBondContact CE1-OG1 3.44Å; V738-T742 HydrophobicContact CG2-CG2 4.22Å; V738-T742 WeakPolarHBondContact O-CB 3.26Å; V738-T742 WeakPolarHBondContact O-CG2 3.15Å; V738-T742 PolarHBondContact O-N 3.02Å; V738-T742 PolarHBondContact O-OG1 2.98Å; V739-T742 WeakPolarHBondContact CA-OG1 3.25Å; V739-T742 PolarHBondContact O-N 3.34Å; V739-T742 PolarHBondContact O-OG1 2.6Å; T742-W746 WeakPolarHBondContact O-CB 3.36Å; T742-W746 PolarHBondContact O-N 2.96Å
743	S	85.2	Confident	85.6	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-39	173.4	67	0	0	0	0	111.9	S406 Y669 V739 G740 I741 W746 V747	S406-S743 WeakPolarHBondContact OG-CB 3.44Å; S406-S743 PolarHBondContact OG-OG 3.22Å; Y669-S743 WeakPolarHBondContact OH-CA 3.2Å; Y669-S743 WeakPolarHBondContact OH-CB 3.21Å; Y669-S743 PolarHBondContact OH-N 3.02Å; V739-S743 PolarHBondContact O-N 2.79Å; V739-S743 PolarHBondContact O-OG 3.07Å; G740-S743 PolarHBondContact O-OG 2.79Å; I741-S743 PolarHBondContact O-N 2.98Å; S743-W746 WeakPolarHBondContact O-CB 3.47Å; S743-W746 PolarHBondContact O-N 2.92Å; S743-V747 PolarHBondContact O-N 3.4Å
744	G	80.7	Confident	84.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-75.6	-36	177	0	0	0	0	0	114.3	S380 T384 G740 I741 W746 V747 W748	S380-G744 VanDerWaalsContact OG-CA 3.31Å; S380-G744 WeakPolarHBondContact OG-CA 3.4Å; T384-G744 WeakPolarHBondContact OG1-CA 3.3Å; G740-G744 PolarHBondContact O-N 2.83Å; I741-G744 PolarHBondContact O-N 2.93Å; G744-W746 VanDerWaalsContact C-N 3.3Å; G744-W746 PolarHBondContact O-N 3.12Å; G744-V747 PolarHBondContact O-N 3.38Å; G744-W748 PolarHBondContact O-N 3.3Å
745	M	80.2	Confident	83.5	Confident	102 Å²	102	48 Å²	48	50%	0.502	23%	0.233	S	C	.	.	H	α-helix	trans	-61.4	-39.6	170.4	-68.6	-176.6	87.8	0	0	111.5	I741 V747 W748 C749	I741-M745 HydrophobicContact CG2-CG 4.39Å; I741-M745 HydrophobicContact CG2-SD 4.04Å; I741-M745 WeakPolarHBondContact O-CG 3.4Å; I741-M745 PolarHBondContact O-N 3.37Å; M745-V747 VanDerWaalsContact C-N 3.29Å; M745-V747 PolarHBondContact O-N 3.41Å; M745-W748 PolarHBondContact O-N 3.39Å; M745-C749 VanDerWaalsContact O-CB 3.26Å; M745-C749 WeakPolarHBondContact O-CB 3.26Å; M745-C749 PolarHBondContact O-N 3.15Å; M745-C749 PolarHBondContact O-SG 3.5Å
746	W	78.4	Confident	82.4	Confident	20 Å²	20	48.3 Å²	48.3	8%	0.076	24%	0.237	C	C	.	.	H	α-helix	trans	-55.3	-44.7	175.4	163.2	-92.1	0	0	0	112.8	K661 I662 F665 T742 S743 G744	K661-W746 HydrophobicContact CB-CH2 3.61Å; K661-W746 HydrophobicContact CB-CZ3 4.21Å; K661-W746 HydrophobicContact CD-CE3 4.35Å; K661-W746 HydrophobicContact CD-CH2 3.12Å; K661-W746 HydrophobicContact CD-CZ2 3.85Å; K661-W746 HydrophobicContact CD-CZ3 3.38Å; K661-W746 HydrophobicContact CG-CH2 3.23Å; K661-W746 HydrophobicContact CG-CZ2 4.35Å; K661-W746 HydrophobicContact CG-CZ3 3.39Å; K661-W746 VanDerWaalsContact NZ-CH2 3.27Å; I662-W746 HydrophobicContact CG1-CH2 4.5Å; I662-W746 HydrophobicContact CG1-CZ2 4.24Å; F665-W746 HydrophobicContact CB-CE3 4.49Å; F665-W746 HydrophobicContact CB-CZ3 4.24Å; F665-W746 HydrophobicContact CD1-CD2 4.37Å; F665-W746 AromaticContact CD1-CE3 3.57Å; F665-W746 HydrophobicContact CD1-CE3 3.57Å; F665-W746 AromaticContact CD1-CZ3 3.98Å; F665-W746 HydrophobicContact CD1-CZ3 3.98Å; F665-W746 AromaticContact CD2-CE3 3.57Å; F665-W746 HydrophobicContact CD2-CE3 3.57Å; F665-W746 HydrophobicContact CD2-CH2 4.04Å; F665-W746 AromaticContact CD2-CZ3 3.08Å; F665-W746 HydrophobicContact CD2-CZ3 3.08Å; F665-W746 HydrophobicContact CE1-CB 4.42Å; F665-W746 HydrophobicContact CE1-CD2 4.47Å; F665-W746 AromaticContact CE1-CE3 3.51Å; F665-W746 HydrophobicContact CE1-CE3 3.51Å; F665-W746 HydrophobicContact CE1-CZ3 4.09Å; F665-W746 AromaticContact CE2-CE3 3.49Å; F665-W746 HydrophobicContact CE2-CE3 3.49Å; F665-W746 VanDerWaalsContact CE2-CE3 3.49Å; F665-W746 HydrophobicContact CE2-CH2 4.43Å; F665-W746 AromaticContact CE2-CZ3 3.21Å; F665-W746 HydrophobicContact CE2-CZ3 3.21Å; F665-W746 HydrophobicContact CG-CD2 4.49Å; F665-W746 AromaticContact CG-CE3 3.57Å; F665-W746 HydrophobicContact CG-CE3 3.57Å; F665-W746 HydrophobicContact CG-CH2 4.34Å; F665-W746 AromaticContact CG-CZ3 3.47Å; F665-W746 HydrophobicContact CG-CZ3 3.47Å; F665-W746 VanDerWaalsContact CG-CZ3 3.47Å; F665-W746 AromaticContact CZ-CE3 3.45Å; F665-W746 HydrophobicContact CZ-CE3 3.45Å; F665-W746 VanDerWaalsContact CZ-CE3 3.45Å; F665-W746 AromaticContact CZ-CZ3 3.72Å; F665-W746 HydrophobicContact CZ-CZ3 3.72Å; T742-W746 WeakPolarHBondContact O-CB 3.36Å; T742-W746 PolarHBondContact O-N 2.96Å; S743-W746 WeakPolarHBondContact O-CB 3.47Å; S743-W746 PolarHBondContact O-N 2.92Å; G744-W746 VanDerWaalsContact C-N 3.3Å; G744-W746 PolarHBondContact O-N 3.12Å
747	V	81.2	Confident	81.3	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	24%	0.242	C	C	.	.	H	α-helix	trans	-69.5	-41.5	-179.9	174.5	0	0	0	0	110.2	T384 T387 F395 I403 S743 G744 M745 N750 S753	T384-V747 HydrophobicContact CG2-CB 4.29Å; T384-V747 HydrophobicContact CG2-CG2 3.8Å; T387-V747 HydrophobicContact CG2-CG1 3.77Å; F395-V747 HydrophobicContact CE1-CG1 4.17Å; F395-V747 HydrophobicContact CE1-CG2 4.15Å; F395-V747 HydrophobicContact CZ-CG1 3.77Å; I403-V747 HydrophobicContact CD1-CG2 4.41Å; S743-V747 PolarHBondContact O-N 3.4Å; G744-V747 PolarHBondContact O-N 3.38Å; M745-V747 VanDerWaalsContact C-N 3.29Å; M745-V747 PolarHBondContact O-N 3.41Å; V747-N750 WeakPolarHBondContact O-CB 3.12Å; V747-S753 WeakPolarHBondContact O-CB 3.35Å; V747-S753 PolarHBondContact O-OG 2.92Å
