X2JJV1_DROME Loading...

Serine/threonine-protein

AlphaFold DB , UniProt , Accession X2JJV1, Species DROME (Drosophila melanogaster, Fruit fly), Gene hep, Length 1,153 aa.

						>X2JJV1_DROME|X2JJV1|hep
MSTIEFETIGSRLQSLEAKLQAQNESHDQIVLSGARGPVVSGSVPSARVPPLATSASAATSATHAPSLGAGSVSGSGISIAQRPAPPVPHATPFGSASASSSSSSASAFASAAPATGTFGGTYTPPTTRVSRATPTLPMLSSGPGGGLNRTRPVILPLPTPPHPPVSETDMKLKIIMEQTGKLNINGRQYPTDINDLKHLGDLGNGTSGNVVKMMHLSSNTIIAVKQMRRTGNAEENKRILMDLDVVLKSHDCKYIVKCLGCFVRDPDVWICMELMSMCFDKLLKLSKKPVPEQILGKVTVATVNALSYLKDKHGVIHRDVKPSNILIDERGNIKLCDFGISGRLVDSKANTRSAGCAAYMAPERIDPKKPKYDIRADVWSLGITLVELATARSPYEGCNTDFEVLTKVLDSEPPCLPYGEGYNFSQQFRDFVIKCLTKNHQDRPKYPELLAQPFIRIYESAKVDVPNWFQSIKDNRLRANGDPTLQRATATGSAIGSGAGSLAGSGSGSAGGAVKYGRATTYAGQSPTNPQKTIKPTQIPSYQQQQSQFFMQSATQLPQTTTTTPTATTNCFGGSGNGNGRGNGSGGSGNGSGSSSSASPLSPPSAGIGDLNRLYRKSPFMQRKLSNGSHHPHYKYNDESPKKESMFSSIGQSILRNLTTSPFSQKKHNSTATTIPLPHNNQTLITDAATAAAAAATATTPPNIAATVLTTTPTTTPTWRLPTENSQAYDSCDSSSNATTTTLNLGLSSPSPSLPRKQFPTESPTLQLTSQQQQQPQRLQPGNQSPIVLQRFYHQQNQLREKEAAERYQQQRQQPPVGVTSTNPFHSNYVPPPPSTHSTSSQSSTQSTCSQIAINPASISPSSGSGTGNMAGLGIGSAPASGLGAAGHFGAGGTGEQLQYQPLPIAAEATGTSPTLQSRSPEQQSDYGGNGNMVASKLSKLYARRQLLGQSSSSGASNSSLDGCSREQHDAATSPVASSMDRDQEPVHPQPPAYRSVVNNGSGGKSYYYRTLSAASSSSNTSQSTSPTTEPLPGGGTSSFLRRYASSGPGGSISTPPSPHILAGLDRRHRSPDPPPRYNRGQSPLLLRKNLLELSGQPPGSPLLHRRYVSASPPLPPPRRGSESVPGSPQHFRTRIHYTPEPQRRIYRTIDQ
					

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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	39.1	Very low	44.1	Very low	200 Å²	200	108.6 Å²	108.6	99%	0.985	59%	0.592	S	S	*	*				0	170.6	0	-72.9	95.5	144.8	0	0	110.6	E5	M1-E5 HydrophobicContact CB-CG 4.37Å; M1-E5 WeakPolarHBondContact CB-OE2 3.44Å; M1-E5 VanDerWaalsContact CG-OE1 3.32Å; M1-E5 WeakPolarHBondContact CG-OE1 3.37Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å
2	S	34.9	Very low	44.7	Very low	75 Å²	75	114.9 Å²	114.9	52%	0.524	60%	0.6	S	S	.	*			trans	-97.2	167.7	-174.2	53	0	0	0	0	113.1	I4 E5	S2-I4 PolarHBondContact O-N 3.09Å; S2-E5 PolarHBondContact O-N 3.03Å
3	T	38.9	Very low	45.5	Very low	119 Å²	119	113.5 Å²	113.5	73%	0.73	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.3	-21.5	-177.8	35.4	0	0	0	0	115.3	E5 F6	T3-E5 PolarHBondContact O-N 2.77Å; T3-F6 PolarHBondContact O-N 3.44Å
4	I	42.2	Very low	45.8	Very low	113 Å²	113	116.1 Å²	116.1	58%	0.579	60%	0.601	S	S	*	*	H	α-helix	trans	-57.6	-31.8	178	-59.2	173.1	0	0	0	111.9	S2 F6 T8	S2-I4 PolarHBondContact O-N 3.09Å; I4-F6 PolarHBondContact O-N 3.08Å; I4-T8 WeakPolarHBondContact O-CB 3.44Å; I4-T8 PolarHBondContact O-N 3.25Å; I4-T8 PolarHBondContact O-OG1 3.05Å
5	E	44.4	Very low	46.5	Very low	87 Å²	87	112.3 Å²	112.3	41%	0.407	59%	0.588	S	S	.	*	H	α-helix	trans	-68.9	-32.3	177.4	-67.4	-173	161.7	0	0	112.7	M1 S2 T3 T8 I9	M1-E5 HydrophobicContact CB-CG 4.37Å; M1-E5 WeakPolarHBondContact CB-OE2 3.44Å; M1-E5 VanDerWaalsContact CG-OE1 3.32Å; M1-E5 WeakPolarHBondContact CG-OE1 3.37Å; M1-E5 WeakPolarHBondContact CG-OE2 3.43Å; S2-E5 PolarHBondContact O-N 3.03Å; T3-E5 PolarHBondContact O-N 2.77Å; E5-T8 PolarHBondContact O-N 2.73Å; E5-I9 WeakPolarHBondContact O-CB 3.07Å; E5-I9 WeakPolarHBondContact O-CD1 3.45Å; E5-I9 WeakPolarHBondContact O-CG1 3.29Å; E5-I9 PolarHBondContact O-N 2.96Å
6	F	40.6	Very low	47.1	Very low	173 Å²	173	112.3 Å²	112.3	76%	0.759	59%	0.588	S	S	*	*	H	α-helix	trans	-69.9	-41.8	-179.3	-101.7	-90.5	0	0	0	112.3	T3 I4 I9 G10	T3-F6 PolarHBondContact O-N 3.44Å; I4-F6 PolarHBondContact O-N 3.08Å; F6-I9 PolarHBondContact O-N 3.09Å; F6-G10 PolarHBondContact O-N 3.36Å
7	E	41.3	Very low	47.9	Very low	151 Å²	151	113.5 Å²	113.5	71%	0.706	59%	0.59	S	S	*	*	H	α-helix	trans	-65.9	-40.5	173.7	-65.6	-172.4	130.5	0	0	111	I9 G10 S11	E7-I9 VanDerWaalsContact C-N 3.33Å; E7-I9 PolarHBondContact O-N 3.1Å; E7-G10 PolarHBondContact O-N 3.46Å; E7-S11 PolarHBondContact O-N 2.88Å; E7-S11 PolarHBondContact O-OG 3.38Å; E7-S11 VanDerWaalsContact O-OG 3.09Å
8	T	47.8	Very low	48.5	Very low	69 Å²	69	110.6 Å²	110.6	42%	0.423	59%	0.585	S	S	.	*	H	α-helix	trans	-61.3	-39.4	175.8	-56	0	0	0	0	112.4	I4 E5 R12	I4-T8 WeakPolarHBondContact O-CB 3.44Å; I4-T8 PolarHBondContact O-N 3.25Å; I4-T8 PolarHBondContact O-OG1 3.05Å; E5-T8 PolarHBondContact O-N 2.73Å; T8-R12 PolarHBondContact O-N 3.23Å; T8-R12 VanDerWaalsContact O-N 3.17Å
9	I	53.2	Low	49.3	Very low	94 Å²	94	111.8 Å²	111.8	48%	0.482	59%	0.585	S	S	.	*	H	α-helix	trans	-70.6	-42.3	175.5	-71.5	164.6	0	0	0	111	E5 F6 E7 R12 L13	E5-I9 WeakPolarHBondContact O-CB 3.07Å; E5-I9 WeakPolarHBondContact O-CD1 3.45Å; E5-I9 WeakPolarHBondContact O-CG1 3.29Å; E5-I9 PolarHBondContact O-N 2.96Å; F6-I9 PolarHBondContact O-N 3.09Å; E7-I9 VanDerWaalsContact C-N 3.33Å; E7-I9 PolarHBondContact O-N 3.1Å; I9-R12 PolarHBondContact O-N 3.14Å; I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 PolarHBondContact O-N 2.76Å
10	G	53.8	Low	49.4	Very low	35 Å²	35	111.9 Å²	111.9	36%	0.361	59%	0.585	S	S	.	*	H	α-helix	trans	-58.8	-48.8	175.2	0	0	0	0	0	112.4	F6 E7 R12 L13 Q14	F6-G10 PolarHBondContact O-N 3.36Å; E7-G10 PolarHBondContact O-N 3.46Å; G10-R12 VanDerWaalsContact C-N 3.31Å; G10-R12 PolarHBondContact O-N 3.14Å; G10-L13 PolarHBondContact O-N 3.41Å; G10-Q14 PolarHBondContact O-N 3.04Å
11	S	48.9	Very low	49.5	Very low	79 Å²	79	112.3 Å²	112.3	55%	0.552	58%	0.584	S	S	*	*	H	α-helix	trans	-60.8	-37.1	175.9	-58.3	0	0	0	0	112.8	E7 S15	E7-S11 PolarHBondContact O-N 2.88Å; E7-S11 PolarHBondContact O-OG 3.38Å; E7-S11 VanDerWaalsContact O-OG 3.09Å; S11-S15 WeakPolarHBondContact O-CB 3.26Å; S11-S15 PolarHBondContact O-N 3.16Å
12	R	51	Low	50.2	Low	184 Å²	184	105.4 Å²	105.4	69%	0.694	56%	0.559	S	S	*	*	H	α-helix	trans	-69.5	-38.9	175.5	-86.6	-179.9	163.4	170.7	-3.5	113.1	T8 I9 G10 L16	T8-R12 PolarHBondContact O-N 3.23Å; T8-R12 VanDerWaalsContact O-N 3.17Å; I9-R12 PolarHBondContact O-N 3.14Å; G10-R12 VanDerWaalsContact C-N 3.31Å; G10-R12 PolarHBondContact O-N 3.14Å; R12-L16 PolarHBondContact O-N 2.86Å
13	L	55.5	Low	51	Low	97 Å²	97	108.4 Å²	108.4	51%	0.508	57%	0.565	S	S	.	*	H	α-helix	trans	-63.2	-48.8	174	-81.4	164.3	0	0	0	111.1	I9 G10 S15 L16 E17	I9-L13 HydrophobicContact CG2-CD1 4.08Å; I9-L13 PolarHBondContact O-N 2.76Å; G10-L13 PolarHBondContact O-N 3.41Å; L13-S15 VanDerWaalsContact C-N 3.3Å; L13-S15 PolarHBondContact O-N 2.77Å; L13-L16 WeakPolarHBondContact O-CB 3.34Å; L13-L16 PolarHBondContact O-N 3.33Å; L13-E17 PolarHBondContact O-N 3.48Å
14	Q	49.9	Very low	51.4	Low	150 Å²	150	107.5 Å²	107.5	70%	0.701	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-33.6	179.8	-159.6	170	21.6	0	0	112.5	G10 A18	G10-Q14 PolarHBondContact O-N 3.04Å; Q14-A18 WeakPolarHBondContact O-CB 3.34Å; Q14-A18 PolarHBondContact O-N 2.72Å; Q14-A18 VanDerWaalsContact O-N 3.09Å
15	S	56.1	Low	51.5	Low	59 Å²	59	108 Å²	108	41%	0.413	56%	0.556	S	S	.	*	H	α-helix	trans	-70.6	-31.6	172.4	-172.3	0	0	0	0	113.5	S11 L13 K19	S11-S15 WeakPolarHBondContact O-CB 3.26Å; S11-S15 PolarHBondContact O-N 3.16Å; L13-S15 VanDerWaalsContact C-N 3.3Å; L13-S15 PolarHBondContact O-N 2.77Å; S15-K19 WeakPolarHBondContact O-CD 3.44Å; S15-K19 VanDerWaalsContact O-CG 3.31Å; S15-K19 WeakPolarHBondContact O-CG 3.45Å; S15-K19 PolarHBondContact O-N 2.71Å
16	L	55.9	Low	51.6	Low	111 Å²	111	106.9 Å²	106.9	58%	0.581	56%	0.557	S	S	*	*	H	α-helix	trans	-72.1	-44.7	173.4	-88.7	162.7	0	0	0	111.4	R12 L13 K19 L20	R12-L16 PolarHBondContact O-N 2.86Å; L13-L16 WeakPolarHBondContact O-CB 3.34Å; L13-L16 PolarHBondContact O-N 3.33Å; L16-K19 PolarHBondContact O-N 3.16Å; L16-K19 VanDerWaalsContact O-N 3.16Å; L16-L20 WeakPolarHBondContact O-CB 3.22Å; L16-L20 PolarHBondContact O-N 2.62Å
17	E	61.4	Low	51.7	Low	134 Å²	134	104.5 Å²	104.5	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-63.5	-44.3	-179.8	-165.5	149	-143.8	0	0	111.4	L13 K19 L20 Q21	L13-E17 PolarHBondContact O-N 3.48Å; E17-K19 VanDerWaalsContact C-N 3.29Å; E17-K19 PolarHBondContact O-N 3.27Å; E17-L20 PolarHBondContact O-N 3.08Å; E17-L20 VanDerWaalsContact O-N 3.16Å; E17-Q21 WeakPolarHBondContact O-CB 3.12Å; E17-Q21 PolarHBondContact O-N 3.39Å
18	A	57.9	Low	51.7	Low	61 Å²	61	102.1 Å²	102.1	50%	0.504	54%	0.54	S	S	.	.	H	α-helix	trans	-59.2	-35.5	172.8	0	0	0	0	0	113.6	Q14 A22	Q14-A18 WeakPolarHBondContact O-CB 3.34Å; Q14-A18 PolarHBondContact O-N 2.72Å; Q14-A18 VanDerWaalsContact O-N 3.09Å; A18-A22 WeakPolarHBondContact O-CB 3.44Å; A18-A22 PolarHBondContact O-N 3.2Å; A18-A22 VanDerWaalsContact O-N 3.08Å
19	K	64.3	Low	51.4	Low	134 Å²	134	106.1 Å²	106.1	58%	0.583	55%	0.554	S	S	*	*	H	α-helix	trans	-72.5	-37.4	175.6	-76.3	171.2	179.8	173	0	112.5	S15 L16 E17 Q23	S15-K19 WeakPolarHBondContact O-CD 3.44Å; S15-K19 VanDerWaalsContact O-CG 3.31Å; S15-K19 WeakPolarHBondContact O-CG 3.45Å; S15-K19 PolarHBondContact O-N 2.71Å; L16-K19 PolarHBondContact O-N 3.16Å; L16-K19 VanDerWaalsContact O-N 3.16Å; E17-K19 VanDerWaalsContact C-N 3.29Å; E17-K19 PolarHBondContact O-N 3.27Å; K19-Q23 PolarHBondContact O-N 3.38Å
20	L	51.8	Low	50.9	Low	112 Å²	112	107.3 Å²	107.3	59%	0.586	56%	0.56	S	S	*	*	H	α-helix	trans	-69.4	-37.9	178.5	-140.8	151.2	0	0	0	110.7	L16 E17 Q23 N24	L16-L20 WeakPolarHBondContact O-CB 3.22Å; L16-L20 PolarHBondContact O-N 2.62Å; E17-L20 PolarHBondContact O-N 3.08Å; E17-L20 VanDerWaalsContact O-N 3.16Å; L20-Q23 PolarHBondContact O-N 3.12Å; L20-N24 PolarHBondContact O-N 3.5Å; L20-N24 VanDerWaalsContact O-N 3.08Å
21	Q	50.7	Low	50.3	Low	121 Å²	121	110.6 Å²	110.6	57%	0.565	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-43.1	175	-159.5	154.4	6.6	0	0	111.9	E17 Q23 N24 E25	E17-Q21 WeakPolarHBondContact O-CB 3.12Å; E17-Q21 PolarHBondContact O-N 3.39Å; Q21-Q23 VanDerWaalsContact C-N 3.3Å; Q21-Q23 PolarHBondContact O-N 3.3Å; Q21-N24 PolarHBondContact O-N 2.9Å; Q21-N24 VanDerWaalsContact O-N 3.17Å; Q21-E25 PolarHBondContact O-N 3.19Å