748	W	75.7	Confident	80.4	Confident	130 Å²	130	54.3 Å²	54.3	49%	0.492	26%	0.264	S	S	.	.	H	α-helix	trans	-81.1	-35.8	-173.5	-160.9	14.5	0	0	0	114.4	M383 G744 M745 N750	M383-W748 HydrophobicContact CE-CB 3.78Å; M383-W748 HydrophobicContact CE-CD2 3.6Å; M383-W748 HydrophobicContact CE-CE3 3.25Å; M383-W748 HydrophobicContact CE-CG 3.9Å; M383-W748 HydrophobicContact CE-CZ3 3.85Å; M383-W748 HydrophobicContact SD-CB 4.38Å; M383-W748 HydrophobicContact SD-CD2 3.28Å; M383-W748 HydrophobicContact SD-CE3 3.22Å; M383-W748 HydrophobicContact SD-CG 3.87Å; M383-W748 HydrophobicContact SD-CH2 3.69Å; M383-W748 HydrophobicContact SD-CZ2 3.81Å; M383-W748 HydrophobicContact SD-CZ3 3.4Å; M383-W748 WeakPolarHBondContact SD-CZ3 3.32Å; G744-W748 PolarHBondContact O-N 3.3Å; M745-W748 PolarHBondContact O-N 3.39Å; W748-N750 PolarHBondContact O-N 3.25Å
749	C	76.3	Confident	79.5	Confident	106 Å²	106	59.9 Å²	59.9	72%	0.716	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-8.6	175	-67.6	0	0	0	0	112.8	M745 R751	M745-C749 VanDerWaalsContact O-CB 3.26Å; M745-C749 WeakPolarHBondContact O-CB 3.26Å; M745-C749 PolarHBondContact O-N 3.15Å; M745-C749 PolarHBondContact O-SG 3.5Å; C749-R751 PolarHBondContact O-N 2.98Å
750	N	75.3	Confident	78.6	Confident	59 Å²	59	63.2 Å²	63.2	32%	0.316	31%	0.309	S	S	.	.	S	Bend	trans	-75.9	119.7	170.8	-169.1	-24.2	0	0	0	110.3	R394 V747 W748 K752 S753 S754	R394-N750 PolarHBondContact NH2-ND2 3.36Å; R394-N750 PolarHBondContact NH2-OD1 2Å; V747-N750 WeakPolarHBondContact O-CB 3.12Å; W748-N750 PolarHBondContact O-N 3.25Å; N750-K752 PolarHBondContact O-N 3.49Å; N750-K752 PolarHBondContact OD1-N 3.34Å; N750-S753 WeakPolarHBondContact O-CA 3.23Å; N750-S753 VanDerWaalsContact O-CB 3.25Å; N750-S753 WeakPolarHBondContact O-CB 3.38Å; N750-S753 PolarHBondContact O-N 3.05Å; N750-S754 PolarHBondContact O-N 3.47Å
751	R	72.8	Confident	77.8	Confident	189 Å²	189	69.6 Å²	69.6	71%	0.713	34%	0.34	S	S	*	.	H	α-helix	trans	-48.1	-37.6	179.4	179.6	177.9	171.8	165.7	4.6	114.1	C749 S753 S754 E755	C749-R751 PolarHBondContact O-N 2.98Å; R751-S753 PolarHBondContact O-N 3.17Å; R751-S754 PolarHBondContact O-N 2.89Å; R751-S754 PolarHBondContact O-OG 3.25Å; R751-E755 WeakPolarHBondContact CG-OE1 3.46Å; R751-E755 IonicContact CZ-OE1 3.77Å; R751-E755 IonicContact NE-OE1 2.93Å; R751-E755 PolarHBondContact NE-OE1 2.79Å; R751-E755 IonicContact NH2-OE1 3.75Å; R751-E755 WeakPolarHBondContact O-CG 3.41Å; R751-E755 PolarHBondContact O-N 2.93Å
752	K	72.8	Confident	76.9	Confident	137 Å²	137	72.7 Å²	72.7	60%	0.596	36%	0.36	S	S	*	.	H	α-helix	trans	-64.7	-32.3	177.7	-70.2	-176.5	-178.4	-176.3	0	112.1	R394 N750 T756	R394-K752 VanDerWaalsContact NH1-C 3.31Å; N750-K752 PolarHBondContact O-N 3.49Å; N750-K752 PolarHBondContact OD1-N 3.34Å; K752-T756 PolarHBondContact O-N 3.28Å; K752-T756 PolarHBondContact O-OG1 2.88Å
753	S	73	Confident	75.2	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-70	-47.7	177.3	-53.9	0	0	0	0	110.6	R394 V747 N750 R751 E755 T756 W757	R394-S753 VanDerWaalsContact CZ-OG 3.23Å; R394-S753 VanDerWaalsContact NH1-CA 3.25Å; R394-S753 PolarHBondContact NH1-OG 3.11Å; R394-S753 PolarHBondContact NH2-OG 3.45Å; V747-S753 WeakPolarHBondContact O-CB 3.35Å; V747-S753 PolarHBondContact O-OG 2.92Å; N750-S753 WeakPolarHBondContact O-CA 3.23Å; N750-S753 VanDerWaalsContact O-CB 3.25Å; N750-S753 WeakPolarHBondContact O-CB 3.38Å; N750-S753 PolarHBondContact O-N 3.05Å; R751-S753 PolarHBondContact O-N 3.17Å; S753-E755 VanDerWaalsContact C-N 3.26Å; S753-E755 PolarHBondContact O-N 3.21Å; S753-T756 WeakPolarHBondContact O-CB 3.45Å; S753-T756 PolarHBondContact O-N 3.06Å; S753-T756 VanDerWaalsContact O-N 3.13Å; S753-W757 PolarHBondContact O-N 3.39Å
754	S	70.9	Confident	73.3	Confident	42 Å²	42	80.9 Å²	80.9	29%	0.294	41%	0.409	S	S	.	.	H	α-helix	trans	-60.1	-38.7	177	59	0	0	0	0	111.6	N750 R751 W757 I758	N750-S754 PolarHBondContact O-N 3.47Å; R751-S754 PolarHBondContact O-N 2.89Å; R751-S754 PolarHBondContact O-OG 3.25Å; S754-W757 PolarHBondContact O-N 3.33Å; S754-I758 WeakPolarHBondContact O-CB 3.42Å; S754-I758 WeakPolarHBondContact O-CD1 3.47Å; S754-I758 WeakPolarHBondContact O-CG1 3.5Å; S754-I758 PolarHBondContact O-N 2.83Å
755	E	76.3	Confident	71.5	Confident	73 Å²	73	92.5 Å²	92.5	34%	0.341	45%	0.452	S	S	.	.	H	α-helix	trans	-62.7	-42.5	173.5	-72.8	172.2	-170.3	0	0	113	R751 S753 I758 K759	R751-E755 WeakPolarHBondContact CG-OE1 3.46Å; R751-E755 IonicContact CZ-OE1 3.77Å; R751-E755 IonicContact NE-OE1 2.93Å; R751-E755 PolarHBondContact NE-OE1 2.79Å; R751-E755 IonicContact NH2-OE1 3.75Å; R751-E755 WeakPolarHBondContact O-CG 3.41Å; R751-E755 PolarHBondContact O-N 2.93Å; S753-E755 VanDerWaalsContact C-N 3.26Å; S753-E755 PolarHBondContact O-N 3.21Å; E755-I758 PolarHBondContact O-N 3.42Å; E755-K759 VanDerWaalsContact O-CG 3.3Å; E755-K759 WeakPolarHBondContact O-CG 3.2Å; E755-K759 PolarHBondContact O-N 3.35Å