22	A	54.4	Low	49.7	Very low	55 Å²	55	114.2 Å²	114.2	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-61.7	-33.4	171.8	0	0	0	0	0	113.3	A18 S26	A18-A22 WeakPolarHBondContact O-CB 3.44Å; A18-A22 PolarHBondContact O-N 3.2Å; A18-A22 VanDerWaalsContact O-N 3.08Å; A22-S26 PolarHBondContact O-N 2.8Å; A22-S26 VanDerWaalsContact O-N 3.11Å
23	Q	51.8	Low	49.1	Very low	138 Å²	138	110 Å²	110	65%	0.645	58%	0.584	S	S	*	*	H	α-helix	trans	-67.2	-42.9	171.8	-77.1	-156.3	-94.9	0	0	112.4	K19 L20 Q21 S26 H27	K19-Q23 PolarHBondContact O-N 3.38Å; L20-Q23 PolarHBondContact O-N 3.12Å; Q21-Q23 VanDerWaalsContact C-N 3.3Å; Q21-Q23 PolarHBondContact O-N 3.3Å; Q23-S26 PolarHBondContact O-N 2.73Å; Q23-S26 PolarHBondContact O-OG 3.05Å; Q23-H27 PolarHBondContact O-N 3.41Å; Q23-H27 VanDerWaalsContact O-N 3.12Å
24	N	45.8	Very low	48.1	Very low	100 Å²	100	108.8 Å²	108.8	54%	0.535	60%	0.595	S	S	.	*	H	α-helix	trans	-61.8	-44.6	175.6	-91.4	13.5	0	0	0	111.8	L20 Q21 S26 H27 D28	L20-N24 PolarHBondContact O-N 3.5Å; L20-N24 VanDerWaalsContact O-N 3.08Å; Q21-N24 PolarHBondContact O-N 2.9Å; Q21-N24 VanDerWaalsContact O-N 3.17Å; N24-S26 VanDerWaalsContact C-N 3.26Å; N24-S26 PolarHBondContact O-N 3.43Å; N24-H27 WeakPolarHBondContact O-CA 3.43Å; N24-H27 WeakPolarHBondContact O-CB 3.33Å; N24-H27 PolarHBondContact O-N 3.16Å; N24-D28 PolarHBondContact O-N 2.87Å
25	E	44.8	Very low	47.3	Very low	125 Å²	125	106 Å²	106	58%	0.584	60%	0.598	S	S	*	*	H	α-helix	trans	-60.8	-34.7	176.4	-71.1	175.9	-172.7	0	0	112.4	Q21 H27	Q21-E25 PolarHBondContact O-N 3.19Å; E25-H27 VanDerWaalsContact C-N 3.29Å; E25-H27 PolarHBondContact O-N 3.24Å
26	S	45.9	Very low	46	Very low	62 Å²	62	115.4 Å²	115.4	43%	0.434	62%	0.624	S	S	.	*	H	α-helix	trans	-68	-27.5	171.4	79.1	0	0	0	0	113.7	A22 Q23 N24 I30	A22-S26 PolarHBondContact O-N 2.8Å; A22-S26 VanDerWaalsContact O-N 3.11Å; Q23-S26 PolarHBondContact O-N 2.73Å; Q23-S26 PolarHBondContact O-OG 3.05Å; N24-S26 VanDerWaalsContact C-N 3.26Å; N24-S26 PolarHBondContact O-N 3.43Å; S26-I30 WeakPolarHBondContact O-CD1 3.24Å; S26-I30 WeakPolarHBondContact O-CG1 3.29Å
27	H	43	Very low	44.7	Very low	123 Å²	123	113.8 Å²	113.8	57%	0.569	63%	0.634	S	S	*	*	H	α-helix	trans	-80.2	-41	-177.3	-138.9	-104	0	0	0	111.6	Q23 N24 E25 Q29 I30 V31	Q23-H27 PolarHBondContact O-N 3.41Å; Q23-H27 VanDerWaalsContact O-N 3.12Å; N24-H27 WeakPolarHBondContact O-CA 3.43Å; N24-H27 WeakPolarHBondContact O-CB 3.33Å; N24-H27 PolarHBondContact O-N 3.16Å; E25-H27 VanDerWaalsContact C-N 3.29Å; E25-H27 PolarHBondContact O-N 3.24Å; H27-Q29 PolarHBondContact O-N 3.46Å; H27-I30 PolarHBondContact O-N 3.25Å; H27-I30 VanDerWaalsContact O-N 3.16Å; H27-V31 WeakPolarHBondContact O-CG2 3.35Å; H27-V31 PolarHBondContact O-N 2.82Å
28	D	41.9	Very low	43.4	Very low	102 Å²	102	113.4 Å²	113.4	55%	0.545	64%	0.643	S	S	.	*	H	α-helix	trans	-68.4	-30.5	178.8	-74.4	-30.4	0	0	0	113	N24 I30 V31 L32	N24-D28 PolarHBondContact O-N 2.87Å; D28-I30 VanDerWaalsContact C-N 3.31Å; D28-I30 PolarHBondContact O-N 2.85Å; D28-V31 PolarHBondContact O-N 3.39Å; D28-L32 PolarHBondContact O-N 3.08Å
29	Q	40.4	Very low	41.9	Very low	152 Å²	152	117.1 Å²	117.1	71%	0.71	66%	0.659	S	S	*	*	H	α-helix	trans	-66.9	-30.3	171.4	-71.5	-166.2	30.8	0	0	113.3	H27 S33	H27-Q29 PolarHBondContact O-N 3.46Å; Q29-S33 PolarHBondContact O-OG 3.26Å
30	I	42.8	Very low	40	Very low	120 Å²	120	117.4 Å²	117.4	62%	0.615	67%	0.672	S	S	*	*	H	α-helix	trans	-74.5	-30.8	176.9	-66.9	168.7	0	0	0	110.8	S26 H27 D28 S33	S26-I30 WeakPolarHBondContact O-CD1 3.24Å; S26-I30 WeakPolarHBondContact O-CG1 3.29Å; H27-I30 PolarHBondContact O-N 3.25Å; H27-I30 VanDerWaalsContact O-N 3.16Å; D28-I30 VanDerWaalsContact C-N 3.31Å; D28-I30 PolarHBondContact O-N 2.85Å; I30-S33 PolarHBondContact O-OG 2.81Å
31	V	41.5	Very low	38.9	Very low	103 Å²	103	117.6 Å²	117.6	62%	0.624	68%	0.683	S	S	*	*	H	α-helix	trans	-76.1	-30.9	179.4	175.2	0	0	0	0	112.7	H27 D28	H27-V31 WeakPolarHBondContact O-CG2 3.35Å; H27-V31 PolarHBondContact O-N 2.82Å; D28-V31 PolarHBondContact O-N 3.39Å
32	L	37.8	Very low	37.7	Very low	155 Å²	155	115.4 Å²	115.4	81%	0.812	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-2.4	-175.5	-76.4	168.6	0	0	0	115.8	D28	D28-L32 PolarHBondContact O-N 3.08Å
33	S	38.1	Very low	36.5	Very low	96 Å²	96	118.8 Å²	118.8	67%	0.671	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.4	5.4	-173.5	46.4	0	0	0	0	115.2	Q29 I30	Q29-S33 PolarHBondContact O-OG 3.26Å; I30-S33 PolarHBondContact O-OG 2.81Å
34	G	34.4	Very low	35.3	Very low	72 Å²	72	118.5 Å²	118.5	74%	0.742	72%	0.72	S	S	*	*			trans	-109.6	41.4	-165.3	0	0	0	0	0	118.6
35	A	32.1	Very low	35.1	Very low	91 Å²	91	119.1 Å²	119.1	75%	0.752	73%	0.73	S	S	*	*			trans	-150.1	97.8	-179.5	0	0	0	0	0	116.8
36	R	29.2	Very low	34.2	Very low	257 Å²	257	119.4 Å²	119.4	97%	0.97	75%	0.745	S	S	*	*			trans	177.3	84.1	140.2	-98.5	165.7	-172	-157.8	2.7	114
37	G	28.9	Very low	33.3	Very low	76 Å²	76	121.3 Å²	121.3	78%	0.784	77%	0.765	S	S	*	*			trans	79.7	173.3	132.3	0	0	0	0	0	119.7
38	P	33.3	Very low	32.6	Very low	127 Å²	127	126.5 Å²	126.5	83%	0.825	78%	0.78	S	S	*	*			cis	-105.5	-175.5	0.6	40.9	-33.2	0	0	0	113.8
39	V	26.8	Very low	32	Very low	139 Å²	139	127.6 Å²	127.6	84%	0.842	79%	0.79	S	S	*	*			trans	-90.5	136.9	177.3	176.7	0	0	0	0	111.2
40	V	25.2	Very low	32	Very low	139 Å²	139	125.6 Å²	125.6	84%	0.842	79%	0.79	S	S	*	*			trans	-129.5	131.2	162.3	178.4	0	0	0	0	108.6
41	S	27.3	Very low	32.4	Very low	116 Å²	116	125.6 Å²	125.6	81%	0.811	80%	0.798	S	S	*	*			trans	-98	129.7	177.6	44.6	0	0	0	0	111.1
42	G	26.7	Very low	31.8	Very low	75 Å²	75	128.8 Å²	128.8	77%	0.773	81%	0.81	S	S	*	*			trans	-168.5	115.5	179.4	0	0	0	0	0	113.8
43	S	28	Very low	31.4	Very low	126 Å²	126	126.1 Å²	126.1	88%	0.881	81%	0.811	S	S	*	*			trans	-76.4	163.2	178.1	47.8	0	0	0	0	114.2
44	V	27.2	Very low	31	Very low	132 Å²	132	127.5 Å²	127.5	80%	0.8	82%	0.815	S	S	*	*			trans	-142.1	142.9	-178	-176.8	0	0	0	0	109.1
45	P	41.1	Very low	30.8	Very low	113 Å²	113	128.9 Å²	128.9	73%	0.734	81%	0.814	S	S	*	*			cis	-125.9	174	-22.2	37.6	-22.7	0	0	0	113.5
46	S	25.6	Very low	30.6	Very low	131 Å²	131	128.9 Å²	128.9	92%	0.916	81%	0.814	S	S	*	*			trans	-154.6	159.5	151.1	-86.8	0	0	0	0	110.9
47	A	28.8	Very low	30.6	Very low	103 Å²	103	122.4 Å²	122.4	85%	0.851	81%	0.808	S	S	*	*			trans	-91.1	161.2	-167.5	0	0	0	0	0	114.5
48	R	26.9	Very low	30.6	Very low	231 Å²	231	123.7 Å²	123.7	87%	0.872	81%	0.811	S	S	*	*			trans	-52.3	160	163.9	-96.1	177.3	166.5	179.9	-4.1	111.1
49	V	30.7	Very low	30.3	Very low	126 Å²	126	122.5 Å²	122.5	76%	0.764	81%	0.812	S	S	*	*			cis	-139.7	-154.1	36.1	-140.3	0	0	0	0	112.2
50	P	39.8	Very low	30.3	Very low	110 Å²	110	121.9 Å²	121.9	71%	0.714	81%	0.809	S	S	*	*			trans	-119.5	-148.8	-137.1	50.4	-29.8	0	0	0	113.2
51	P	51.2	Low	30.5	Very low	119 Å²	119	120.5 Å²	120.5	77%	0.773	81%	0.805	S	S	*	*				-130.5	-177.2	-123.5	35.2	-11	0	0	0	117.5
52	L	28.7	Very low	30.6	Very low	170 Å²	170	118.7 Å²	118.7	89%	0.89	80%	0.798	S	S	*	*			trans	83.3	104.9	149.7	-158	79.4	0	0	0	120.1
53	A	29.9	Very low	30.7	Very low	100 Å²	100	121 Å²	121	83%	0.826	80%	0.797	S	S	*	*			trans	-161.2	166.6	140.4	0	0	0	0	0	110
54	T	29.5	Very low	30.7	Very low	124 Å²	124	123.8 Å²	123.8	76%	0.761	80%	0.796	S	S	*	*			trans	-112.9	170.6	-165.1	51.5	0	0	0	0	115.8
55	S	31	Very low	30.9	Very low	102 Å²	102	121.5 Å²	121.5	71%	0.713	79%	0.791	S	S	*	*			trans	69.3	100.3	143.1	54.4	0	0	0	0	121.6
56	A	28	Very low	31.6	Very low	91 Å²	91	121.5 Å²	121.5	75%	0.752	79%	0.79	S	S	*	*				76.6	158.8	109.7	0	0	0	0	0	123
57	S	29.3	Very low	32	Very low	120 Å²	120	119.7 Å²	119.7	84%	0.839	78%	0.778	S	S	*	*			trans	67.5	121	163.5	34.7	0	0	0	0	120.3
58	A	27.5	Very low	32.1	Very low	103 Å²	103	123 Å²	123	85%	0.851	78%	0.78	S	S	*	*			trans	-54	156.2	169.5	0	0	0	0	0	116.3
59	A	27.4	Very low	32.2	Very low	103 Å²	103	115.9 Å²	115.9	85%	0.851	78%	0.779	S	S	*	*			trans	-154.1	151.3	135.1	0	0	0	0	0	112.3
60	T	27.7	Very low	32.4	Very low	126 Å²	126	115.3 Å²	115.3	77%	0.773	79%	0.787	S	S	*	*			trans	-66.6	135.1	-174.6	44.9	0	0	0	0	116.8
61	S	28.6	Very low	32	Very low	109 Å²	109	113.7 Å²	113.7	76%	0.762	79%	0.79	S	S	*	*				65.5	147.4	127.7	72.9	0	0	0	0	123.8
62	A	29.3	Very low	31.4	Very low	79 Å²	79	113.7 Å²	113.7	65%	0.653	79%	0.793	S	S	*	*			trans	102.7	101.1	134.4	0	0	0	0	0	121
63	T	28.1	Very low	31.8	Very low	123 Å²	123	111.5 Å²	111.5	76%	0.755	79%	0.787	S	S	*	*				80.1	145.9	123.3	58.8	0	0	0	0	124
64	H	29	Very low	32.1	Very low	185 Å²	185	112.7 Å²	112.7	86%	0.856	79%	0.789	S	S	*	*			trans	71.9	138.6	155.8	-72.8	-66.8	0	0	0	121.6
65	A	31.1	Very low	32.3	Very low	84 Å²	84	110.1 Å²	110.1	69%	0.694	79%	0.786	S	S	*	*			trans	-108.9	-170.2	166.2	0	0	0	0	0	107.4
66	P	56	Low	32.6	Very low	112 Å²	112	111.9 Å²	111.9	73%	0.727	80%	0.799	S	S	*	*			cis	-145.7	-173.6	7.5	41.4	-20	0	0	0	117.7
67	S	34	Very low	32.9	Very low	93 Å²	93	110.8 Å²	110.8	65%	0.65	80%	0.797	S	S	*	*			trans	97.3	144.6	133.4	80.5	0	0	0	0	123.8
68	L	31.6	Very low	33.3	Very low	174 Å²	174	113.4 Å²	113.4	91%	0.911	80%	0.8	S	S	*	*			trans	70.8	148.2	147.1	-69.4	160.7	0	0	0	122.8
69	G	28.3	Very low	33.7	Very low	81 Å²	81	113 Å²	113	84%	0.835	79%	0.79	S	S	*	*			trans	138.2	131.7	160.8	0	0	0	0	0	116.2
70	A	34.6	Very low	34.1	Very low	114 Å²	114	116 Å²	116	94%	0.942	79%	0.79	S	S	*	*			trans	-130.9	168.3	-175.7	0	0	0	0	0	113.9
71	G	31.5	Very low	34.5	Very low	75 Å²	75	114.1 Å²	114.1	77%	0.773	79%	0.788	S	S	*	*			trans	139	87.6	149.1	0	0	0	0	0	123.1
72	S	37.5	Very low	34.8	Very low	120 Å²	120	118.7 Å²	118.7	84%	0.839	80%	0.797	S	S	*	*				56.9	160.9	121.6	-150.9	0	0	0	0	127.1
73	V	37.2	Very low	35.2	Very low	124 Å²	124	126.2 Å²	126.2	75%	0.752	81%	0.809	S	S	*	*			trans	107.9	117.9	149.2	-170.2	0	0	0	0	123.3
74	S	36.4	Very low	36.2	Very low	125 Å²	125	125.3 Å²	125.3	87%	0.874	81%	0.805	S	S	*	*			trans	42.3	160	147.9	-57.2	0	0	0	0	126
75	G	34.2	Very low	36.6	Very low	69 Å²	69	121.2 Å²	121.2	71%	0.711	80%	0.803	S	S	*	*			cis	167.3	156.3	-10.8	0	0	0	0	0	117.3