756	T	73.6	Confident	69.5	Low	43 Å²	43	95.1 Å²	95.1	26%	0.264	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-44.2	174	-60.7	0	0	0	0	111.5	K752 S753 K759 C760	K752-T756 PolarHBondContact O-N 3.28Å; K752-T756 PolarHBondContact O-OG1 2.88Å; S753-T756 WeakPolarHBondContact O-CB 3.45Å; S753-T756 PolarHBondContact O-N 3.06Å; S753-T756 VanDerWaalsContact O-N 3.13Å; T756-K759 PolarHBondContact O-N 3.05Å; T756-C760 WeakPolarHBondContact O-CB 3.3Å; T756-C760 PolarHBondContact O-N 2.94Å
757	W	73.8	Confident	67.5	Low	44 Å²	44	100.4 Å²	100.4	17%	0.167	49%	0.491	C	S	.	.	H	α-helix	trans	-66.2	-41.7	177.6	-82.4	97.2	0	0	0	112.1	M383 I386 T387 S753 S754 K759 C760 M761	M383-W757 HydrophobicContact CG-CH2 4.27Å; M383-W757 HydrophobicContact CG-CZ2 3.65Å; I386-W757 HydrophobicContact CB-CH2 4.11Å; I386-W757 HydrophobicContact CB-CZ2 4.08Å; I386-W757 HydrophobicContact CD1-CH2 4.4Å; I386-W757 HydrophobicContact CG2-CH2 3.52Å; I386-W757 HydrophobicContact CG2-CZ2 3.71Å; T387-W757 PolarHBondContact OG1-NE1 3.13Å; S753-W757 PolarHBondContact O-N 3.39Å; S754-W757 PolarHBondContact O-N 3.33Å; W757-K759 VanDerWaalsContact C-N 3.33Å; W757-K759 PolarHBondContact O-N 3.04Å; W757-C760 PolarHBondContact O-N 3.34Å; W757-M761 HydrophobicContact CB-CE 4.25Å; W757-M761 WeakPolarHBondContact O-CB 3.31Å; W757-M761 VanDerWaalsContact O-CG 3.31Å; W757-M761 WeakPolarHBondContact O-CG 3.37Å; W757-M761 PolarHBondContact O-N 3.07Å
758	I	76.4	Confident	65.6	Low	93 Å²	93	108.9 Å²	108.9	48%	0.477	54%	0.535	S	S	.	.	H	α-helix	trans	-59.6	-45.8	173.6	-70	162.7	0	0	0	110	S754 E755 C760 M761 T762	S754-I758 WeakPolarHBondContact O-CB 3.42Å; S754-I758 WeakPolarHBondContact O-CD1 3.47Å; S754-I758 WeakPolarHBondContact O-CG1 3.5Å; S754-I758 PolarHBondContact O-N 2.83Å; E755-I758 PolarHBondContact O-N 3.42Å; I758-C760 VanDerWaalsContact C-N 3.31Å; I758-C760 PolarHBondContact O-N 3.21Å; I758-M761 PolarHBondContact O-N 2.94Å; I758-T762 HydrophobicContact CG2-CG2 3.99Å; I758-T762 VanDerWaalsContact O-CB 3.26Å; I758-T762 WeakPolarHBondContact O-CB 3.44Å; I758-T762 VanDerWaalsContact O-CG2 3.24Å; I758-T762 WeakPolarHBondContact O-CG2 3.46Å; I758-T762 PolarHBondContact O-N 3.32Å; I758-T762 PolarHBondContact O-OG1 3.46Å
759	K	76.4	Confident	63.7	Low	146 Å²	146	108 Å²	108	64%	0.635	55%	0.549	S	S	*	.	H	α-helix	trans	-60.9	-39.2	176.5	-72.9	172.6	-177.2	177.6	0	112.5	E755 T756 W757	E755-K759 VanDerWaalsContact O-CG 3.3Å; E755-K759 WeakPolarHBondContact O-CG 3.2Å; E755-K759 PolarHBondContact O-N 3.35Å; T756-K759 PolarHBondContact O-N 3.05Å; W757-K759 VanDerWaalsContact C-N 3.33Å; W757-K759 PolarHBondContact O-N 3.04Å
760	C	75.1	Confident	61.8	Low	71 Å²	71	111.7 Å²	111.7	48%	0.48	55%	0.553	S	S	.	*	H	α-helix	trans	-69.1	-46.7	177.1	-169.6	0	0	0	0	112.2	T756 W757 I758	T756-C760 WeakPolarHBondContact O-CB 3.3Å; T756-C760 PolarHBondContact O-N 2.94Å; W757-C760 PolarHBondContact O-N 3.34Å; I758-C760 VanDerWaalsContact C-N 3.31Å; I758-C760 PolarHBondContact O-N 3.21Å
761	M	77	Confident	59.7	Low	135 Å²	135	116.1 Å²	116.1	67%	0.665	58%	0.576	S	S	*	*	H	α-helix	trans	-72.4	-34.8	-178	-69.9	-172.7	-65.1	0	0	112.9	W757 I758 G763	W757-M761 HydrophobicContact CB-CE 4.25Å; W757-M761 WeakPolarHBondContact O-CB 3.31Å; W757-M761 VanDerWaalsContact O-CG 3.31Å; W757-M761 WeakPolarHBondContact O-CG 3.37Å; W757-M761 PolarHBondContact O-N 3.07Å; I758-M761 PolarHBondContact O-N 2.94Å; M761-G763 PolarHBondContact O-N 3.41Å
762	T	73.4	Confident	57.7	Low	88 Å²	88	110.7 Å²	110.7	54%	0.54	58%	0.579	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	7	-179.8	56.3	0	0	0	0	113.8	I758 K764	I758-T762 HydrophobicContact CG2-CG2 3.99Å; I758-T762 VanDerWaalsContact O-CB 3.26Å; I758-T762 WeakPolarHBondContact O-CB 3.44Å; I758-T762 VanDerWaalsContact O-CG2 3.24Å; I758-T762 WeakPolarHBondContact O-CG2 3.46Å; I758-T762 PolarHBondContact O-N 3.32Å; I758-T762 PolarHBondContact O-OG1 3.46Å; T762-K764 PolarHBondContact O-N 3.33Å
763	G	55.7	Low	55.8	Low	57 Å²	57	112.1 Å²	112.1	59%	0.588	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.7	23.8	164.8	0	0	0	0	0	115.2	M761 R765	M761-G763 PolarHBondContact O-N 3.41Å; G763-R765 PolarHBondContact O-N 2.8Å
764	K	44.4	Very low	53.6	Low	160 Å²	160	118.9 Å²	118.9	70%	0.696	63%	0.628	S	S	*	*			trans	-72.9	68.4	165.6	-79	-172.3	-179.4	174.6	0	109.3	T762 K766	T762-K764 PolarHBondContact O-N 3.33Å; K764-K766 PolarHBondContact O-N 3.4Å
765	R	42.6	Very low	51.5	Low	243 Å²	243	128 Å²	128	92%	0.917	66%	0.658	S	S	*	*			trans	-67.3	67.7	161.3	-164.3	-173.2	-70.8	180	-2	107	G763 D767	G763-R765 PolarHBondContact O-N 2.8Å; R765-D767 PolarHBondContact O-N 2.76Å; R765-D767 VanDerWaalsContact O-N 3.13Å
766	K	38.1	Very low	49.2	Very low	158 Å²	158	133.7 Å²	133.7	69%	0.687	68%	0.677	S	S	*	*			trans	-74	99.8	174	-81.7	-169.4	171.9	-168.2	0	108	K764 L768	K764-K766 PolarHBondContact O-N 3.4Å; K766-L768 PolarHBondContact O-N 2.74Å; K766-L768 VanDerWaalsContact O-N 3.13Å
767	D	36.3	Very low	47.1	Very low	130 Å²	130	139 Å²	139	70%	0.695	70%	0.698	S	S	*	*			trans	36.4	62.2	146.3	-65.6	-41.4	0	0	0	117.9	R765 S769	R765-D767 PolarHBondContact O-N 2.76Å; R765-D767 VanDerWaalsContact O-N 3.13Å; D767-S769 PolarHBondContact O-N 3.1Å
768	L	40.8	Very low	45	Very low	183 Å²	183	144.9 Å²	144.9	96%	0.958	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	64.6	151.4	-92.1	94.6	0	0	0	109.1	K766	K766-L768 PolarHBondContact O-N 2.74Å; K766-L768 VanDerWaalsContact O-N 3.13Å