76	S	37.6	Very low	38.2	Very low	139 Å²	139	122.8 Å²	122.8	97%	0.972	81%	0.806	S	S	*	*			trans	55.6	151.7	160.9	-56.7	0	0	0	0	123.5
77	G	34.4	Very low	38.1	Very low	69 Å²	69	123.7 Å²	123.7	71%	0.711	81%	0.812	S	S	*	*			cis	170.6	168.6	-10.6	0	0	0	0	0	115.7
78	I	37.6	Very low	38.5	Very low	175 Å²	175	126 Å²	126	90%	0.897	82%	0.822	S	S	*	*			trans	78.4	154.2	159.8	-67	170.1	0	0	0	119.9
79	S	35.4	Very low	40.1	Very low	94 Å²	94	122.9 Å²	122.9	66%	0.657	81%	0.812	S	S	*	*			cis	-175.3	156.9	-34.7	-79.4	0	0	0	0	116.4
80	I	36.3	Very low	40.5	Very low	165 Å²	165	128 Å²	128	85%	0.846	81%	0.814	S	S	*	*			trans	85.1	125.9	141.3	-75.8	164.1	0	0	0	127.1
81	A	36.3	Very low	40.6	Very low	88 Å²	88	126.4 Å²	126.4	73%	0.727	80%	0.801	S	S	*	*			trans	83.9	123.6	143.6	0	0	0	0	0	130.1
82	Q	35.1	Very low	41.1	Very low	205 Å²	205	127.8 Å²	127.8	96%	0.958	79%	0.794	S	S	*	*			trans	81.9	-179.8	137.1	-68.6	-172.6	-7.3	0	0	125.7
83	R	36.7	Very low	41.8	Very low	237 Å²	237	125.1 Å²	125.1	89%	0.894	77%	0.774	S	S	*	*			trans	-121.6	-172.7	-146.8	-124	-169.1	170	-154.2	1.5	112.9
84	P	49.2	Very low	41.7	Very low	103 Å²	103	125.6 Å²	125.6	67%	0.669	77%	0.766	S	S	*	*			cis	-139.8	-177.8	-30.2	42	-23.2	0	0	0	118
85	A	37.6	Very low	41.7	Very low	99 Å²	99	123.1 Å²	123.1	82%	0.818	76%	0.76	S	S	*	*			trans	86	159.8	145.6	0	0	0	0	0	125.8
86	P	64.3	Low	41.8	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	77%	0.766	S	S	*	*			trans	-135.4	175.2	-163.1	45.2	-28.2	0	0	0	120.2
87	P	54.6	Low	41.6	Very low	130 Å²	130	123.9 Å²	123.9	84%	0.844	76%	0.761	S	S	*	*				-154.7	-158.6	128.1	37.4	-15.1	0	0	0	119
88	V	42.7	Very low	41.5	Very low	143 Å²	143	125.9 Å²	125.9	87%	0.867	76%	0.764	S	S	*	*			trans	-140.5	0	-169.6	-124.7	0	0	0	0	113.7
89	P	64.1	Low	41.2	Very low	107 Å²	107	122.3 Å²	122.3	70%	0.695	76%	0.761	S	S	*	*				0	-165	0	45.8	-22.3	0	0	0	121
90	H	38.3	Very low	40.9	Very low	190 Å²	190	122.8 Å²	122.8	88%	0.88	76%	0.764	S	S	*	*			trans	89	150	143.9	-95	-77.7	0	0	0	131
91	A	36.1	Very low	40.6	Very low	80 Å²	80	119.9 Å²	119.9	66%	0.661	76%	0.758	S	S	*	*			trans	111.2	152.1	149.5	0	0	0	0	0	124.4	Q951	A91-Q951 PolarHBondContact O-NE2 2.96Å; A91-Q951 VanDerWaalsContact O-NE2 3.09Å
92	T	41	Very low	40.2	Very low	104 Å²	104	120.4 Å²	120.4	64%	0.638	76%	0.757	S	S	*	*			trans	-144.4	-171	-164.8	59.1	0	0	0	0	116	Q951	T92-Q951 VanDerWaalsContact CA-CD 3.43Å; T92-Q951 HydrophobicContact CG2-CG 4.06Å
93	P	52.3	Low	39.9	Very low	64 Å²	64	115.7 Å²	115.7	42%	0.416	75%	0.746	S	S	.	*			cis	-144.2	-164.9	0.3	43.9	-21	0	0	0	120.1	Q951	P93-Q951 VanDerWaalsContact CA-OE1 3.31Å
94	F	35	Very low	39.6	Very low	134 Å²	134	109.5 Å²	109.5	59%	0.588	74%	0.739	S	S	*	*			trans	76.1	161.2	165.1	-55.9	-46.5	0	0	0	121.5	Q951 S952 S953	F94-Q951 CarbonylContact C-O 3.54Å; F94-Q951 VanDerWaalsContact CA-O 3.26Å; F94-Q951 WeakPolarHBondContact CA-O 3.27Å; F94-Q951 PolarHBondContact N-O 3.29Å; F94-Q951 VanDerWaalsContact N-O 3.08Å; F94-S952 PolarHBondContact N-O 3.07Å; F94-S953 WeakPolarHBondContact CD1-O 3.16Å; F94-S953 WeakPolarHBondContact CE1-O 3.48Å
95	G	36.3	Very low	38.7	Very low	72 Å²	72	109.9 Å²	109.9	74%	0.742	74%	0.744	S	S	*	*			cis	169.2	-180	0.1	0	0	0	0	0	111.4
96	S	36.6	Very low	38.3	Very low	120 Å²	120	109.4 Å²	109.4	84%	0.839	74%	0.74	S	S	*	*			cis	-177.1	152.1	-19.8	54.3	0	0	0	0	114.8
97	A	33.9	Very low	36.7	Very low	104 Å²	104	109 Å²	109	86%	0.86	74%	0.74	S	S	*	*			trans	68.8	148.8	163.5	0	0	0	0	0	123.3
98	S	32.2	Very low	35.3	Very low	111 Å²	111	106.7 Å²	106.7	78%	0.776	73%	0.732	S	S	*	*			cis	-171.5	146.5	-17.8	56.8	0	0	0	0	115.8
99	A	30.8	Very low	34.4	Very low	101 Å²	101	109.5 Å²	109.5	84%	0.835	73%	0.733	S	S	*	*			trans	62.3	156.4	154.9	0	0	0	0	0	121.9
100	S	28.7	Very low	32.7	Very low	103 Å²	103	108.6 Å²	108.6	72%	0.72	74%	0.735	S	S	*	*			cis	-166.6	165.8	-24.5	58.8	0	0	0	0	113.8
101	S	30.1	Very low	32.9	Very low	104 Å²	104	105 Å²	105	73%	0.727	73%	0.731	S	S	*	*			trans	73	141.9	149.5	47.9	0	0	0	0	125.2
102	S	28.6	Very low	32.8	Very low	100 Å²	100	106 Å²	106	70%	0.699	74%	0.739	S	S	*	*			trans	63.1	94	147.7	56.9	0	0	0	0	123.7
103	S	28.9	Very low	32.9	Very low	106 Å²	106	105.4 Å²	105.4	74%	0.741	75%	0.745	S	S	*	*				44.2	137.8	114.3	67.3	0	0	0	0	124.3
104	S	30.4	Very low	32.8	Very low	107 Å²	107	107.8 Å²	107.8	75%	0.748	76%	0.76	S	S	*	*			trans	95.5	105.2	141.6	-58.2	0	0	0	0	122
105	S	30.6	Very low	33.6	Very low	110 Å²	110	106 Å²	106	77%	0.769	77%	0.77	S	S	*	*			trans	61.6	117.6	130.2	64.3	0	0	0	0	124.4
106	A	29.5	Very low	33.9	Very low	89 Å²	89	109.5 Å²	109.5	74%	0.736	78%	0.777	S	S	*	*				87.5	134.9	127.7	0	0	0	0	0	122.9
107	S	29.4	Very low	34.7	Very low	109 Å²	109	107 Å²	107	76%	0.762	77%	0.77	S	S	*	*			trans	47.6	114.2	156.1	46.6	0	0	0	0	119.5
108	A	26.7	Very low	35.6	Very low	82 Å²	82	108.1 Å²	108.1	68%	0.678	77%	0.767	S	S	*	*				64.9	131.2	71.8	0	0	0	0	0	113.4
109	F	23.3	Very low	36.3	Very low	202 Å²	202	112.1 Å²	112.1	89%	0.886	77%	0.771	S	S	*	*			cis	-143.5	167.6	25.2	-85.1	-100.3	0	0	0	113.6
110	A	28.3	Very low	36.5	Very low	88 Å²	88	111 Å²	111	73%	0.727	77%	0.769	S	S	*	*			trans	23	149.9	143.6	0	0	0	0	0	122.8
111	S	43.3	Very low	37.1	Very low	115 Å²	115	109.2 Å²	109.2	80%	0.804	77%	0.767	S	S	*	*			cis	-175.9	166.5	-7.8	-95.8	0	0	0	0	111.7
112	A	33.9	Very low	37.1	Very low	101 Å²	101	110.5 Å²	110.5	84%	0.835	77%	0.771	S	S	*	*			trans	76.4	151.8	154.6	0	0	0	0	0	120.3
113	A	43.3	Very low	37.2	Very low	92 Å²	92	115 Å²	115	76%	0.76	77%	0.774	S	S	*	*			cis	-156.9	-76.3	-23.7	0	0	0	0	0	117
114	P	50.2	Low	37.4	Very low	113 Å²	113	115.3 Å²	115.3	73%	0.734	77%	0.771	S	S	*	*			trans	-138	158	-131.1	38.8	-20.5	0	0	0	120.4
115	A	50.9	Low	38	Very low	96 Å²	96	115.6 Å²	115.6	79%	0.793	77%	0.771	S	S	*	*			trans	68.5	179	149.7	0	0	0	0	0	116.5
116	T	43.1	Very low	38.8	Very low	146 Å²	146	115 Å²	115	90%	0.896	76%	0.764	S	S	*	*			cis	-143	169.2	14.7	60.5	0	0	0	0	113.4
117	G	52.6	Low	39	Very low	67 Å²	67	115.2 Å²	115.2	69%	0.691	76%	0.756	S	S	*	*			trans	137	156.7	175.9	0	0	0	0	0	111.9
118	T	52	Low	38.9	Very low	128 Å²	128	115.3 Å²	115.3	79%	0.785	75%	0.752	S	S	*	*			cis	-150.7	173	-10.9	67.2	0	0	0	0	107.4
119	F	47.8	Very low	39.1	Very low	196 Å²	196	122.5 Å²	122.5	86%	0.86	76%	0.762	S	S	*	*			cis	-153.8	150.2	-0.8	-137.6	-60.3	0	0	0	108
120	G	35.8	Very low	39.6	Very low	77 Å²	77	118.3 Å²	118.3	79%	0.794	75%	0.753	S	S	*	*			trans	51.9	108.2	155.5	0	0	0	0	0	120.4
121	G	41.4	Very low	39.7	Very low	66 Å²	66	119.8 Å²	119.8	68%	0.68	76%	0.758	S	S	*	*			cis	167.4	168	-4.6	0	0	0	0	0	113.2
122	T	29	Very low	38.8	Very low	131 Å²	131	125.8 Å²	125.8	80%	0.804	76%	0.763	S	S	*	*			trans	74.1	157.2	178.3	-9.9	0	0	0	0	116.9
123	Y	31.5	Very low	38.5	Very low	194 Å²	194	124.6 Å²	124.6	76%	0.761	75%	0.753	S	S	*	*			trans	57.3	95.9	167.4	-74.1	-76	0	0	0	120.2
124	T	32.3	Very low	37.8	Very low	112 Å²	112	126 Å²	126	69%	0.687	75%	0.752	S	S	*	*				50.7	155.7	113.6	64.1	0	0	0	0	122.4
125	P	42.5	Very low	37	Very low	114 Å²	114	126.9 Å²	126.9	74%	0.74	76%	0.758	S	S	*	*			cis	-124.2	-103.4	-28.5	29.1	-7.2	0	0	0	115.4
126	P	47.5	Very low	36	Very low	97 Å²	97	128.7 Å²	128.7	63%	0.63	76%	0.759	S	S	*	*				-142.6	-165.4	-116	44.1	-22.8	0	0	0	116.4
127	T	33.9	Very low	35.8	Very low	93 Å²	93	129.4 Å²	129.4	57%	0.571	76%	0.757	S	S	*	*				42.3	107	128.8	-75.9	0	0	0	0	116.5	R129	T127-R129 HydrophobicContact CG2-CG 4.42Å
128	T	27.6	Very low	35.6	Very low	112 Å²	112	131 Å²	131	69%	0.687	76%	0.756	S	S	*	*				49.2	148.2	78.8	80	0	0	0	0	114
129	R	31.5	Very low	34.4	Very low	232 Å²	232	132.8 Å²	132.8	88%	0.875	76%	0.757	S	S	*	*				-149.7	98.6	126.8	-108.9	166	-169.6	-147.3	0.9	106.3	T127	T127-R129 HydrophobicContact CG2-CG 4.42Å
130	V	33	Very low	33.8	Very low	114 Å²	114	130.8 Å²	130.8	69%	0.691	75%	0.754	S	S	*	*				82.6	101.1	93.6	163.5	0	0	0	0	109.1	R132	V130-R132 PolarHBondContact O-N 3.43Å
131	S	30.6	Very low	33.5	Very low	120 Å²	120	133 Å²	133	84%	0.839	76%	0.758	S	S	*	*			trans	-54.5	122.7	167.6	-30.6	0	0	0	0	110.4
132	R	25.4	Very low	33.2	Very low	240 Å²	240	135.7 Å²	135.7	91%	0.906	77%	0.766	S	S	*	*			trans	-161.1	164.2	148	-129.2	179.2	178.3	160.3	2.3	114.5	V130	V130-R132 PolarHBondContact O-N 3.43Å
133	A	26.4	Very low	33.4	Very low	77 Å²	77	132.9 Å²	132.9	64%	0.636	76%	0.763	S	S	*	*			trans	70.7	94.2	153.7	0	0	0	0	0	117.7
134	T	28.7	Very low	33.9	Very low	120 Å²	120	130.1 Å²	130.1	74%	0.736	77%	0.769	S	S	*	*				22.6	129.9	119.2	49.5	0	0	0	0	118.8
135	P	33.4	Very low	33.9	Very low	132 Å²	132	128.8 Å²	128.8	86%	0.857	78%	0.777	S	S	*	*			trans	-73.7	129.8	179.1	31.4	-34.8	0	0	0	112.8
136	T	29.3	Very low	33.4	Very low	134 Å²	134	127.1 Å²	127.1	82%	0.822	78%	0.781	S	S	*	*			trans	-144.7	145.1	160.4	-23.8	0	0	0	0	110.5
137	L	38.7	Very low	32.8	Very low	162 Å²	162	126 Å²	126	85%	0.848	79%	0.787	S	S	*	*			trans	-69.4	175.9	171.3	-58	172.2	0	0	0	110.1
138	P	49.4	Very low	33.1	Very low	101 Å²	101	129.2 Å²	129.2	66%	0.656	80%	0.8	S	S	*	*			cis	-146.2	179	17.3	35.4	-11.5	0	0	0	117.1
139	M	26.6	Very low	33.5	Very low	164 Å²	164	130.5 Å²	130.5	81%	0.808	80%	0.803	S	S	*	*				175.7	165.7	109.6	-100.3	-59.8	157.7	0	0	115.5
140	L	35.7	Very low	33.7	Very low	155 Å²	155	130.8 Å²	130.8	81%	0.812	80%	0.804	S	S	*	*			trans	-89.7	154.3	179.3	-73	62	0	0	0	111.6
141	S	30	Very low	34.2	Very low	124 Å²	124	130.5 Å²	130.5	87%	0.867	80%	0.802	S	S	*	*				-158	157.7	124.7	-161.6	0	0	0	0	111.3
142	S	33.4	Very low	34.8	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	79%	0.785	S	S	*	*			trans	-109.8	151.8	-174.6	47	0	0	0	0	112.7
143	G	33.3	Very low	35.7	Very low	73 Å²	73	125.1 Å²	125.1	75%	0.753	78%	0.779	S	S	*	*			trans	-149.6	143.4	170.5	0	0	0	0	0	110.4
144	P	43.7	Very low	36.9	Very low	135 Å²	135	127.1 Å²	127.1	88%	0.877	78%	0.783	S	S	*	*			trans	-116.8	161.9	-154.6	40.7	-31.2	0	0	0	116.6
145	G	31.5	Very low	38	Very low	84 Å²	84	129 Å²	129	87%	0.866	79%	0.787	S	S	*	*			trans	94.6	132.2	167	0	0	0	0	0	114.5