769	S	37.7	Very low	42.6	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.3	-2.6	167.5	-162.8	0	0	0	0	114.2	D767	D767-S769 PolarHBondContact O-N 3.1Å
770	K	36	Very low	40.4	Very low	183 Å²	183	144.6 Å²	144.6	80%	0.796	74%	0.743	S	S	*	*	S	Bend	trans	-126.9	6.9	179.3	-88.8	-176.5	175.8	179.2	0	117.4
771	N	30.9	Very low	38.4	Very low	151 Å²	151	148 Å²	148	81%	0.807	75%	0.751	S	S	*	*			trans	-127.5	34	171.8	-78.4	-6.9	0	0	0	112.8	L773	N771-L773 PolarHBondContact O-N 3.19Å
772	G	31.1	Very low	36.3	Very low	75 Å²	75	144.9 Å²	144.9	77%	0.773	74%	0.738	S	S	*	*			trans	-75.6	63	177	0	0	0	0	0	112.8
773	L	31.8	Very low	34.4	Very low	168 Å²	168	145 Å²	145	88%	0.88	75%	0.748	S	S	*	*	S	Bend	trans	179.6	52.8	166	-99.8	152.1	0	0	0	109.9	N771	N771-L773 PolarHBondContact O-N 3.19Å
774	N	28	Very low	33.6	Very low	141 Å²	141	147.7 Å²	147.7	75%	0.754	75%	0.753	S	S	*	*			trans	-164.8	52.8	162.8	-111.3	-19.4	0	0	0	110.8	R776	N774-R776 PolarHBondContact O-N 3.28Å
775	Y	27	Very low	33.2	Very low	235 Å²	235	143 Å²	143	92%	0.922	74%	0.743	S	S	*	*			trans	-87.8	78.7	159.7	-121.7	-93.1	0	0	0	106.8	H777	Y775-H777 PolarHBondContact O-N 3.44Å
776	R	26.3	Very low	32.8	Very low	192 Å²	192	138.8 Å²	138.8	73%	0.725	74%	0.739	S	S	*	*			trans	-63.7	117.2	169	-140.7	-178.8	-127.4	-168.1	0.9	105.9	N774 H778	N774-R776 PolarHBondContact O-N 3.28Å; R776-H778 PolarHBondContact O-N 3.25Å; R776-H778 VanDerWaalsContact O-N 3.1Å
777	H	29.8	Very low	32.9	Very low	154 Å²	154	137.2 Å²	137.2	71%	0.713	74%	0.742	S	S	*	*			trans	-40.5	120.2	155.4	-102.8	-131.1	0	0	0	107	Y775 N779	Y775-H777 PolarHBondContact O-N 3.44Å; H777-N779 PolarHBondContact O-N 3.17Å
778	H	29.1	Very low	32.9	Very low	167 Å²	167	135.1 Å²	135.1	77%	0.773	74%	0.743	S	S	*	*			trans	-67.5	83.3	160.6	-95.2	-65.1	0	0	0	106.3	R776 D782	R776-H778 PolarHBondContact O-N 3.25Å; R776-H778 VanDerWaalsContact O-N 3.1Å; H778-D782 IonicContact CE1-OD2 3.85Å; H778-D782 IonicContact ND1-OD2 3.39Å; H778-D782 PolarHBondContact ND1-OD2 3.44Å
779	N	27	Very low	32.7	Very low	92 Å²	92	130.8 Å²	130.8	49%	0.492	73%	0.734	S	S	.	*			trans	-58.9	150.3	158.3	-79.9	-4	0	0	0	107.5	H777 E781	H777-N779 PolarHBondContact O-N 3.17Å; N779-E781 PolarHBondContact O-N 2.95Å
780	C	29.4	Very low	32.4	Very low	141 Å²	141	128.3 Å²	128.3	95%	0.953	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	33.4	-178.2	-134	0	0	0	0	113.5
781	E	34.9	Very low	32.3	Very low	142 Å²	142	127.3 Å²	127.3	66%	0.664	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	-17.6	-173.4	-81.8	170.1	114.1	0	0	113.7	N779 A783	N779-E781 PolarHBondContact O-N 2.95Å; E781-A783 VanDerWaalsContact C-N 3.32Å; E781-A783 PolarHBondContact O-N 3.46Å
782	D	31.8	Very low	32.4	Very low	71 Å²	71	127.3 Å²	127.3	38%	0.38	73%	0.729	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84	-2.4	-176.5	-65.5	-34.8	0	0	0	114.4	H778 V784	H778-D782 IonicContact CE1-OD2 3.85Å; H778-D782 IonicContact ND1-OD2 3.39Å; H778-D782 PolarHBondContact ND1-OD2 3.44Å; D782-V784 PolarHBondContact O-N 2.69Å
783	A	33.6	Very low	32.6	Very low	91 Å²	91	130.5 Å²	130.5	75%	0.752	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-1.2	174.6	0	0	0	0	0	113.6	E781	E781-A783 VanDerWaalsContact C-N 3.32Å; E781-A783 PolarHBondContact O-N 3.46Å
784	V	38.3	Very low	32.9	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.685	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	-13.3	-179.5	-175.7	0	0	0	0	112.2	D782	D782-V784 PolarHBondContact O-N 2.69Å
785	A	36.3	Very low	33	Very low	61 Å²	61	130.5 Å²	130.5	50%	0.504	73%	0.729	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.3	-26.3	-176.7	0	0	0	0	0	114.6	V787 A788	A785-V787 VanDerWaalsContact C-N 3.27Å; A785-V787 PolarHBondContact O-N 3.4Å; A785-A788 PolarHBondContact O-N 2.93Å
786	D	34.6	Very low	33.6	Very low	154 Å²	154	124.6 Å²	124.6	82%	0.824	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-2.2	-179.5	-93.7	-13.5	0	0	0	114.3
787	V	39.4	Very low	34.1	Very low	125 Å²	125	124.2 Å²	124.2	76%	0.758	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.9	-12.4	172.2	-179	0	0	0	0	111.5	A785	A785-V787 VanDerWaalsContact C-N 3.27Å; A785-V787 PolarHBondContact O-N 3.4Å
788	A	36.2	Very low	34.5	Very low	86 Å²	86	122.1 Å²	122.1	71%	0.711	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	2.3	-176.7	0	0	0	0	0	114.4	A785	A785-A788 PolarHBondContact O-N 2.93Å
789	A	36.9	Very low	34.8	Very low	93 Å²	93	119.4 Å²	119.4	77%	0.769	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	13.9	-175.2	0	0	0	0	0	114.8
790	G	32.2	Very low	35.5	Very low	60 Å²	60	123.7 Å²	123.7	62%	0.619	73%	0.734	S	S	*	*	S	Bend	trans	-140	116.4	-178.6	0	0	0	0	0	112.7
791	N	34.1	Very low	35.7	Very low	161 Å²	161	125.1 Å²	125.1	86%	0.861	72%	0.724	S	S	*	*			trans	73.8	86.9	176.7	-90.6	-5.8	0	0	0	117.1	N793	N791-N793 PolarHBondContact O-N 2.95Å
792	N	32.2	Very low	35.7	Very low	151 Å²	151	121.3 Å²	121.3	81%	0.807	72%	0.717	S	S	*	*			trans	-52.7	114	142.9	-64.9	-27.3	0	0	0	108.3
793	N	36.4	Very low	35.9	Very low	142 Å²	142	125.5 Å²	125.5	76%	0.759	74%	0.735	S	S	*	*	S	Bend	trans	162.4	118	147.5	-75.8	-18.8	0	0	0	107.4	N791	N791-N793 PolarHBondContact O-N 2.95Å
794	N	36.3	Very low	35.9	Very low	149 Å²	149	125.2 Å²	125.2	80%	0.797	73%	0.727	S	S	*	*			trans	101.5	38	179.9	-51.4	-17.6	0	0	0	116.8	S796	N794-S796 VanDerWaalsContact C-N 3.32Å; N794-S796 PolarHBondContact O-N 3.37Å; N794-S796 VanDerWaalsContact O-N 3.14Å
795	L	30.2	Very low	35.5	Very low	161 Å²	161	127.3 Å²	127.3	84%	0.843	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	73.5	165	-167.8	73.4	0	0	0	110.4
796	S	39.8	Very low	35.4	Very low	110 Å²	110	131.8 Å²	131.8	77%	0.769	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.6	3.1	165.3	61.5	0	0	0	0	115.6	N794	N794-S796 VanDerWaalsContact C-N 3.32Å; N794-S796 PolarHBondContact O-N 3.37Å; N794-S796 VanDerWaalsContact O-N 3.14Å
797	Q	38.1	Very low	35.3	Very low	184 Å²	184	129.4 Å²	129.4	86%	0.86	74%	0.743	S	S	*	*	S	Bend	trans	-132.5	6	-175.2	-124.2	179.1	3.3	0	0	115.9
798	V	36.8	Very low	35.1	Very low	110 Å²	110	131.9 Å²	131.9	67%	0.667	75%	0.748	S	S	*	*	S	Bend	trans	-112	-12.1	-176.2	-174.6	0	0	0	0	113.2	Q800 K801	V798-Q800 VanDerWaalsContact C-N 3.32Å; V798-Q800 PolarHBondContact O-N 2.61Å; V798-K801 PolarHBondContact O-N 2.86Å
799	D	36.9	Very low	34.8	Very low	110 Å²	110	134 Å²	134	59%	0.588	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-8.5	-176.6	-81.8	-37.9	0	0	0	115.8
800	Q	40.1	Very low	34.4	Very low	183 Å²	183	135.6 Å²	135.6	86%	0.855	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-9.9	175.4	-84.4	-178.6	-19.2	0	0	114.6	V798	V798-Q800 VanDerWaalsContact C-N 3.32Å; V798-Q800 PolarHBondContact O-N 2.61Å
801	K	33.8	Very low	34.3	Very low	170 Å²	170	140.5 Å²	140.5	74%	0.739	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-16.2	-179	-143	169	-174.1	175.1	0	113.8	V798	V798-K801 PolarHBondContact O-N 2.86Å
802	A	35.7	Very low	34.4	Very low	63 Å²	63	138.5 Å²	138.5	52%	0.521	77%	0.771	S	S	.	*	G	3₁₀ helix	trans	-81.1	-16.3	175.5	0	0	0	0	0	113.8
803	Q	35.1	Very low	34.4	Very low	158 Å²	158	140.5 Å²	140.5	74%	0.738	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-84.2	-6.5	179	-74.7	178.5	-10.2	0	0	114.6
804	S	33.5	Very low	34.2	Very low	86 Å²	86	138 Å²	138	60%	0.601	77%	0.774	S	S	*	*	G	3₁₀ helix	trans	-95.6	-1.5	-180	81.1	0	0	0	0	115.6
805	M	31.6	Very low	33.9	Very low	156 Å²	156	134.7 Å²	134.7	77%	0.768	78%	0.776	S	S	*	*	S	Bend	trans	-110.1	-1.4	178.9	-90.8	172.7	52.3	0	0	114.5
806	N	33.6	Very low	33.8	Very low	155 Å²	155	133.4 Å²	133.4	83%	0.829	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	14.5	180	-85.2	-8	0	0	0	114.5
807	S	32.9	Very low	33.4	Very low	105 Å²	105	133 Å²	133	73%	0.734	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.4	6.3	-177.1	63	0	0	0	0	115.5
808	M	34.1	Very low	33.1	Very low	177 Å²	177	129.5 Å²	129.5	87%	0.872	77%	0.773	S	S	*	*	S	Bend	trans	-117.2	4.7	-168.8	-133.1	173.8	-163.9	0	0	117.5
809	C	30.5	Very low	32.9	Very low	131 Å²	131	132.1 Å²	132.1	89%	0.885	78%	0.783	S	S	*	*	S	Bend	trans	-136.7	49.3	178.5	-89.8	0	0	0	0	113.4
810	C	29.6	Very low	32.6	Very low	125 Å²	125	131.5 Å²	131.5	85%	0.845	79%	0.788	S	S	*	*			trans	-155.5	73.3	164.8	-105.9	0	0	0	0	110.1
811	N	28.9	Very low	32.3	Very low	164 Å²	164	131.7 Å²	131.7	88%	0.877	79%	0.789	S	S	*	*			trans	-160.6	94	161.9	-121.2	-15	0	0	0	112.2
812	S	35.6	Very low	32.2	Very low	119 Å²	119	132.3 Å²	132.3	83%	0.832	79%	0.794	S	S	*	*			trans	-168.5	110.7	148.8	-88.5	0	0	0	0	111.8
813	R	32.4	Very low	32	Very low	193 Å²	193	135.2 Å²	135.2	73%	0.728	81%	0.807	S	S	*	*			trans	90.8	93	156.2	-67	178.1	160.6	-163.6	-10.5	119.2	H5	H5-R813 PolarHBondContact CD2-NH2 3.45Å; H5-R813 VanDerWaalsContact CE1-CZ 3.5Å; H5-R813 PolarHBondContact CE1-NH1 3.46Å; H5-R813 PolarHBondContact CE1-NH2 3.39Å; H5-R813 VanDerWaalsContact CE1-NH2 3.35Å; H5-R813 PolarHBondContact NE2-NH1 3.2Å; H5-R813 VanDerWaalsContact NE2-NH1 3.15Å; H5-R813 PolarHBondContact NE2-NH2 2.82Å
814	G	32.2	Very low	31.8	Very low	88 Å²	88	131.3 Å²	131.3	91%	0.907	81%	0.81	S	S	*	*				122	103.9	107.3	0	0	0	0	0	116.7
815	G	31.4	Very low	31.6	Very low	81 Å²	81	135 Å²	135	84%	0.835	82%	0.823	S	S	*	*			trans	121.4	78	154	0	0	0	0	0	115.9
816	C	26.3	Very low	31.5	Very low	133 Å²	133	132.2 Å²	132.2	90%	0.899	82%	0.818	S	S	*	*			trans	-72.2	123.1	159	-68.9	0	0	0	0	109.4
817	A	33.1	Very low	31.5	Very low	102 Å²	102	132.2 Å²	132.2	84%	0.843	82%	0.817	S	S	*	*			trans	-115.1	113.8	152.1	0	0	0	0	0	107.3
818	V	31.6	Very low	31.1	Very low	110 Å²	110	134.2 Å²	134.2	67%	0.667	82%	0.819	S	S	*	*			trans	-66.7	136.6	176.1	172	0	0	0	0	109.2
819	N	32.7	Very low	30.9	Very low	165 Å²	165	135.7 Å²	135.7	88%	0.882	82%	0.821	S	S	*	*				-157.7	108.3	130	-100.6	-8.1	0	0	0	110.9
820	S	29.8	Very low	30.8	Very low	98 Å²	98	136 Å²	136	69%	0.685	81%	0.814	S	S	*	*			trans	-64.9	138.5	168.5	-42.4	0	0	0	0	110.7
821	Q	33.2	Very low	30.8	Very low	187 Å²	187	137.3 Å²	137.3	87%	0.874	81%	0.812	S	S	*	*			trans	-173.4	109.6	133.4	-103.6	160.6	2	0	0	112.1
822	H	32.8	Very low	30.8	Very low	182 Å²	182	134.4 Å²	134.4	84%	0.843	81%	0.805	S	S	*	*			trans	51.4	135.8	144.7	-81.8	-78.6	0	0	0	123.6
823	P	31.7	Very low	30.4	Very low	125 Å²	125	136.4 Å²	136.4	81%	0.812	80%	0.803	S	S	*	*			trans	-91.1	147.1	174	37.5	-30.6	0	0	0	111.5
824	G	31.1	Very low	30.3	Very low	76 Å²	76	133.1 Å²	133.1	78%	0.784	80%	0.8	S	S	*	*			trans	-166.4	110.7	174.3	0	0	0	0	0	111.3
825	N	29.1	Very low	30.1	Very low	164 Å²	164	135.4 Å²	135.4	88%	0.877	79%	0.792	S	S	*	*			trans	-34.6	141.9	168.8	-65.6	-30.3	0	0	0	113.9
826	S	29.8	Very low	30.1	Very low	97 Å²	97	137.1 Å²	137.1	68%	0.678	79%	0.786	S	S	*	*				161.3	124.5	106.8	63.7	0	0	0	0	113