146	G	32.1	Very low	39.1	Very low	80 Å²	80	129.5 Å²	129.5	83%	0.825	78%	0.782	S	S	*	*			cis	179.1	167.4	-7.4	0	0	0	0	0	111.2
147	G	34.6	Very low	40.1	Very low	72 Å²	72	128.8 Å²	128.8	74%	0.742	78%	0.779	S	S	*	*			trans	88.6	95.6	163.3	0	0	0	0	0	118.9
148	L	40.4	Very low	40.6	Very low	161 Å²	161	128.5 Å²	128.5	84%	0.843	78%	0.778	S	S	*	*			trans	72.5	139.2	138.6	-58.2	169.3	0	0	0	122.1
149	N	36.6	Very low	40.6	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	78%	0.782	S	S	*	*			trans	65.3	80.8	151.5	-61.1	-19.7	0	0	0	120.7	T151	N149-T151 PolarHBondContact O-N 2.91Å
150	R	35.9	Very low	41.7	Very low	238 Å²	238	127 Å²	127	90%	0.898	78%	0.778	S	S	*	*			trans	-68.4	115.1	160.6	-82.1	-179.6	165.3	179.6	-4.5	112.9
151	T	41.7	Very low	42.3	Very low	107 Å²	107	124.8 Å²	124.8	66%	0.656	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-90.4	134.6	155.6	46.4	0	0	0	0	110	N149	N149-T151 PolarHBondContact O-N 2.91Å
152	R	43.9	Very low	43.1	Very low	126 Å²	126	124.9 Å²	124.9	48%	0.475	77%	0.771	S	S	.	*	P	Polyproline II helix	trans	-60.2	139	170.5	-56.5	178.4	177.7	158.6	0	109.4	R1107 Y1109 V1110	R152-R1107 PolarHBondContact O-NH2 3.22Å; R152-Y1109 PolarHBondContact NH2-O 3.47Å; R152-V1110 VanDerWaalsContact NH2-N 3.18Å; R152-V1110 PolarHBondContact NH2-O 3.17Å
153	P	45.3	Very low	43.8	Very low	122 Å²	122	127.1 Å²	127.1	79%	0.792	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.4	147.2	169.7	28.2	-34.6	0	0	0	110.6
154	V	50.9	Low	44.8	Very low	119 Å²	119	128.6 Å²	128.6	72%	0.721	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-82.4	130.1	168.8	174.9	0	0	0	0	107.8	L156	V154-L156 PolarHBondContact O-N 2.94Å; V154-L156 VanDerWaalsContact O-N 3.14Å
155	I	52.7	Low	45	Very low	159 Å²	159	128 Å²	128	82%	0.815	76%	0.76	S	S	*	*			trans	-72.3	105.5	165.8	-62.1	175	0	0	0	106.3
156	L	54.7	Low	46.1	Very low	143 Å²	143	128.3 Å²	128.3	75%	0.749	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.8	133.9	166.2	-71.8	169.8	0	0	0	108.2	V154 L158	V154-L156 PolarHBondContact O-N 2.94Å; V154-L156 VanDerWaalsContact O-N 3.14Å; L156-L158 PolarHBondContact O-N 2.97Å
157	P	52.1	Low	47.7	Very low	118 Å²	118	126.3 Å²	126.3	77%	0.766	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-55	125.5	168	-23.3	33.9	0	0	0	109.1
158	L	48.8	Very low	49.1	Very low	156 Å²	156	128.9 Å²	128.9	82%	0.817	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-56.3	134.6	171.6	-174.4	71.9	0	0	0	107.9	L156 T160	L156-L158 PolarHBondContact O-N 2.97Å; L158-T160 PolarHBondContact O-N 2.77Å
159	P	49.4	Very low	50	Low	114 Å²	114	122.7 Å²	122.7	74%	0.74	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-53.6	118.9	175.5	-26	35	0	0	0	109.5
160	T	49.3	Very low	51.5	Low	120 Å²	120	118.8 Å²	118.8	74%	0.736	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-57.6	138	169.6	34.9	0	0	0	0	108	L158	L158-T160 PolarHBondContact O-N 2.77Å
161	P	47.8	Very low	53	Low	109 Å²	109	112.4 Å²	112.4	71%	0.708	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-56.4	139.7	175.8	25.2	-33.7	0	0	0	108.2	H163	P161-H163 PolarHBondContact O-N 3.35Å
162	P	48	Very low	54.2	Low	125 Å²	125	110 Å²	110	81%	0.812	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-54.6	131.8	178.9	23.7	-33.4	0	0	0	108.5
163	H	48.2	Very low	55.3	Low	168 Å²	168	106.4 Å²	106.4	78%	0.778	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-50	139.5	177.4	-82.7	-92.2	0	0	0	109.3	P161	P161-H163 PolarHBondContact O-N 3.35Å
164	P	52.8	Low	56.4	Low	104 Å²	104	106.6 Å²	106.6	68%	0.675	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-53.4	139.8	173.5	25.1	-34.3	0	0	0	108.4	V166	P164-V166 PolarHBondContact O-N 2.91Å
165	P	49.4	Very low	57.5	Low	124 Å²	124	104.7 Å²	104.7	81%	0.805	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-54.3	117.3	-173.2	21.8	-33.1	0	0	0	109	S167	P165-S167 PolarHBondContact O-N 3.25Å
166	V	54.3	Low	58.3	Low	89 Å²	89	97.2 Å²	97.2	54%	0.539	55%	0.546	S	S	.	.			trans	-50	116	-176	-178.9	0	0	0	0	107	P164 E168 D170 M171	P164-V166 PolarHBondContact O-N 2.91Å; V166-E168 PolarHBondContact O-N 3Å; V166-D170 HydrophobicContact CG1-CB 3.81Å; V166-M171 HydrophobicContact CG1-CG 3.88Å; V166-M171 WeakPolarHBondContact O-CE 3.49Å
167	S	65.6	Low	59.2	Low	39 Å²	39	95.1 Å²	95.1	27%	0.273	53%	0.534	S	S	.	.			trans	-65.5	147.3	-168.5	75.4	0	0	0	0	108.8	P165 T169 D170 M171 K238	P165-S167 PolarHBondContact O-N 3.25Å; S167-T169 PolarHBondContact O-N 3.04Å; S167-T169 PolarHBondContact OG-OG1 3.41Å; S167-D170 WeakPolarHBondContact CB-OD2 3.25Å; S167-D170 PolarHBondContact N-OD2 3.1Å; S167-D170 WeakPolarHBondContact O-CA 3.28Å; S167-D170 WeakPolarHBondContact O-CB 3.48Å; S167-D170 PolarHBondContact O-N 3.08Å; S167-D170 PolarHBondContact OG-N 2.93Å; S167-D170 PolarHBondContact OG-OD2 2.95Å; S167-M171 PolarHBondContact O-N 2.97Å; S167-M171 VanDerWaalsContact O-N 3.13Å; S167-K238 PolarHBondContact OG-NZ 3.15Å; S167-K238 VanDerWaalsContact OG-NZ 3.16Å
168	E	63.8	Low	60.2	Low	125 Å²	125	94.3 Å²	94.3	58%	0.584	52%	0.52	S	S	*	.	H	α-helix	trans	-50	-32.4	-179.6	-168.8	-158.1	135.5	0	0	111.7	V166 M171 K172	V166-E168 PolarHBondContact O-N 3Å; E168-M171 PolarHBondContact O-N 3.36Å; E168-K172 WeakPolarHBondContact O-CG 3.33Å; E168-K172 PolarHBondContact O-N 2.99Å; E168-K172 WeakPolarHBondContact OE1-CE 3.44Å; E168-K172 IonicContact OE1-NZ 2.63Å; E168-K172 PolarHBondContact OE1-NZ 3.4Å
169	T	59.1	Low	61.2	Low	32 Å²	32	91.3 Å²	91.3	20%	0.196	50%	0.501	C	S	.	.	H	α-helix	trans	-73.7	-26.6	177.5	57.4	0	0	0	0	114.5	S167 L173 K238 M242	S167-T169 PolarHBondContact O-N 3.04Å; S167-T169 PolarHBondContact OG-OG1 3.41Å; T169-L173 VanDerWaalsContact O-CB 3.31Å; T169-L173 WeakPolarHBondContact O-CB 3.4Å; T169-L173 PolarHBondContact O-N 3.5Å; T169-K238 VanDerWaalsContact CB-CE 3.47Å; T169-K238 WeakPolarHBondContact OG1-CE 3.46Å; T169-K238 PolarHBondContact OG1-NZ 3.22Å; T169-M242 HydrophobicContact CG2-CE 3.59Å; T169-M242 HydrophobicContact CG2-CG 4.33Å; T169-M242 HydrophobicContact CG2-SD 3.36Å; T169-M242 WeakPolarHBondContact CG2-SD 3.33Å
170	D	67.6	Low	62.8	Low	58 Å²	58	87.7 Å²	87.7	31%	0.31	48%	0.478	S	S	.	.	H	α-helix	trans	-78.7	-34.6	170.7	-55.6	-46.9	0	0	0	111.5	V166 S167 L173 K174 K238	V166-D170 HydrophobicContact CG1-CB 3.81Å; S167-D170 WeakPolarHBondContact CB-OD2 3.25Å; S167-D170 PolarHBondContact N-OD2 3.1Å; S167-D170 WeakPolarHBondContact O-CA 3.28Å; S167-D170 WeakPolarHBondContact O-CB 3.48Å; S167-D170 PolarHBondContact O-N 3.08Å; S167-D170 PolarHBondContact OG-N 2.93Å; S167-D170 PolarHBondContact OG-OD2 2.95Å; D170-L173 WeakPolarHBondContact O-CB 3.48Å; D170-L173 PolarHBondContact O-N 3.49Å; D170-K174 PolarHBondContact O-N 2.98Å; D170-K238 VanDerWaalsContact CG-NZ 3.34Å; D170-K238 WeakPolarHBondContact OD1-CE 3.45Å; D170-K238 IonicContact OD1-NZ 3.26Å; D170-K238 PolarHBondContact OD1-NZ 3.3Å; D170-K238 IonicContact OD2-NZ 3.59Å; D170-K238 PolarHBondContact OD2-NZ 3.08Å
171	M	67.8	Low	64.3	Low	104 Å²	104	83.1 Å²	83.1	51%	0.512	45%	0.454	S	S	.	.	H	α-helix	trans	-64.7	-44.7	169.9	-72.2	-171.2	-102.9	0	0	111.2	V166 S167 E168 K174 I175	V166-M171 HydrophobicContact CG1-CG 3.88Å; V166-M171 WeakPolarHBondContact O-CE 3.49Å; S167-M171 PolarHBondContact O-N 2.97Å; S167-M171 VanDerWaalsContact O-N 3.13Å; E168-M171 PolarHBondContact O-N 3.36Å; M171-K174 PolarHBondContact O-N 3.15Å; M171-I175 WeakPolarHBondContact O-CG1 3.44Å; M171-I175 PolarHBondContact O-N 2.71Å
172	K	66.3	Low	66.2	Low	57 Å²	57	82 Å²	82	25%	0.248	44%	0.438	C	S	.	.	H	α-helix	trans	-60.4	-43.7	172.2	-76.9	175.8	179.2	171.1	0	112.2	E168 K174 I175 I176	E168-K172 WeakPolarHBondContact O-CG 3.33Å; E168-K172 PolarHBondContact O-N 2.99Å; E168-K172 WeakPolarHBondContact OE1-CE 3.44Å; E168-K172 IonicContact OE1-NZ 2.63Å; E168-K172 PolarHBondContact OE1-NZ 3.4Å; K172-K174 VanDerWaalsContact C-N 3.34Å; K172-K174 PolarHBondContact O-N 2.81Å; K172-I175 PolarHBondContact O-N 3.09Å; K172-I176 WeakPolarHBondContact O-CD1 3.47Å; K172-I176 VanDerWaalsContact O-CG1 3.24Å; K172-I176 WeakPolarHBondContact O-CG1 3.48Å; K172-I176 PolarHBondContact O-N 3.19Å
173	L	67.4	Low	68.3	Low	49 Å²	49	76 Å²	76	26%	0.257	40%	0.4	S	S	.	.	H	α-helix	trans	-54.5	-48.7	173.4	173.1	60.1	0	0	0	111.7	T169 D170 I175 I176 M177 L241	T169-L173 VanDerWaalsContact O-CB 3.31Å; T169-L173 WeakPolarHBondContact O-CB 3.4Å; T169-L173 PolarHBondContact O-N 3.5Å; D170-L173 WeakPolarHBondContact O-CB 3.48Å; D170-L173 PolarHBondContact O-N 3.49Å; L173-I175 PolarHBondContact O-N 2.95Å; L173-I176 PolarHBondContact O-N 3Å; L173-M177 HydrophobicContact CD1-CG 4.21Å; L173-M177 HydrophobicContact CD1-SD 3.92Å; L173-M177 HydrophobicContact CG-SD 4.1Å; L173-M177 WeakPolarHBondContact O-CG 3.39Å; L173-M177 PolarHBondContact O-N 3.4Å; L173-L241 HydrophobicContact CD1-CB 4.44Å; L173-L241 HydrophobicContact CD1-CD1 3.43Å; L173-L241 VanDerWaalsContact CD1-CD1 3.43Å; L173-L241 HydrophobicContact CD1-CG 4.42Å
174	K	68.9	Low	70.3	Confident	126 Å²	126	72.1 Å²	72.1	55%	0.548	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-44.1	177.5	-172	171.1	-176.9	-71.8	0	112.2	D170 M171 K172 I176 M177 E178	D170-K174 PolarHBondContact O-N 2.98Å; M171-K174 PolarHBondContact O-N 3.15Å; K172-K174 VanDerWaalsContact C-N 3.34Å; K172-K174 PolarHBondContact O-N 2.81Å; K174-I176 PolarHBondContact O-N 3.39Å; K174-M177 PolarHBondContact O-N 3.14Å; K174-E178 IonicContact NZ-OE1 2.8Å; K174-E178 PolarHBondContact NZ-OE1 3.14Å; K174-E178 WeakPolarHBondContact O-CB 3.39Å; K174-E178 WeakPolarHBondContact O-CG 3.35Å; K174-E178 PolarHBondContact O-N 3.42Å
175	I	72.6	Confident	72	Confident	79 Å²	79	67.3 Å²	67.3	41%	0.405	35%	0.353	S	S	.	.	H	α-helix	trans	-61.3	-43.8	175.8	-67.9	163.5	0	0	0	111.3	M171 K172 L173 E178 Q179	M171-I175 WeakPolarHBondContact O-CG1 3.44Å; M171-I175 PolarHBondContact O-N 2.71Å; K172-I175 PolarHBondContact O-N 3.09Å; L173-I175 PolarHBondContact O-N 2.95Å; I175-E178 PolarHBondContact O-N 2.89Å; I175-Q179 WeakPolarHBondContact O-CB 3.4Å; I175-Q179 VanDerWaalsContact O-CG 3.28Å; I175-Q179 WeakPolarHBondContact O-CG 3.25Å; I175-Q179 PolarHBondContact O-N 3.4Å