827	I	31.7	Very low	30.4	Very low	155 Å²	155	135 Å²	135	80%	0.795	77%	0.772	S	S	*	*			trans	78.1	119.6	134.7	-55.9	161.9	0	0	0	118.5
828	N	26.3	Very low	30.4	Very low	146 Å²	146	137.8 Å²	137.8	78%	0.781	77%	0.768	S	S	*	*			trans	-47.5	143.7	166.7	-70.4	-27.8	0	0	0	114.1
829	F	29.8	Very low	30.5	Very low	209 Å²	209	139.3 Å²	139.3	92%	0.917	77%	0.772	S	S	*	*			trans	-142.8	123.4	141.6	-105.9	-82.6	0	0	0	110.1
830	D	28.7	Very low	30.5	Very low	137 Å²	137	137.2 Å²	137.2	73%	0.733	77%	0.765	S	S	*	*			trans	-68.6	152.4	172.9	-87.8	-48.5	0	0	0	112.8
831	N	27.8	Very low	30.8	Very low	152 Å²	152	139.6 Å²	139.6	81%	0.813	77%	0.774	S	S	*	*			trans	59.8	132.1	143.1	-70	-30.5	0	0	0	121.9
832	S	29.3	Very low	30.7	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	77%	0.768	S	S	*	*				118.6	109.9	128.7	-157.6	0	0	0	0	116.6
833	M	28.3	Very low	30.8	Very low	160 Å²	160	133.6 Å²	133.6	79%	0.788	76%	0.763	S	S	*	*			trans	55.4	132.3	132.7	-77.1	178.2	159.3	0	0	122.4
834	N	28.8	Very low	30.9	Very low	125 Å²	125	132.3 Å²	132.3	67%	0.668	76%	0.757	S	S	*	*			trans	95.6	121.3	136.7	-70.1	-12.3	0	0	0	120.2
835	N	28.7	Very low	31	Very low	135 Å²	135	136.3 Å²	136.3	72%	0.722	76%	0.755	S	S	*	*			trans	66	141.5	133.5	-67.7	-10.3	0	0	0	116.4
836	T	31.6	Very low	31	Very low	118 Å²	118	138.6 Å²	138.6	72%	0.724	75%	0.753	S	S	*	*			cis	176.7	130.7	25.5	1	0	0	0	0	102.8
837	S	32.1	Very low	31.1	Very low	87 Å²	87	142 Å²	142	61%	0.608	76%	0.758	S	S	*	*				118.5	156.6	73.9	53.6	0	0	0	0	112.6
838	H	34.4	Very low	31.1	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.745	75%	0.752	S	S	*	*			trans	87.3	132.1	162.9	-67	-70.2	0	0	0	118.8
839	L	33	Very low	31.3	Very low	143 Å²	143	143 Å²	143	75%	0.749	75%	0.754	S	S	*	*			cis	-159.9	130.6	14.1	-91.4	137.7	0	0	0	109.9
840	V	33.5	Very low	31.2	Very low	121 Å²	121	136 Å²	136	73%	0.733	74%	0.741	S	S	*	*				70.9	124.6	97.2	-177.1	0	0	0	0	115.5
841	V	35.2	Very low	31.2	Very low	147 Å²	147	138 Å²	138	89%	0.891	75%	0.75	S	S	*	*				-154.5	152.7	85.8	170.3	0	0	0	0	113.2
842	D	31.4	Very low	31.3	Very low	137 Å²	137	134.7 Å²	134.7	73%	0.733	74%	0.744	S	S	*	*			trans	-116.9	167.7	-153.1	-174.7	21.4	0	0	0	115.3
843	S	34	Very low	31.4	Very low	107 Å²	107	141.8 Å²	141.8	75%	0.748	76%	0.755	S	S	*	*			trans	150.3	132.1	140.5	-67.7	0	0	0	0	111.2
844	S	34.5	Very low	31.5	Very low	97 Å²	97	141 Å²	141	68%	0.678	75%	0.754	S	S	*	*			cis	-174.5	134.2	-3	48.6	0	0	0	0	110.3
845	Q	32.6	Very low	31.6	Very low	160 Å²	160	142 Å²	142	75%	0.748	76%	0.759	S	S	*	*			trans	31.1	142.6	142.2	-65.8	173.8	-26.4	0	0	121.9
846	Y	30.2	Very low	31.7	Very low	212 Å²	212	141.2 Å²	141.2	83%	0.831	76%	0.759	S	S	*	*				-159.6	149.2	58.7	-113.2	-90.2	0	0	0	114.9
847	H	31.1	Very low	31.5	Very low	168 Å²	168	145.5 Å²	145.5	78%	0.778	76%	0.762	S	S	*	*			trans	-66.5	172.1	174.9	-102.9	-50.3	0	0	0	114.5
848	Q	32.5	Very low	31.3	Very low	147 Å²	147	147.5 Å²	147.5	69%	0.687	77%	0.765	S	S	*	*			cis	-176	156.9	30.2	-129.5	175.7	-7.4	0	0	113
849	H	30.6	Very low	31	Very low	176 Å²	176	147.7 Å²	147.7	82%	0.815	77%	0.771	S	S	*	*			trans	45.1	127.7	146	-82.3	-66.6	0	0	0	125
850	G	27	Very low	30.9	Very low	62 Å²	62	149.4 Å²	149.4	64%	0.639	78%	0.777	S	S	*	*				128.6	111.5	113	0	0	0	0	0	120.9
851	I	28.5	Very low	31	Very low	179 Å²	179	148.9 Å²	148.9	92%	0.918	78%	0.777	S	S	*	*			trans	82.3	130.3	136.2	-52.3	172.2	0	0	0	120
852	A	29.3	Very low	30.8	Very low	83 Å²	83	147.9 Å²	147.9	69%	0.686	78%	0.776	S	S	*	*			trans	-66.3	153.9	179	0	0	0	0	0	115.8
853	R	32.2	Very low	30.9	Very low	253 Å²	253	145.1 Å²	145.1	96%	0.955	78%	0.78	S	S	*	*				-174.5	147.7	129.6	-105.5	168.5	-173.8	171.2	2.6	114.2
854	N	30.1	Very low	30.7	Very low	144 Å²	144	145.5 Å²	145.5	77%	0.77	78%	0.783	S	S	*	*			trans	-70.2	157.2	175.9	-77.9	-34.2	0	0	0	114
855	N	30.3	Very low	30.7	Very low	146 Å²	146	149.4 Å²	149.4	78%	0.781	80%	0.795	S	S	*	*			trans	77.4	143.1	144.5	-70.5	-21.9	0	0	0	120.9
856	V	30.6	Very low	30.5	Very low	118 Å²	118	148.9 Å²	148.9	72%	0.715	80%	0.797	S	S	*	*			trans	103.8	99.2	149.2	-167.8	0	0	0	0	116.5
857	R	27.9	Very low	30.6	Very low	208 Å²	208	146.1 Å²	146.1	79%	0.785	80%	0.796	S	S	*	*				49	135	128.9	-87.8	178.8	-98.5	-175.7	-6.1	120.5
858	N	28	Very low	30.5	Very low	128 Å²	128	143 Å²	143	68%	0.684	79%	0.793	S	S	*	*			trans	96.6	124.9	132.1	-74.7	-3.2	0	0	0	119.4
859	L	28	Very low	30.5	Very low	165 Å²	165	141.7 Å²	141.7	86%	0.864	80%	0.8	S	S	*	*			trans	87.1	116.7	142	-62.9	156.4	0	0	0	118.8
860	M	32.3	Very low	30.7	Very low	179 Å²	179	137.4 Å²	137.4	88%	0.882	80%	0.803	S	S	*	*			trans	-47.6	170.3	153.3	-78.4	-160.5	177.5	0	0	112.2
861	P	35.2	Very low	30.8	Very low	111 Å²	111	139.4 Å²	139.4	72%	0.721	81%	0.814	S	S	*	*			cis	-150.4	178.1	31.8	35.7	-10.3	0	0	0	118.7
862	S	31.2	Very low	31.1	Very low	125 Å²	125	135.9 Å²	135.9	87%	0.874	81%	0.812	S	S	*	*			trans	27.8	136.7	146.2	-49.9	0	0	0	0	123.2
863	G	32	Very low	31	Very low	80 Å²	80	137.6 Å²	137.6	83%	0.825	82%	0.818	S	S	*	*			trans	168.9	100.2	158.4	0	0	0	0	0	114.7
864	S	31.1	Very low	30.8	Very low	114 Å²	114	131.2 Å²	131.2	80%	0.797	81%	0.811	S	S	*	*			trans	-67	157	171	48.9	0	0	0	0	114.1
865	L	34.3	Very low	30.7	Very low	179 Å²	179	130.3 Å²	130.3	94%	0.937	81%	0.811	S	S	*	*			trans	-162.1	135.2	145.4	-102.4	161.5	0	0	0	112.4