176	I	70.9	Confident	73.8	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.01	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-45	177.1	-65.1	155.8	0	0	0	110	K172 L173 K174 E178 Q179 T180 L241 L244 D245	K172-I176 WeakPolarHBondContact O-CD1 3.47Å; K172-I176 VanDerWaalsContact O-CG1 3.24Å; K172-I176 WeakPolarHBondContact O-CG1 3.48Å; K172-I176 PolarHBondContact O-N 3.19Å; L173-I176 PolarHBondContact O-N 3Å; K174-I176 PolarHBondContact O-N 3.39Å; I176-E178 PolarHBondContact O-N 3.4Å; I176-Q179 CarbonylContact O-C 3.35Å; I176-Q179 WeakPolarHBondContact O-CA 3.39Å; I176-Q179 PolarHBondContact O-N 3.06Å; I176-T180 WeakPolarHBondContact O-CG2 3.21Å; I176-T180 PolarHBondContact O-N 3.14Å; I176-L241 HydrophobicContact CD1-CB 4.15Å; I176-L241 WeakPolarHBondContact CD1-O 3.47Å; I176-L241 HydrophobicContact CG2-CD2 4.19Å; I176-L244 HydrophobicContact CG2-CD2 4.44Å; I176-D245 HydrophobicContact CD1-CB 4.23Å
177	M	72.8	Confident	75.2	Confident	100 Å²	100	67.6 Å²	67.6	49%	0.493	36%	0.361	S	S	.	.	H	α-helix	trans	-61.8	-40.9	176.9	-68.3	178.7	77.6	0	0	112	L173 K174 Q179 T180	L173-M177 HydrophobicContact CD1-CG 4.21Å; L173-M177 HydrophobicContact CD1-SD 3.92Å; L173-M177 HydrophobicContact CG-SD 4.1Å; L173-M177 WeakPolarHBondContact O-CG 3.39Å; L173-M177 PolarHBondContact O-N 3.4Å; K174-M177 PolarHBondContact O-N 3.14Å; M177-Q179 PolarHBondContact O-N 3.12Å; M177-T180 PolarHBondContact O-N 3.28Å; M177-T180 PolarHBondContact O-OG1 3.26Å
178	E	73.1	Confident	76.4	Confident	100 Å²	100	74.2 Å²	74.2	47%	0.467	38%	0.38	S	S	.	.	H	α-helix	trans	-68.2	-18.8	173.2	-72	168.9	-179.5	0	0	114.2	K174 I175 I176 K182	K174-E178 IonicContact NZ-OE1 2.8Å; K174-E178 PolarHBondContact NZ-OE1 3.14Å; K174-E178 WeakPolarHBondContact O-CB 3.39Å; K174-E178 WeakPolarHBondContact O-CG 3.35Å; K174-E178 PolarHBondContact O-N 3.42Å; I175-E178 PolarHBondContact O-N 2.89Å; I176-E178 PolarHBondContact O-N 3.4Å; E178-K182 PolarHBondContact O-NZ 3.35Å
179	Q	71.3	Confident	77.7	Confident	93 Å²	93	74.8 Å²	74.8	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-94.8	-10	173.2	-71	178.8	10.4	0	0	113.6	I175 I176 M177	I175-Q179 WeakPolarHBondContact O-CB 3.4Å; I175-Q179 VanDerWaalsContact O-CG 3.28Å; I175-Q179 WeakPolarHBondContact O-CG 3.25Å; I175-Q179 PolarHBondContact O-N 3.4Å; I176-Q179 CarbonylContact O-C 3.35Å; I176-Q179 WeakPolarHBondContact O-CA 3.39Å; I176-Q179 PolarHBondContact O-N 3.06Å; M177-Q179 PolarHBondContact O-N 3.12Å
180	T	82.4	Confident	79.2	Confident	39 Å²	39	75.8 Å²	75.8	24%	0.239	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	157.5	169.3	66.3	0	0	0	0	111.3	I176 M177 K182 C262 V264	I176-T180 WeakPolarHBondContact O-CG2 3.21Å; I176-T180 PolarHBondContact O-N 3.14Å; M177-T180 PolarHBondContact O-N 3.28Å; M177-T180 PolarHBondContact O-OG1 3.26Å; T180-K182 VanDerWaalsContact C-N 3.26Å; T180-K182 PolarHBondContact O-N 2.95Å; T180-C262 VanDerWaalsContact CA-O 3.32Å; T180-C262 WeakPolarHBondContact CA-O 3.45Å; T180-V264 HydrophobicContact CG2-CB 3.92Å; T180-V264 HydrophobicContact CG2-CG2 3.78Å
181	G	80.4	Confident	80.3	Confident	24 Å²	24	78.2 Å²	78.2	25%	0.247	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	10.9	-178.3	0	0	0	0	0	113.9	P191 T192	G181-P191 WeakPolarHBondContact O-CA 3.27Å; G181-T192 CarbonylContact C-O 2.83Å; G181-T192 VanDerWaalsContact CA-O 3.29Å; G181-T192 WeakPolarHBondContact CA-O 3.41Å; G181-T192 PolarHBondContact O-N 3.1Å
182	K	87.8	Confident	81.4	Confident	85 Å²	85	73.8 Å²	73.8	37%	0.37	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	121.7	-179	-64.6	164.3	-170.9	155.3	0	110.6	E178 T180 Q189 Y190	E178-K182 PolarHBondContact O-NZ 3.35Å; T180-K182 VanDerWaalsContact C-N 3.26Å; T180-K182 PolarHBondContact O-N 2.95Å; K182-Q189 HydrophobicContact CB-CG 4.11Å; K182-Y190 CarbonylContact C-O 3.56Å; K182-Y190 VanDerWaalsContact CA-O 3.29Å; K182-Y190 WeakPolarHBondContact CA-O 3.4Å
183	L	90.9	Very high	82.6	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	122.3	174.2	-61.2	-170.9	0	0	0	111.1	I185 Q189 Y190 T192 L197 I223 L260 F263 C272	L183-I185 HydrophobicContact CB-CD1 4.08Å; L183-I185 HydrophobicContact CB-CG1 4.09Å; L183-I185 HydrophobicContact CD1-CD1 4.21Å; L183-Q189 WeakPolarHBondContact O-CA 3.31Å; L183-Y190 PolarHBondContact N-O 3.48Å; L183-Y190 PolarHBondContact O-N 3.39Å; L183-T192 HydrophobicContact CD1-CG2 3.85Å; L183-T192 HydrophobicContact CG-CG2 4.14Å; L183-L197 HydrophobicContact CD1-CD2 4.4Å; L183-I223 HydrophobicContact CD1-CD1 4.32Å; L183-L260 CarbonylContact C-O 3.59Å; L183-L260 WeakPolarHBondContact CA-O 3.41Å; L183-F263 HydrophobicContact CD1-CZ 4.1Å; L183-F263 HydrophobicContact CD2-CE2 4.16Å; L183-F263 HydrophobicContact CD2-CZ 3.77Å; L183-F263 HydrophobicContact CG-CZ 3.91Å; L183-C272 HydrophobicContact CD1-CB 4.41Å; L183-C272 HydrophobicContact CD2-CB 3.73Å
184	N	90.3	Very high	83.6	Confident	86 Å²	86	72.4 Å²	72.4	46%	0.46	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	106.6	168	-176.2	-4.4	0	0	0	109.6	G187 R188 L260	N184-G187 WeakPolarHBondContact OD1-CA 3.29Å; N184-G187 PolarHBondContact OD1-N 3.22Å; N184-R188 WeakPolarHBondContact CA-O 3.33Å; N184-L260 PolarHBondContact N-O 2.87Å; N184-L260 WeakPolarHBondContact O-CD2 3.12Å
185	I	89.6	Confident	84.6	Confident	3 Å²	3	72.8 Å²	72.8	2%	0.015	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.7	-179	-58.2	178.8	0	0	0	108.2	L183 G187 R188 Y190 H216 S219 T221 L260	L183-I185 HydrophobicContact CB-CD1 4.08Å; L183-I185 HydrophobicContact CB-CG1 4.09Å; L183-I185 HydrophobicContact CD1-CD1 4.21Å; I185-G187 PolarHBondContact O-N 2.9Å; I185-G187 VanDerWaalsContact O-N 3.13Å; I185-R188 PolarHBondContact N-O 3.3Å; I185-R188 PolarHBondContact O-N 2.88Å; I185-Y190 HydrophobicContact CB-CD2 4.13Å; I185-Y190 HydrophobicContact CB-CE2 4.03Å; I185-H216 HydrophobicContact CD1-CB 4.3Å; I185-H216 WeakPolarHBondContact CD1-ND1 3.37Å; I185-S219 WeakPolarHBondContact CD1-OG 3.41Å; I185-T221 HydrophobicContact CG2-CG2 3.87Å; I185-L260 HydrophobicContact CG1-CB 4.48Å; I185-L260 HydrophobicContact CG1-CD1 4.33Å
186	N	86.3	Confident	85.6	Confident	150 Å²	150	71.4 Å²	71.4	80%	0.802	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	31.8	-178.6	-57.7	-31.3	0	0	0	114.1	R188	N186-R188 VanDerWaalsContact C-N 3.32Å
187	G	84.9	Confident	86.7	Confident	69 Å²	69	71.9 Å²	71.9	71%	0.711	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	4.3	-178.8	0	0	0	0	0	114.9	N184 I185	N184-G187 WeakPolarHBondContact OD1-CA 3.29Å; N184-G187 PolarHBondContact OD1-N 3.22Å; I185-G187 PolarHBondContact O-N 2.9Å; I185-G187 VanDerWaalsContact O-N 3.13Å
188	R	89.4	Confident	87.8	Confident	177 Å²	177	71.4 Å²	71.4	67%	0.668	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.7	173.6	-64.4	-178.6	179.2	-172.1	-1.1	109.6	N184 I185 N186 Y190	N184-R188 WeakPolarHBondContact CA-O 3.33Å; I185-R188 PolarHBondContact N-O 3.3Å; I185-R188 PolarHBondContact O-N 2.88Å; N186-R188 VanDerWaalsContact C-N 3.32Å; R188-Y190 HydrophobicContact CB-CD2 4.4Å; R188-Y190 HydrophobicContact CB-CE2 3.71Å; R188-Y190 WeakPolarHBondContact O-CD2 2.98Å
189	Q	91.1	Very high	88.9	Confident	138 Å²	138	71 Å²	71	65%	0.645	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	120.2	173.6	-172.4	170.5	62	0	0	109.8	K182 L183	K182-Q189 HydrophobicContact CB-CG 4.11Å; L183-Q189 WeakPolarHBondContact O-CA 3.31Å
190	Y	90.6	Very high	90	Very high	53 Å²	53	70 Å²	70	21%	0.208	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	130.6	174.5	-66	-95	0	0	0	109.1	K182 L183 I185 R188 T192 H216 S218	K182-Y190 CarbonylContact C-O 3.56Å; K182-Y190 VanDerWaalsContact CA-O 3.29Å; K182-Y190 WeakPolarHBondContact CA-O 3.4Å; L183-Y190 PolarHBondContact N-O 3.48Å; L183-Y190 PolarHBondContact O-N 3.39Å; I185-Y190 HydrophobicContact CB-CD2 4.13Å; I185-Y190 HydrophobicContact CB-CE2 4.03Å; R188-Y190 HydrophobicContact CB-CD2 4.4Å; R188-Y190 HydrophobicContact CB-CE2 3.71Å; R188-Y190 WeakPolarHBondContact O-CD2 2.98Å; Y190-T192 PolarHBondContact O-OG1 3.32Å; Y190-H216 AromaticContact CG-CE1 3.8Å; Y190-S218 WeakPolarHBondContact CE1-O 3.3Å
191	P	91.4	Very high	90.5	Very high	109 Å²	109	69.4 Å²	69.4	71%	0.708	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.1	135.5	155.6	31	-31.5	0	0	0	108.3	G181	G181-P191 WeakPolarHBondContact O-CA 3.27Å
192	T	91.1	Very high	91	Very high	11 Å²	11	72.8 Å²	72.8	7%	0.067	38%	0.384	C	S	.	.			trans	-148.9	134.2	-169.3	-56.7	0	0	0	0	109.6	G181 L183 Y190 D196 L197 H216 F263	G181-T192 CarbonylContact C-O 2.83Å; G181-T192 VanDerWaalsContact CA-O 3.29Å; G181-T192 WeakPolarHBondContact CA-O 3.41Å; G181-T192 PolarHBondContact O-N 3.1Å; L183-T192 HydrophobicContact CD1-CG2 3.85Å; L183-T192 HydrophobicContact CG-CG2 4.14Å; Y190-T192 PolarHBondContact O-OG1 3.32Å; T192-D196 HydrophobicContact CG2-CB 4.09Å; T192-L197 HydrophobicContact CG2-CD2 4.3Å; T192-H216 VanDerWaalsContact CG2-CD2 3.45Å; T192-H216 WeakPolarHBondContact CG2-CD2 3.26Å; T192-H216 WeakPolarHBondContact CG2-NE2 3.48Å; T192-H216 PolarHBondContact OG1-NE2 2.89Å; T192-F263 HydrophobicContact CG2-CE1 4.15Å; T192-F263 HydrophobicContact CG2-CZ 3.69Å; T192-F263 VanDerWaalsContact O-CE1 3.28Å; T192-F263 WeakPolarHBondContact O-CE1 3.49Å
193	D	90.4	Very high	90.8	Very high	58 Å²	58	71.4 Å²	71.4	31%	0.31	38%	0.381	S	S	.	.			trans	-98.1	164.1	161.5	-159.6	-78.5	0	0	0	110.7	N195 D196 R265	D193-N195 HydrophobicContact CB-CB 4.35Å; D193-N195 PolarHBondContact O-N 3.36Å; D193-N195 PolarHBondContact OD1-N 3.45Å; D193-D196 PolarHBondContact N-OD2 3Å; D193-D196 WeakPolarHBondContact O-CB 3.41Å; D193-D196 PolarHBondContact O-N 2.71Å; D193-R265 IonicContact OD1-CZ 2.83Å; D193-R265 IonicContact OD1-NH1 3.06Å; D193-R265 PolarHBondContact OD1-NH1 3.02Å; D193-R265 IonicContact OD1-NH2 3.47Å; D193-R265 PolarHBondContact OD1-NH2 2.71Å; D193-R265 IonicContact OD2-CZ 2.83Å; D193-R265 IonicContact OD2-NH2 3.45Å; D193-R265 PolarHBondContact OD2-NH2 2.85Å
194	I	88.8	Confident	90.2	Very high	19 Å²	19	72.6 Å²	72.6	10%	0.097	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-58.5	-30.2	168	-60.3	-175.2	0	0	0	110.8	D196 L197 F263 R265 W270	I194-D196 PolarHBondContact O-N 2.82Å; I194-L197 WeakPolarHBondContact O-CB 3.4Å; I194-L197 PolarHBondContact O-N 2.79Å; I194-F263 HydrophobicContact CD1-CB 3.96Å; I194-F263 HydrophobicContact CD1-CG 4.34Å; I194-F263 HydrophobicContact CG1-CB 3.98Å; I194-F263 HydrophobicContact CG1-CD1 4.37Å; I194-F263 HydrophobicContact CG1-CD2 3.95Å; I194-F263 HydrophobicContact CG1-CG 3.81Å; I194-R265 HydrophobicContact CD1-CG 4.29Å; I194-W270 HydrophobicContact CD1-CD2 3.92Å; I194-W270 HydrophobicContact CD1-CE3 4.26Å; I194-W270 HydrophobicContact CD1-CG 4.12Å; I194-W270 HydrophobicContact CG1-CE3 4.43Å; I194-W270 HydrophobicContact CG2-CD2 4.38Å; I194-W270 HydrophobicContact CG2-CE3 3.84Å; I194-W270 HydrophobicContact CG2-CH2 3.53Å; I194-W270 HydrophobicContact CG2-CZ2 4.09Å; I194-W270 HydrophobicContact CG2-CZ3 3.39Å
195	N	90.6	Very high	89.3	Confident	134 Å²	134	74.3 Å²	74.3	72%	0.717	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-61.8	-23.5	174.6	-65.2	-18.3	0	0	0	113.5	D193 L197	D193-N195 HydrophobicContact CB-CB 4.35Å; D193-N195 PolarHBondContact O-N 3.36Å; D193-N195 PolarHBondContact OD1-N 3.45Å; N195-L197 PolarHBondContact O-N 2.9Å
196	D	92.9	Very high	88	Confident	49 Å²	49	76.5 Å²	76.5	26%	0.262	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-82.5	4.8	176.4	-55.8	-44.9	0	0	0	112.8	T192 D193 I194 H216 L217	T192-D196 HydrophobicContact CG2-CB 4.09Å; D193-D196 PolarHBondContact N-OD2 3Å; D193-D196 WeakPolarHBondContact O-CB 3.41Å; D193-D196 PolarHBondContact O-N 2.71Å; I194-D196 PolarHBondContact O-N 2.82Å; D196-H216 WeakPolarHBondContact O-CA 3.42Å; D196-L217 WeakPolarHBondContact O-CG 3.33Å; D196-L217 PolarHBondContact O-N 3.31Å
197	L	94.6	Very high	86.6	Confident	12 Å²	12	73.8 Å²	73.8	6%	0.063	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	93.7	-178.3	-57.3	-175.2	0	0	0	112	L183 T192 I194 N195 H199 M214 H216 I223 V225 F263	L183-L197 HydrophobicContact CD1-CD2 4.4Å; T192-L197 HydrophobicContact CG2-CD2 4.3Å; I194-L197 WeakPolarHBondContact O-CB 3.4Å; I194-L197 PolarHBondContact O-N 2.79Å; N195-L197 PolarHBondContact O-N 2.9Å; L197-H199 PolarHBondContact O-N 3.05Å; L197-M214 HydrophobicContact CB-CB 4.32Å; L197-M214 HydrophobicContact CB-CG 4.36Å; L197-M214 HydrophobicContact CB-SD 3.9Å; L197-M214 HydrophobicContact CD1-SD 4.22Å; L197-H216 HydrophobicContact CD2-CB 3.75Å; L197-I223 HydrophobicContact CD2-CD1 3.96Å; L197-V225 HydrophobicContact CD1-CG2 4.38Å; L197-F263 HydrophobicContact CD1-CD2 4.49Å; L197-F263 HydrophobicContact CD1-CE2 3.73Å; L197-F263 HydrophobicContact CD1-CZ 4.37Å
198	K	95.8	Very high	85.5	Confident	90 Å²	90	72.2 Å²	72.2	39%	0.391	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	114.7	176.4	-175.6	167.5	-177.6	166	0	110.5	M214 M215 L217 A692	K198-M214 CarbonylContact O-C 3.56Å; K198-M214 VanDerWaalsContact O-CA 3.32Å; K198-M214 WeakPolarHBondContact O-CA 3.34Å; K198-M215 HydrophobicContact CB-CB 4.42Å; K198-M215 PolarHBondContact N-O 3.24Å; K198-M215 PolarHBondContact O-N 2.67Å; K198-L217 HydrophobicContact CB-CD2 4.09Å; K198-L217 HydrophobicContact CD-CD2 4.43Å; K198-A692 PolarHBondContact NZ-O 2.83Å
199	H	95.8	Very high	84.7	Confident	92 Å²	92	64.8 Å²	64.8	43%	0.426	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	138.2	173.7	-178.7	-83.3	0	0	0	111.2	L197 G201 D202 M214	L197-H199 PolarHBondContact O-N 3.05Å; H199-G201 WeakPolarHBondContact CE1-CA 3.39Å; H199-G201 PolarHBondContact CE1-N 3.38Å; H199-G201 PolarHBondContact ND1-N 3.42Å; H199-G201 VanDerWaalsContact ND1-N 3.13Å; H199-D202 IonicContact CE1-OD1 3.76Å; H199-D202 PolarHBondContact CE1-OD1 2.97Å; H199-D202 IonicContact NE2-OD1 3.5Å; H199-D202 PolarHBondContact NE2-OD1 3.14Å; H199-M214 HydrophobicContact CB-CE 4.07Å; H199-M214 HydrophobicContact CB-CG 4.45Å
200	L	95.1	Very high	84.3	Confident	73 Å²	73	60 Å²	60	38%	0.382	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	2.8	-178.7	-59.6	-173.7	0	0	0	113.5	K213 M215 I222	L200-K213 HydrophobicContact CB-CB 4.3Å; L200-K213 HydrophobicContact CB-CD 4.27Å; L200-K213 HydrophobicContact CB-CG 4.16Å; L200-K213 HydrophobicContact CD1-CD 4.48Å; L200-K213 HydrophobicContact CD1-CG 4.34Å; L200-K213 PolarHBondContact N-O 3.26Å; L200-M215 HydrophobicContact CD1-CB 4.07Å; L200-M215 HydrophobicContact CD2-CB 4.28Å; L200-M215 HydrophobicContact CG-CB 4.23Å; L200-I222 HydrophobicContact CD1-CD1 4.01Å; L200-I222 HydrophobicContact CD1-CG1 4.23Å; L200-I222 HydrophobicContact CD1-CG2 3.87Å
201	G	92.6	Very high	84.2	Confident	25 Å²	25	59 Å²	59	26%	0.258	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	127.1	156.4	-174.2	0	0	0	0	0	113.7	H199 K213	H199-G201 WeakPolarHBondContact CE1-CA 3.39Å; H199-G201 PolarHBondContact CE1-N 3.38Å; H199-G201 PolarHBondContact ND1-N 3.42Å; H199-G201 VanDerWaalsContact ND1-N 3.13Å; G201-K213 VanDerWaalsContact O-CB 3.3Å; G201-K213 WeakPolarHBondContact O-CB 3.32Å; G201-K213 PolarHBondContact O-N 3.27Å
202	D	90.2	Very high	84.3	Confident	96 Å²	96	53.9 Å²	53.9	51%	0.513	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	138.2	-178.7	-56.2	-28.8	0	0	0	111.3	H199 V212	H199-D202 IonicContact CE1-OD1 3.76Å; H199-D202 PolarHBondContact CE1-OD1 2.97Å; H199-D202 IonicContact NE2-OD1 3.5Å; H199-D202 PolarHBondContact NE2-OD1 3.14Å; D202-V212 WeakPolarHBondContact OD1-CG1 3.31Å
203	L	85.4	Confident	84.5	Confident	55 Å²	55	56.8 Å²	56.8	29%	0.288	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-34.4	175	-63.9	171.1	0	0	0	111.4	V211 K213 A224 L275 K282	L203-V211 CarbonylContact C-O 3.43Å; L203-V211 WeakPolarHBondContact CA-O 3.4Å; L203-V211 HydrophobicContact CB-CB 4.47Å; L203-V211 HydrophobicContact CB-CG1 4.26Å; L203-V211 WeakPolarHBondContact CB-O 3.36Å; L203-V211 HydrophobicContact CD1-CG1 4.24Å; L203-V211 PolarHBondContact N-O 3.18Å; L203-K213 HydrophobicContact CD1-CB 4.06Å; L203-K213 HydrophobicContact CD2-CB 3.98Å; L203-K213 HydrophobicContact CD2-CD 4.42Å; L203-K213 HydrophobicContact CD2-CG 4.48Å; L203-K213 HydrophobicContact CG-CB 3.87Å; L203-A224 HydrophobicContact CD1-CB 3.86Å; L203-L275 HydrophobicContact CD1-CD1 3.65Å; L203-L275 HydrophobicContact CD2-CD1 4.35Å; L203-K282 PolarHBondContact O-NZ 3.19Å
204	G	77.4	Confident	84.7	Confident	25 Å²	25	54.4 Å²	54.4	26%	0.258	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	172.4	147.5	172.6	0	0	0	0	0	114.6	V211	G204-V211 PolarHBondContact N-O 3.22Å; G204-V211 PolarHBondContact O-N 2.91Å
205	N	70.9	Confident	85.1	Confident	122 Å²	122	55.7 Å²	55.7	65%	0.652	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	134	175.3	-70.5	-53	0	0	0	110.1	N210	N205-N210 VanDerWaalsContact OD1-CB 3.27Å; N205-N210 WeakPolarHBondContact OD1-CB 3.48Å; N205-N210 PolarHBondContact OD1-OD1 2.97Å; N205-N210 VanDerWaalsContact OD1-OD1 3.08Å
206	G	63.4	Low	85.4	Confident	50 Å²	50	49.3 Å²	49.3	52%	0.515	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	178.9	178.2	0	0	0	0	0	112.6	S208 G209	G206-S208 PolarHBondContact O-N 3.02Å; G206-G209 PolarHBondContact N-O 2.89Å; G206-G209 PolarHBondContact O-N 2.94Å
207	T	56.1	Low	85.4	Confident	92 Å²	92	51 Å²	51	56%	0.564	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-21	178.5	42	0	0	0	0	113.9	S354	T207-S354 WeakPolarHBondContact CG2-OG 3.41Å
208	S	61.4	Low	85.3	Confident	37 Å²	37	53.5 Å²	53.5	26%	0.259	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.3	179.6	62.7	0	0	0	0	114.1	G206 K226 M228 D338	G206-S208 PolarHBondContact O-N 3.02Å; S208-K226 WeakPolarHBondContact O-CE 3.37Å; S208-K226 PolarHBondContact OG-NZ 2.72Å; S208-M228 WeakPolarHBondContact O-CG 3.44Å; S208-D338 PolarHBondContact OG-OD2 3.16Å
209	G	72.9	Confident	85.2	Confident	21 Å²	21	50.3 Å²	50.3	22%	0.216	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.7	-173.9	176.9	0	0	0	0	0	115.1	G206 Q227	G206-G209 PolarHBondContact N-O 2.89Å; G206-G209 PolarHBondContact O-N 2.94Å; G209-Q227 VanDerWaalsContact CA-O 3.3Å; G209-Q227 WeakPolarHBondContact CA-O 3.47Å
210	N	84	Confident	85.2	Confident	36 Å²	36	51.7 Å²	51.7	19%	0.193	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.1	166.1	-175.9	2.1	0	0	0	108.9	N205 V212 K226 Q227	N205-N210 VanDerWaalsContact OD1-CB 3.27Å; N205-N210 WeakPolarHBondContact OD1-CB 3.48Å; N205-N210 PolarHBondContact OD1-OD1 2.97Å; N205-N210 VanDerWaalsContact OD1-OD1 3.08Å; N210-V212 WeakPolarHBondContact ND2-CG1 3.49Å; N210-V212 WeakPolarHBondContact OD1-CG1 3.47Å; N210-K226 WeakPolarHBondContact O-CA 3.38Å; N210-Q227 PolarHBondContact N-O 2.87Å; N210-Q227 PolarHBondContact O-N 3.14Å
211	V	88.4	Confident	85.2	Confident	33 Å²	33	49.8 Å²	49.8	20%	0.2	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	119.7	169.2	-171.1	0	0	0	0	108.4	L203 G204 A224 V225 K226	L203-V211 CarbonylContact C-O 3.43Å; L203-V211 WeakPolarHBondContact CA-O 3.4Å; L203-V211 HydrophobicContact CB-CB 4.47Å; L203-V211 HydrophobicContact CB-CG1 4.26Å; L203-V211 WeakPolarHBondContact CB-O 3.36Å; L203-V211 HydrophobicContact CD1-CG1 4.24Å; L203-V211 PolarHBondContact N-O 3.18Å; G204-V211 PolarHBondContact N-O 3.22Å; G204-V211 PolarHBondContact O-N 2.91Å; V211-A224 HydrophobicContact CG1-CB 4.4Å; V211-V225 CarbonylContact C-O 3.58Å; V211-V225 WeakPolarHBondContact CA-O 3.37Å; V211-K226 HydrophobicContact CG2-CB 4.13Å; V211-K226 HydrophobicContact CG2-CD 4.24Å; V211-K226 HydrophobicContact CG2-CG 4.02Å