866	N	27.6	Very low	30.6	Very low	150 Å²	150	129 Å²	129	80%	0.802	81%	0.814	S	S	*	*			trans	-88.8	160.6	179.5	-75.6	-35.9	0	0	0	112.9
867	L	32.5	Very low	30.4	Very low	154 Å²	154	128.2 Å²	128.2	81%	0.806	82%	0.819	S	S	*	*				176.5	119.5	126.8	-120	65.9	0	0	0	109.1
868	S	29.6	Very low	30.5	Very low	101 Å²	101	124.8 Å²	124.8	71%	0.706	82%	0.821	S	S	*	*				64.1	140.9	100.1	88.1	0	0	0	0	113.7
869	S	32.3	Very low	31	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	82%	0.82	S	S	*	*			cis	-172.9	161.9	15	45.6	0	0	0	0	107.7
870	G	35	Very low	31.2	Very low	85 Å²	85	123.8 Å²	123.8	88%	0.876	82%	0.822	S	S	*	*			trans	153.8	92.7	166.4	0	0	0	0	0	114.7
871	A	29.5	Very low	31.1	Very low	105 Å²	105	119 Å²	119	87%	0.868	81%	0.805	S	S	*	*			trans	-92.7	149.1	-179.1	0	0	0	0	0	113
872	A	34.8	Very low	31.1	Very low	105 Å²	105	124.5 Å²	124.5	87%	0.868	81%	0.813	S	S	*	*			trans	-163.7	120.6	144.2	0	0	0	0	0	110.7
873	S	26.8	Very low	30.9	Very low	118 Å²	118	122.1 Å²	122.1	83%	0.825	81%	0.809	S	S	*	*			trans	-76.1	153.2	175.7	-85	0	0	0	0	113.4
874	C	27.1	Very low	30.8	Very low	119 Å²	119	124.9 Å²	124.9	80%	0.804	80%	0.804	S	S	*	*				-171.6	100.7	124	-98.1	0	0	0	0	111.6
875	T	27.7	Very low	30.7	Very low	125 Å²	125	123 Å²	123	77%	0.767	80%	0.803	S	S	*	*			trans	35	109.3	137.3	56.5	0	0	0	0	120.5
876	S	28.5	Very low	30.4	Very low	119 Å²	119	121 Å²	121	83%	0.832	80%	0.799	S	S	*	*				166.1	136.5	100.1	52	0	0	0	0	112.9
877	A	27.2	Very low	30.6	Very low	101 Å²	101	121.7 Å²	121.7	84%	0.835	80%	0.799	S	S	*	*			trans	72.1	92.3	163	0	0	0	0	0	120.4
878	V	30.7	Very low	30.5	Very low	137 Å²	137	119.8 Å²	119.8	83%	0.83	79%	0.79	S	S	*	*			trans	-149.9	159.9	162.9	-173.7	0	0	0	0	104.8
879	P	37.5	Very low	30.9	Very low	101 Å²	101	120.4 Å²	120.4	66%	0.656	78%	0.782	S	S	*	*			cis	-137.4	-179.9	-43.1	40.6	-26.2	0	0	0	112.4
880	L	32.1	Very low	31	Very low	171 Å²	171	117.1 Å²	117.1	90%	0.895	76%	0.76	S	S	*	*			trans	-135.1	115.1	141.1	-100.2	166.8	0	0	0	110.2
881	S	30.3	Very low	30.8	Very low	77 Å²	77	119.7 Å²	119.7	54%	0.538	75%	0.753	S	S	.	*			trans	-71.9	151.6	178.6	43.3	0	0	0	0	114
882	Y	34.5	Very low	31.2	Very low	227 Å²	227	118.8 Å²	118.8	89%	0.89	73%	0.729	S	S	*	*			trans	162.5	109.4	135	-73	-60.6	0	0	0	105.4
883	G	27	Very low	31.1	Very low	76 Å²	76	120.4 Å²	120.4	78%	0.784	72%	0.723	S	S	*	*			cis	109.7	57.8	29	0	0	0	0	0	110.7
884	L	31	Very low	31.2	Very low	137 Å²	137	117.8 Å²	117.8	72%	0.717	71%	0.705	S	S	*	*			trans	-145.6	115.4	163.6	-106.8	145.3	0	0	0	109.6	I479 T886	I479-L884 HydrophobicContact CD1-CD1 3.72Å; I479-L884 HydrophobicContact CG1-CD1 3.82Å; L884-T886 PolarHBondContact O-N 3.04Å
885	G	28.5	Very low	31.3	Very low	76 Å²	76	119.9 Å²	119.9	78%	0.784	71%	0.708	S	S	*	*			trans	-64.4	121.7	-161.9	0	0	0	0	0	114.4	M887	G885-M887 PolarHBondContact O-N 2.77Å; G885-M887 VanDerWaalsContact O-N 3.1Å
886	T	28.6	Very low	31.4	Very low	137 Å²	137	123.1 Å²	123.1	84%	0.84	72%	0.715	S	S	*	*			trans	-59.4	103.8	146.9	50.6	0	0	0	0	107.4	L884 D888	L884-T886 PolarHBondContact O-N 3.04Å; T886-D888 VanDerWaalsContact C-N 3.34Å; T886-D888 PolarHBondContact O-N 3.13Å
887	M	32.1	Very low	31.4	Very low	164 Å²	164	122.5 Å²	122.5	81%	0.808	71%	0.71	S	S	*	*			trans	-62.7	106.6	158.8	-87.3	-170.9	169	0	0	106.5	G885 M889	G885-M887 PolarHBondContact O-N 2.77Å; G885-M887 VanDerWaalsContact O-N 3.1Å; M887-M889 PolarHBondContact O-N 3.13Å
888	D	29	Very low	31.5	Very low	114 Å²	114	124.9 Å²	124.9	61%	0.61	71%	0.709	S	S	*	*			trans	-60.4	103.2	173.9	-165.2	1.6	0	0	0	108.6	T886 S890	T886-D888 VanDerWaalsContact C-N 3.34Å; T886-D888 PolarHBondContact O-N 3.13Å; D888-S890 PolarHBondContact O-N 3.22Å; D888-S890 VanDerWaalsContact O-N 3.13Å; D888-S890 WeakPolarHBondContact OD1-CB 3.24Å; D888-S890 PolarHBondContact OD1-N 3.46Å; D888-S890 PolarHBondContact OD1-OG 3.1Å; D888-S890 PolarHBondContact OD2-OG 3.43Å
889	M	38.4	Very low	31.3	Very low	113 Å²	113	129.2 Å²	129.2	56%	0.557	71%	0.712	S	S	*	*	G	3₁₀ helix	trans	-71	5.9	174	-100.3	-135.4	-178	0	0	112.2	V407 M887 L891 F892	V407-M889 HydrophobicContact CG1-CE 4.37Å; M887-M889 PolarHBondContact O-N 3.13Å; M889-L891 PolarHBondContact O-N 2.89Å; M889-F892 PolarHBondContact O-N 3.28Å; M889-F892 VanDerWaalsContact O-N 3.09Å; M889-F892 HydrophobicContact SD-CD2 4.45Å
890	S	34.4	Very low	30.7	Very low	53 Å²	53	130.1 Å²	130.1	37%	0.371	72%	0.72	S	S	.	*	G	3₁₀ helix	trans	-55.6	-27.9	168.1	67.4	0	0	0	0	112.7	D888 F892 N893 S894	D888-S890 PolarHBondContact O-N 3.22Å; D888-S890 VanDerWaalsContact O-N 3.13Å; D888-S890 WeakPolarHBondContact OD1-CB 3.24Å; D888-S890 PolarHBondContact OD1-N 3.46Å; D888-S890 PolarHBondContact OD1-OG 3.1Å; D888-S890 PolarHBondContact OD2-OG 3.43Å; S890-F892 VanDerWaalsContact C-N 3.28Å; S890-F892 PolarHBondContact O-N 3.44Å; S890-N893 CarbonylContact O-C 3.41Å; S890-N893 PolarHBondContact O-N 3.33Å; S890-S894 WeakPolarHBondContact O-CB 3.26Å; S890-S894 PolarHBondContact O-N 2.96Å; S890-S894 VanDerWaalsContact O-N 3.12Å; S890-S894 PolarHBondContact O-OG 3.39Å
891	L	31.7	Very low	30.6	Very low	139 Å²	139	129.7 Å²	129.7	73%	0.728	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-70.4	-13.6	175.8	-98	148.2	0	0	0	115.2	M889	M889-L891 PolarHBondContact O-N 2.89Å