212	V	92.4	Very high	85.3	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	153.2	-177	-60	0	0	0	0	111.7	D202 N210 M214 V225	D202-V212 WeakPolarHBondContact OD1-CG1 3.31Å; N210-V212 WeakPolarHBondContact ND2-CG1 3.49Å; N210-V212 WeakPolarHBondContact OD1-CG1 3.47Å; V212-M214 HydrophobicContact CG2-CE 3.66Å; V212-M214 HydrophobicContact CG2-CG 4.13Å; V212-M214 HydrophobicContact CG2-SD 3.77Å; V212-V225 HydrophobicContact CG2-CB 4.04Å; V212-V225 PolarHBondContact N-O 2.99Å; V212-V225 PolarHBondContact O-N 3.11Å
213	K	95	Very high	85.5	Confident	72 Å²	72	47.2 Å²	47.2	31%	0.313	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	126.6	172.5	-168.4	179	177.4	177.8	0	108.2	L200 G201 L203 I222 L275	L200-K213 HydrophobicContact CB-CB 4.3Å; L200-K213 HydrophobicContact CB-CD 4.27Å; L200-K213 HydrophobicContact CB-CG 4.16Å; L200-K213 HydrophobicContact CD1-CD 4.48Å; L200-K213 HydrophobicContact CD1-CG 4.34Å; L200-K213 PolarHBondContact N-O 3.26Å; G201-K213 VanDerWaalsContact O-CB 3.3Å; G201-K213 WeakPolarHBondContact O-CB 3.32Å; G201-K213 PolarHBondContact O-N 3.27Å; L203-K213 HydrophobicContact CD1-CB 4.06Å; L203-K213 HydrophobicContact CD2-CB 3.98Å; L203-K213 HydrophobicContact CD2-CD 4.42Å; L203-K213 HydrophobicContact CD2-CG 4.48Å; L203-K213 HydrophobicContact CG-CB 3.87Å; K213-I222 HydrophobicContact CD-CG2 4.27Å; K213-I222 HydrophobicContact CG-CG2 3.71Å; K213-L275 HydrophobicContact CD-CD2 4.5Å; K213-L275 HydrophobicContact CG-CD1 4.5Å; K213-L275 HydrophobicContact CG-CD2 4.42Å
214	M	95.9	Very high	86	Confident	9 Å²	9	45 Å²	45	4%	0.044	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.5	179.7	-80.9	168.4	167.3	0	0	111.4	L197 K198 H199 V212 I222 I223 V225 W270	L197-M214 HydrophobicContact CB-CB 4.32Å; L197-M214 HydrophobicContact CB-CG 4.36Å; L197-M214 HydrophobicContact CB-SD 3.9Å; L197-M214 HydrophobicContact CD1-SD 4.22Å; K198-M214 CarbonylContact O-C 3.56Å; K198-M214 VanDerWaalsContact O-CA 3.32Å; K198-M214 WeakPolarHBondContact O-CA 3.34Å; H199-M214 HydrophobicContact CB-CE 4.07Å; H199-M214 HydrophobicContact CB-CG 4.45Å; V212-M214 HydrophobicContact CG2-CE 3.66Å; V212-M214 HydrophobicContact CG2-CG 4.13Å; V212-M214 HydrophobicContact CG2-SD 3.77Å; M214-I222 CarbonylContact O-C 3.18Å; M214-I222 WeakPolarHBondContact O-CA 3.48Å; M214-I222 WeakPolarHBondContact O-CG2 3.22Å; M214-I223 HydrophobicContact CB-CG1 4.2Å; M214-I223 PolarHBondContact N-O 3.02Å; M214-I223 WeakPolarHBondContact O-CG1 3.49Å; M214-I223 PolarHBondContact O-N 3.2Å; M214-V225 HydrophobicContact CB-CG2 3.95Å; M214-V225 HydrophobicContact CG-CG2 4.26Å; M214-V225 HydrophobicContact SD-CB 3.79Å; M214-V225 HydrophobicContact SD-CG1 4.15Å; M214-V225 HydrophobicContact SD-CG2 3.64Å; M214-W270 HydrophobicContact CE-CH2 4.06Å; M214-W270 HydrophobicContact CE-CZ3 3.55Å; M214-W270 HydrophobicContact SD-CE3 4.44Å; M214-W270 HydrophobicContact SD-CZ3 3.91Å
215	M	96.5	Very high	86.7	Confident	45 Å²	45	43.8 Å²	43.8	22%	0.222	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115.6	168.1	173.2	176.9	-80.7	0	0	108.3	K198 L200 L217 I222	K198-M215 HydrophobicContact CB-CB 4.42Å; K198-M215 PolarHBondContact N-O 3.24Å; K198-M215 PolarHBondContact O-N 2.67Å; L200-M215 HydrophobicContact CD1-CB 4.07Å; L200-M215 HydrophobicContact CD2-CB 4.28Å; L200-M215 HydrophobicContact CG-CB 4.23Å; M215-L217 HydrophobicContact CG-CD2 4.34Å; M215-L217 PolarHBondContact O-N 3.45Å; M215-L217 HydrophobicContact SD-CD2 4.38Å; M215-I222 HydrophobicContact CE-CG1 4.33Å
216	H	96.1	Very high	87.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	110	168.2	173.7	-122.7	0	0	0	108.6	I185 Y190 T192 D196 L197 S218 S219 N220 T221	I185-H216 HydrophobicContact CD1-CB 4.3Å; I185-H216 WeakPolarHBondContact CD1-ND1 3.37Å; Y190-H216 AromaticContact CG-CE1 3.8Å; T192-H216 VanDerWaalsContact CG2-CD2 3.45Å; T192-H216 WeakPolarHBondContact CG2-CD2 3.26Å; T192-H216 WeakPolarHBondContact CG2-NE2 3.48Å; T192-H216 PolarHBondContact OG1-NE2 2.89Å; D196-H216 WeakPolarHBondContact O-CA 3.42Å; L197-H216 HydrophobicContact CD2-CB 3.75Å; H216-S218 PolarHBondContact O-N 3.23Å; H216-S219 WeakPolarHBondContact ND1-CB 3.34Å; H216-S219 PolarHBondContact ND1-OG 3.01Å; H216-S219 PolarHBondContact O-N 3.12Å; H216-N220 WeakPolarHBondContact O-CA 3.11Å; H216-N220 PolarHBondContact O-N 3.08Å; H216-T221 PolarHBondContact N-O 2.71Å; H216-T221 PolarHBondContact O-N 3.26Å
217	L	94.5	Very high	88.5	Confident	85 Å²	85	38.1 Å²	38.1	45%	0.445	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-61.6	-47.1	-169.6	-64	175.6	0	0	0	111.5	D196 K198 M215 S219 N220	D196-L217 WeakPolarHBondContact O-CG 3.33Å; D196-L217 PolarHBondContact O-N 3.31Å; K198-L217 HydrophobicContact CB-CD2 4.09Å; K198-L217 HydrophobicContact CD-CD2 4.43Å; M215-L217 HydrophobicContact CG-CD2 4.34Å; M215-L217 PolarHBondContact O-N 3.45Å; M215-L217 HydrophobicContact SD-CD2 4.38Å; L217-S219 PolarHBondContact O-N 2.77Å; L217-S219 VanDerWaalsContact O-N 3.09Å; L217-N220 PolarHBondContact O-N 3.15Å
218	S	92.4	Very high	89.6	Confident	65 Å²	65	34.5 Å²	34.5	46%	0.455	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-65.9	-13.7	-174.9	-44.8	0	0	0	0	114.8	Y190 H216	Y190-S218 WeakPolarHBondContact CE1-O 3.3Å; H216-S218 PolarHBondContact O-N 3.23Å
219	S	93.8	Very high	90.3	Very high	22 Å²	22	41.7 Å²	41.7	15%	0.154	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-122.8	5.7	172	77.8	0	0	0	0	113.8	I185 H216 L217 T221	I185-S219 WeakPolarHBondContact CD1-OG 3.41Å; H216-S219 WeakPolarHBondContact ND1-CB 3.34Å; H216-S219 PolarHBondContact ND1-OG 3.01Å; H216-S219 PolarHBondContact O-N 3.12Å; L217-S219 PolarHBondContact O-N 2.77Å; L217-S219 VanDerWaalsContact O-N 3.09Å; S219-T221 PolarHBondContact O-N 2.83Å; S219-T221 PolarHBondContact O-OG1 3.15Å; S219-T221 WeakPolarHBondContact OG-CB 3.45Å; S219-T221 PolarHBondContact OG-OG1 2.95Å
220	N	94.1	Very high	90.3	Very high	121 Å²	121	43.3 Å²	43.3	65%	0.647	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	42.3	32.2	-169.9	-164.2	23.4	0	0	0	113.9	H216 L217	H216-N220 WeakPolarHBondContact O-CA 3.11Å; H216-N220 PolarHBondContact O-N 3.08Å; L217-N220 PolarHBondContact O-N 3.15Å
221	T	94.9	Very high	89.5	Confident	34 Å²	34	44.3 Å²	44.3	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.8	-172.2	-52.9	0	0	0	0	109.9	I185 H216 S219 I223	I185-T221 HydrophobicContact CG2-CG2 3.87Å; H216-T221 PolarHBondContact N-O 2.71Å; H216-T221 PolarHBondContact O-N 3.26Å; S219-T221 PolarHBondContact O-N 2.83Å; S219-T221 PolarHBondContact O-OG1 3.15Å; S219-T221 WeakPolarHBondContact OG-CB 3.45Å; S219-T221 PolarHBondContact OG-OG1 2.95Å; T221-I223 HydrophobicContact CG2-CG2 4.29Å
222	I	95.8	Very high	88.3	Confident	66 Å²	66	47.2 Å²	47.2	34%	0.338	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	127.4	175.6	-48.6	-179	0	0	0	109.6	L200 K213 M214 M215 L275	L200-I222 HydrophobicContact CD1-CD1 4.01Å; L200-I222 HydrophobicContact CD1-CG1 4.23Å; L200-I222 HydrophobicContact CD1-CG2 3.87Å; K213-I222 HydrophobicContact CD-CG2 4.27Å; K213-I222 HydrophobicContact CG-CG2 3.71Å; M214-I222 CarbonylContact O-C 3.18Å; M214-I222 WeakPolarHBondContact O-CA 3.48Å; M214-I222 WeakPolarHBondContact O-CG2 3.22Å; M215-I222 HydrophobicContact CE-CG1 4.33Å; I222-L275 HydrophobicContact CB-CD2 4.35Å; I222-L275 HydrophobicContact CG2-CD2 3.78Å
223	I	95.2	Very high	87.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	162.1	-174.6	63.4	169.1	0	0	0	110.6	L183 L197 M214 T221 V225 L260 C272	L183-I223 HydrophobicContact CD1-CD1 4.32Å; L197-I223 HydrophobicContact CD2-CD1 3.96Å; M214-I223 HydrophobicContact CB-CG1 4.2Å; M214-I223 PolarHBondContact N-O 3.02Å; M214-I223 WeakPolarHBondContact O-CG1 3.49Å; M214-I223 PolarHBondContact O-N 3.2Å; T221-I223 HydrophobicContact CG2-CG2 4.29Å; I223-V225 HydrophobicContact CD1-CG2 3.61Å; I223-V225 HydrophobicContact CG1-CG2 3.86Å; I223-L260 HydrophobicContact CB-CD1 4.01Å; I223-L260 HydrophobicContact CG2-CD1 3.39Å; I223-C272 HydrophobicContact CD1-CB 4.05Å
224	A	94.2	Very high	86	Confident	8 Å²	8	49.8 Å²	49.8	7%	0.066	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.4	164.1	0	0	0	0	0	108.9	L203 V211 M273 L275	L203-A224 HydrophobicContact CD1-CB 3.86Å; V211-A224 HydrophobicContact CG1-CB 4.4Å; A224-M273 HydrophobicContact CB-CB 4.43Å; A224-M273 PolarHBondContact N-O 3.37Å; A224-M273 PolarHBondContact O-N 3.33Å; A224-L275 HydrophobicContact CB-CD1 4.18Å
225	V	91.8	Very high	84.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.8	178.3	-176.6	0	0	0	0	109.2	L197 V211 V212 M214 I223 W270 I271	L197-V225 HydrophobicContact CD1-CG2 4.38Å; V211-V225 CarbonylContact C-O 3.58Å; V211-V225 WeakPolarHBondContact CA-O 3.37Å; V212-V225 HydrophobicContact CG2-CB 4.04Å; V212-V225 PolarHBondContact N-O 2.99Å; V212-V225 PolarHBondContact O-N 3.11Å; M214-V225 HydrophobicContact CB-CG2 3.95Å; M214-V225 HydrophobicContact CG-CG2 4.26Å; M214-V225 HydrophobicContact SD-CB 3.79Å; M214-V225 HydrophobicContact SD-CG1 4.15Å; M214-V225 HydrophobicContact SD-CG2 3.64Å; I223-V225 HydrophobicContact CD1-CG2 3.61Å; I223-V225 HydrophobicContact CG1-CG2 3.86Å; V225-W270 HydrophobicContact CG1-CB 4.21Å; V225-W270 HydrophobicContact CG1-CD2 4.42Å; V225-W270 HydrophobicContact CG1-CE3 3.81Å; V225-I271 WeakPolarHBondContact CA-O 3.46Å
226	K	87.6	Confident	83.3	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.017	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	118.6	176	-179.9	171.6	175.2	177.2	0	110.1	S208 N210 V211 M228 W270 I271 M273 D338	S208-K226 WeakPolarHBondContact O-CE 3.37Å; S208-K226 PolarHBondContact OG-NZ 2.72Å; N210-K226 WeakPolarHBondContact O-CA 3.38Å; V211-K226 HydrophobicContact CG2-CB 4.13Å; V211-K226 HydrophobicContact CG2-CD 4.24Å; V211-K226 HydrophobicContact CG2-CG 4.02Å; K226-M228 HydrophobicContact CD-CG 4.3Å; K226-M228 HydrophobicContact CD-SD 4.33Å; K226-M228 HydrophobicContact CG-CG 3.98Å; K226-W270 WeakPolarHBondContact O-CA 3.48Å; K226-I271 HydrophobicContact CB-CB 4.42Å; K226-I271 PolarHBondContact N-O 2.96Å; K226-I271 PolarHBondContact O-N 3.11Å; K226-M273 HydrophobicContact CB-CE 3.65Å; K226-D338 WeakPolarHBondContact CD-OD1 3.33Å; K226-D338 IonicContact NZ-OD1 2.62Å; K226-D338 PolarHBondContact NZ-OD1 3.12Å; K226-D338 IonicContact NZ-OD2 2.65Å; K226-D338 PolarHBondContact NZ-OD2 3.43Å