892	F	37.8	Very low	30.5	Very low	85 Å²	85	138 Å²	138	37%	0.373	74%	0.736	S	S	.	*	G	3₁₀ helix	trans	-92.4	-3.4	169.9	-83.1	-67.3	0	0	0	113.5	I389 R392 M889 S890	I389-F892 HydrophobicContact CD1-CE1 3.5Å; I389-F892 HydrophobicContact CD1-CZ 3.67Å; I389-F892 HydrophobicContact CG1-CE1 3.6Å; I389-F892 HydrophobicContact CG1-CZ 4.26Å; R392-F892 VanDerWaalsContact CZ-O 3.3Å; R392-F892 PolarHBondContact NH1-O 3.47Å; R392-F892 PolarHBondContact NH2-O 3.35Å; M889-F892 PolarHBondContact O-N 3.28Å; M889-F892 VanDerWaalsContact O-N 3.09Å; M889-F892 HydrophobicContact SD-CD2 4.45Å; S890-F892 VanDerWaalsContact C-N 3.28Å; S890-F892 PolarHBondContact O-N 3.44Å
893	N	33.1	Very low	30.3	Very low	140 Å²	140	132 Å²	132	75%	0.749	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.5	5	179.8	-123.3	14.6	0	0	0	113.9	S890	S890-N893 CarbonylContact O-C 3.41Å; S890-N893 PolarHBondContact O-N 3.33Å
894	S	27.6	Very low	30.5	Very low	62 Å²	62	133.1 Å²	133.1	43%	0.434	72%	0.723	S	S	.	*			trans	-107.8	78.7	-177.7	63.1	0	0	0	0	112.4	S890	S890-S894 WeakPolarHBondContact O-CB 3.26Å; S890-S894 PolarHBondContact O-N 2.96Å; S890-S894 VanDerWaalsContact O-N 3.12Å; S890-S894 PolarHBondContact O-OG 3.39Å
895	N	30.1	Very low	30.6	Very low	163 Å²	163	136.3 Å²	136.3	87%	0.872	73%	0.734	S	S	*	*	S	Bend	trans	178.2	62	147.2	-98	-6.3	0	0	0	110
896	E	30.4	Very low	30.7	Very low	194 Å²	194	143.1 Å²	143.1	91%	0.907	74%	0.736	S	S	*	*			trans	-169.6	62.1	148	-111.7	-174.5	173	0	0	108.5
897	S	28.2	Very low	30.8	Very low	106 Å²	106	145.9 Å²	145.9	74%	0.741	74%	0.74	S	S	*	*			trans	-102.5	67.5	160.8	50.7	0	0	0	0	107.9
898	N	28.1	Very low	30.9	Very low	150 Å²	150	144 Å²	144	80%	0.802	74%	0.738	S	S	*	*			trans	-134.2	60.9	163.5	-89	-24.9	0	0	0	108.1
899	Y	27.2	Very low	30.9	Very low	228 Å²	228	145.1 Å²	145.1	89%	0.894	75%	0.748	S	S	*	*	S	Bend	trans	-169.3	130.3	145.1	-99.5	-73.9	0	0	0	107.4
900	C	24.9	Very low	30.8	Very low	121 Å²	121	149.4 Å²	149.4	82%	0.818	76%	0.764	S	S	*	*			trans	80.6	80.7	-178.9	-63.1	0	0	0	0	117.9
901	I	29.4	Very low	30.8	Very low	161 Å²	161	154.3 Å²	154.3	83%	0.826	78%	0.784	S	S	*	*				-149.1	111.8	126.8	-58.8	-167.8	0	0	0	109
902	R	29.2	Very low	30.6	Very low	253 Å²	253	157.9 Å²	157.9	96%	0.955	79%	0.788	S	S	*	*			trans	-131.6	95.3	134.6	-155.5	174	-170.5	-179.4	3.2	108.6
903	S	29.8	Very low	30.5	Very low	101 Å²	101	159.7 Å²	159.7	71%	0.706	81%	0.808	S	S	*	*			trans	-62.1	131.7	163.2	113.4	0	0	0	0	109
904	S	31.1	Very low	30.6	Very low	99 Å²	99	157.7 Å²	157.7	69%	0.692	80%	0.801	S	S	*	*			trans	-165.7	87.3	138.9	-175.5	0	0	0	0	108.5
905	Q	33.8	Very low	31.1	Very low	204 Å²	204	161 Å²	161	95%	0.953	81%	0.814	S	S	*	*			trans	-102.1	90.5	151.8	-84.9	-163.1	-13.4	0	0	107.2
906	R	30.9	Very low	31.5	Very low	218 Å²	218	160.6 Å²	160.6	82%	0.823	81%	0.81	S	S	*	*			trans	-79.7	116.9	156.6	-97.7	-174.5	-174.9	-161.5	1.2	107.7	T908	R906-T908 PolarHBondContact O-N 3.14Å; R906-T908 VanDerWaalsContact O-N 3.15Å
907	Q	30.1	Very low	31.9	Very low	196 Å²	196	154.6 Å²	154.6	92%	0.916	80%	0.8	S	S	*	*			trans	-50.9	115.9	157.6	-76.4	170.6	-29.8	0	0	108.5
908	T	34.5	Very low	32.1	Very low	125 Å²	125	161.3 Å²	161.3	77%	0.767	81%	0.809	S	S	*	*			trans	-133.4	112.5	161.8	37.8	0	0	0	0	108.2	R906 K910	R906-T908 PolarHBondContact O-N 3.14Å; R906-T908 VanDerWaalsContact O-N 3.15Å; T908-K910 PolarHBondContact O-N 3.22Å
909	V	29.2	Very low	32.6	Very low	136 Å²	136	158.6 Å²	158.6	82%	0.824	80%	0.8	S	S	*	*			trans	-54.4	123.1	168.7	174.6	0	0	0	0	108.3
910	K	34.6	Very low	33.2	Very low	204 Å²	204	154.4 Å²	154.4	89%	0.887	79%	0.793	S	S	*	*			trans	-144.3	129.7	161.1	-123.3	176.3	-175.2	-179.9	0	111.4	T908	T908-K910 PolarHBondContact O-N 3.22Å
911	I	34.7	Very low	33.9	Very low	155 Å²	155	162.2 Å²	162.2	80%	0.795	81%	0.814	S	S	*	*			trans	-73.7	142.9	-164.7	-65.6	164.8	0	0	0	110.7
912	R	27.6	Very low	34.1	Very low	214 Å²	214	162.3 Å²	162.3	81%	0.808	81%	0.813	S	S	*	*			trans	-68.4	147.9	176.1	-161.1	-173.7	-82.5	-158	-3.4	110.5
913	P	36.8	Very low	34.4	Very low	124 Å²	124	157.5 Å²	157.5	81%	0.805	81%	0.806	S	S	*	*				-125.3	135.4	129.7	24	-8.9	0	0	0	111.9
914	T	35.1	Very low	34.6	Very low	97 Å²	97	160.7 Å²	160.7	60%	0.595	81%	0.811	S	S	*	*			trans	-63.4	141.6	172.2	41.8	0	0	0	0	112.2
915	N	36.9	Very low	34.8	Very low	131 Å²	131	164.3 Å²	164.3	70%	0.701	82%	0.818	S	S	*	*				179.7	131.1	110.5	-97.2	-20.5	0	0	0	113.3
916	I	39.7	Very low	34.9	Very low	155 Å²	155	161.8 Å²	161.8	80%	0.795	81%	0.81	S	S	*	*				55.2	121.8	127.9	-50.3	163.4	0	0	0	116.5
917	G	37.8	Very low	35.1	Very low	68 Å²	68	158.1 Å²	158.1	70%	0.701	81%	0.809	S	S	*	*			cis	180	157.8	10.9	0	0	0	0	0	112.5
918	R	33.5	Very low	35.5	Very low	247 Å²	247	155.4 Å²	155.4	93%	0.932	80%	0.801	S	S	*	*			trans	45.7	153	145.9	-90	-139.5	167.5	137.4	-3.1	124
919	P	38	Very low	35.6	Very low	93 Å²	93	157.7 Å²	157.7	60%	0.604	80%	0.804	S	S	*	*			trans	-125	-163.5	-151.5	32.1	-6.5	0	0	0	112.6
920	D	40.5	Very low	36.1	Very low	141 Å²	141	159.5 Å²	159.5	75%	0.754	80%	0.802	S	S	*	*			trans	110.1	99.2	152.9	-56.3	-28.2	0	0	0	116.9
921	F	38.4	Very low	36.3	Very low	285 Å²	285	155.5 Å²	155.5	100%	1.25	79%	0.794	S	S	*	*				-147.8	0	125.8	-110.3	-77.6	0	0	0	109.9

Retrieved 921 of 921 residues in 1256.5 ms (Link to these results)

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