227	Q	86.4	Confident	82	Confident	48 Å²	48	54.5 Å²	54.5	22%	0.224	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	112	177.4	-65.3	171.5	-18.6	0	0	108.8	G209 N210 W270	G209-Q227 VanDerWaalsContact CA-O 3.3Å; G209-Q227 WeakPolarHBondContact CA-O 3.47Å; N210-Q227 PolarHBondContact N-O 2.87Å; N210-Q227 PolarHBondContact O-N 3.14Å; Q227-W270 HydrophobicContact CG-CD2 3.96Å; Q227-W270 HydrophobicContact CG-CE3 4.35Å; Q227-W270 HydrophobicContact CG-CG 4.32Å; Q227-W270 HydrophobicContact CG-CZ2 4.28Å; Q227-W270 VanDerWaalsContact NE2-CZ2 3.26Å
228	M	78.6	Confident	80.7	Confident	17 Å²	17	53.2 Å²	53.2	8%	0.084	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.4	177.8	-61.6	-172.2	56.3	0	0	109.3	S208 K226 R230 I240 V269 I271 I341	S208-M228 WeakPolarHBondContact O-CG 3.44Å; K226-M228 HydrophobicContact CD-CG 4.3Å; K226-M228 HydrophobicContact CD-SD 4.33Å; K226-M228 HydrophobicContact CG-CG 3.98Å; M228-R230 PolarHBondContact O-N 3.33Å; M228-I240 HydrophobicContact CE-CG2 4.48Å; M228-V269 HydrophobicContact CB-CB 4.47Å; M228-V269 PolarHBondContact N-O 2.84Å; M228-V269 PolarHBondContact O-N 3.48Å; M228-I271 HydrophobicContact SD-CD1 3.68Å; M228-I341 HydrophobicContact CE-CB 4.29Å; M228-I341 HydrophobicContact CE-CG2 4.17Å; M228-I341 HydrophobicContact SD-CD1 4.38Å; M228-I341 HydrophobicContact SD-CG2 4.45Å
229	R	76.3	Confident	79.4	Confident	188 Å²	188	54.5 Å²	54.5	71%	0.709	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	124.2	178.3	-169.8	168.1	-177.8	173.3	2.9	110.6	T231 P267 D268	R229-T231 PolarHBondContact O-N 3.16Å; R229-P267 CarbonylContact C-O 3.58Å; R229-D268 WeakPolarHBondContact CA-OD1 3.29Å; R229-D268 WeakPolarHBondContact CB-OD1 3.31Å; R229-D268 WeakPolarHBondContact CG-OD1 3.32Å
230	R	72.4	Confident	78.2	Confident	55 Å²	55	54.1 Å²	54.1	21%	0.208	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-60.9	128	165.1	-69.2	-171.6	60	177.9	0.7	109	M228 N237 D266 P267 V269	M228-R230 PolarHBondContact O-N 3.33Å; R230-N237 WeakPolarHBondContact CA-OD1 3.39Å; R230-N237 WeakPolarHBondContact CB-OD1 3.32Å; R230-N237 WeakPolarHBondContact CG-OD1 3.44Å; R230-N237 PolarHBondContact NE-ND2 2.78Å; R230-N237 PolarHBondContact NE-OD1 3.41Å; R230-N237 VanDerWaalsContact NE-OD1 3.14Å; R230-N237 PolarHBondContact NH2-ND2 3.45Å; R230-N237 VanDerWaalsContact NH2-ND2 3.12Å; R230-D266 WeakPolarHBondContact CD-OD1 3.31Å; R230-D266 IonicContact CZ-OD1 3.98Å; R230-D266 IonicContact NE-OD1 3.45Å; R230-D266 PolarHBondContact NE-OD1 3.43Å; R230-D266 IonicContact NH1-OD1 3.23Å; R230-D266 PolarHBondContact NH1-OD1 3.37Å; R230-D266 IonicContact NH1-OD2 2.72Å; R230-D266 PolarHBondContact NH1-OD2 3.18Å; R230-D266 IonicContact NH2-OD1 2.63Å; R230-P267 WeakPolarHBondContact CA-O 3.45Å; R230-P267 WeakPolarHBondContact CB-O 3.42Å; R230-P267 PolarHBondContact N-O 2.98Å; R230-V269 HydrophobicContact CG-CG2 3.83Å
231	T	67	Low	77	Confident	57 Å²	57	48.5 Å²	48.5	35%	0.35	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-73.6	165.2	162.4	59.8	0	0	0	0	108.9	R229 N233 E236 N237	R229-T231 PolarHBondContact O-N 3.16Å; T231-N233 PolarHBondContact O-N 3.2Å; T231-N233 WeakPolarHBondContact OG1-CB 3.34Å; T231-E236 WeakPolarHBondContact CB-OE2 3.34Å; T231-E236 VanDerWaalsContact CG2-OE2 3.28Å; T231-E236 WeakPolarHBondContact CG2-OE2 3.43Å; T231-E236 VanDerWaalsContact OG1-CD 3.3Å; T231-E236 PolarHBondContact OG1-OE2 3.34Å; T231-N237 PolarHBondContact O-ND2 3.42Å
232	G	63.1	Low	75.7	Confident	94 Å²	94	50.4 Å²	50.4	97%	0.969	27%	0.266	S	S	*	.	S	Bend	trans	-67.6	0.5	172.2	0	0	0	0	0	114.3
233	N	70.6	Confident	74.2	Confident	70 Å²	70	49.4 Å²	49.4	37%	0.374	26%	0.261	S	S	.	.			trans	-86.1	116.4	-174.9	-179.7	-32.4	0	0	0	110.3	T231 E235 E236 N237	T231-N233 PolarHBondContact O-N 3.2Å; T231-N233 WeakPolarHBondContact OG1-CB 3.34Å; N233-E235 PolarHBondContact O-N 3.33Å; N233-E235 WeakPolarHBondContact OD1-CB 3.49Å; N233-E235 PolarHBondContact OD1-N 2.87Å; N233-E235 PolarHBondContact OD1-OE2 3.06Å; N233-E236 HydrophobicContact CB-CB 3.89Å; N233-E236 PolarHBondContact O-N 3.42Å; N233-E236 PolarHBondContact OD1-N 3.09Å; N233-N237 PolarHBondContact O-N 2.52Å; N233-N237 VanDerWaalsContact O-N 3.14Å; N233-N237 PolarHBondContact O-ND2 3.04Å
234	A	69.8	Low	73.1	Confident	57 Å²	57	49.4 Å²	49.4	47%	0.471	26%	0.261	S	S	.	.	H	α-helix	trans	-64.1	-41.1	-178.1	0	0	0	0	0	111.9	N237 K238	A234-N237 PolarHBondContact O-N 3.29Å; A234-K238 WeakPolarHBondContact O-CB 3.45Å; A234-K238 PolarHBondContact O-N 2.92Å
235	E	67.8	Low	72.1	Confident	112 Å²	112	49.7 Å²	49.7	52%	0.523	26%	0.262	S	S	.	.	H	α-helix	trans	-68.8	-33.9	-178.4	-67.6	59.7	-134.5	0	0	112.6	N233 R239	N233-E235 PolarHBondContact O-N 3.33Å; N233-E235 WeakPolarHBondContact OD1-CB 3.49Å; N233-E235 PolarHBondContact OD1-N 2.87Å; N233-E235 PolarHBondContact OD1-OE2 3.06Å; E235-R239 WeakPolarHBondContact O-CD 3.23Å; E235-R239 VanDerWaalsContact O-CG 3.23Å; E235-R239 WeakPolarHBondContact O-CG 3.23Å; E235-R239 PolarHBondContact O-N 3.41Å; E235-R239 PolarHBondContact O-NE 3.03Å
236	E	66.1	Low	71.1	Confident	33 Å²	33	50.8 Å²	50.8	15%	0.154	27%	0.268	C	S	.	.	H	α-helix	trans	-70.7	-48.1	174.3	-171.7	176.9	-175.9	0	0	110.9	T231 N233 K238 R239 I240 L345	T231-E236 WeakPolarHBondContact CB-OE2 3.34Å; T231-E236 VanDerWaalsContact CG2-OE2 3.28Å; T231-E236 WeakPolarHBondContact CG2-OE2 3.43Å; T231-E236 VanDerWaalsContact OG1-CD 3.3Å; T231-E236 PolarHBondContact OG1-OE2 3.34Å; N233-E236 HydrophobicContact CB-CB 3.89Å; N233-E236 PolarHBondContact O-N 3.42Å; N233-E236 PolarHBondContact OD1-N 3.09Å; E236-K238 VanDerWaalsContact C-N 3.29Å; E236-K238 PolarHBondContact O-N 3.4Å; E236-R239 WeakPolarHBondContact O-CB 3.47Å; E236-R239 PolarHBondContact O-N 3.47Å; E236-I240 HydrophobicContact CG-CD1 4.28Å; E236-I240 WeakPolarHBondContact O-CG1 3.33Å; E236-I240 PolarHBondContact O-N 3.35Å; E236-L345 WeakPolarHBondContact OE1-CD2 3.27Å; E236-L345 WeakPolarHBondContact OE1-CG 3.48Å
237	N	68.8	Low	70.4	Confident	7 Å²	7	51 Å²	51	4%	0.037	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-42.7	175.1	-69.5	-44.4	0	0	0	112.2	R230 T231 N233 A234 R239 I240 L241	R230-N237 WeakPolarHBondContact CA-OD1 3.39Å; R230-N237 WeakPolarHBondContact CB-OD1 3.32Å; R230-N237 WeakPolarHBondContact CG-OD1 3.44Å; R230-N237 PolarHBondContact NE-ND2 2.78Å; R230-N237 PolarHBondContact NE-OD1 3.41Å; R230-N237 VanDerWaalsContact NE-OD1 3.14Å; R230-N237 PolarHBondContact NH2-ND2 3.45Å; R230-N237 VanDerWaalsContact NH2-ND2 3.12Å; T231-N237 PolarHBondContact O-ND2 3.42Å; N233-N237 PolarHBondContact O-N 2.52Å; N233-N237 VanDerWaalsContact O-N 3.14Å; N233-N237 PolarHBondContact O-ND2 3.04Å; A234-N237 PolarHBondContact O-N 3.29Å; N237-R239 VanDerWaalsContact C-N 3.27Å; N237-R239 PolarHBondContact O-N 3.36Å; N237-I240 PolarHBondContact O-N 3.47Å; N237-L241 WeakPolarHBondContact O-CB 3.29Å; N237-L241 WeakPolarHBondContact O-CD1 3.23Å; N237-L241 VanDerWaalsContact O-CG 3.24Å; N237-L241 WeakPolarHBondContact O-CG 3.46Å; N237-L241 PolarHBondContact O-N 3.02Å
238	K	68.4	Low	69.8	Low	59 Å²	59	50.2 Å²	50.2	26%	0.257	27%	0.267	S	S	.	.	H	α-helix	trans	-61.9	-33.6	176.5	-170.8	161.2	176.5	168.5	0	112.1	S167 T169 D170 A234 E236 M242	S167-K238 PolarHBondContact OG-NZ 3.15Å; S167-K238 VanDerWaalsContact OG-NZ 3.16Å; T169-K238 VanDerWaalsContact CB-CE 3.47Å; T169-K238 WeakPolarHBondContact OG1-CE 3.46Å; T169-K238 PolarHBondContact OG1-NZ 3.22Å; D170-K238 VanDerWaalsContact CG-NZ 3.34Å; D170-K238 WeakPolarHBondContact OD1-CE 3.45Å; D170-K238 IonicContact OD1-NZ 3.26Å; D170-K238 PolarHBondContact OD1-NZ 3.3Å; D170-K238 IonicContact OD2-NZ 3.59Å; D170-K238 PolarHBondContact OD2-NZ 3.08Å; A234-K238 WeakPolarHBondContact O-CB 3.45Å; A234-K238 PolarHBondContact O-N 2.92Å; E236-K238 VanDerWaalsContact C-N 3.29Å; E236-K238 PolarHBondContact O-N 3.4Å; K238-M242 VanDerWaalsContact O-CG 3.3Å; K238-M242 WeakPolarHBondContact O-CG 3.27Å; K238-M242 PolarHBondContact O-N 2.82Å; K238-M242 VanDerWaalsContact O-N 3.12Å
239	R	65.7	Low	69.8	Low	92 Å²	92	54.1 Å²	54.1	35%	0.347	28%	0.284	S	S	.	.	H	α-helix	trans	-71	-48.7	171.4	-68	160.6	-159.5	173.5	10.8	112	E235 E236 N237 L241 M242 D243 R344	E235-R239 WeakPolarHBondContact O-CD 3.23Å; E235-R239 VanDerWaalsContact O-CG 3.23Å; E235-R239 WeakPolarHBondContact O-CG 3.23Å; E235-R239 PolarHBondContact O-N 3.41Å; E235-R239 PolarHBondContact O-NE 3.03Å; E236-R239 WeakPolarHBondContact O-CB 3.47Å; E236-R239 PolarHBondContact O-N 3.47Å; N237-R239 VanDerWaalsContact C-N 3.27Å; N237-R239 PolarHBondContact O-N 3.36Å; R239-L241 PolarHBondContact O-N 3.33Å; R239-L241 VanDerWaalsContact O-N 3.15Å; R239-M242 PolarHBondContact O-N 3.27Å; R239-D243 PolarHBondContact O-N 3.21Å; R239-R344 PolarHBondContact NH1-O 2.69Å
240	I	66.9	Low	70	Confident	13 Å²	13	45.2 Å²	45.2	7%	0.067	25%	0.25	C	S	.	.	H	α-helix	trans	-52	-40.7	177.1	-68.9	166.3	0	0	0	110.7	M228 E236 N237 L244 I341	M228-I240 HydrophobicContact CE-CG2 4.48Å; E236-I240 HydrophobicContact CG-CD1 4.28Å; E236-I240 WeakPolarHBondContact O-CG1 3.33Å; E236-I240 PolarHBondContact O-N 3.35Å; N237-I240 PolarHBondContact O-N 3.47Å; I240-L244 VanDerWaalsContact O-CB 3.28Å; I240-L244 WeakPolarHBondContact O-CB 3.23Å; I240-L244 PolarHBondContact O-N 3.12Å; I240-I341 HydrophobicContact CB-CG2 4.49Å; I240-I341 HydrophobicContact CG2-CG2 4.12Å
241	L	70.3	Confident	70.4	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-77.3	-34.5	-178.6	-64.7	162.6	0	0	0	112.3	L173 I176 N237 R239 L244 D245 V264	L173-L241 HydrophobicContact CD1-CB 4.44Å; L173-L241 HydrophobicContact CD1-CD1 3.43Å; L173-L241 VanDerWaalsContact CD1-CD1 3.43Å; L173-L241 HydrophobicContact CD1-CG 4.42Å; I176-L241 HydrophobicContact CD1-CB 4.15Å; I176-L241 WeakPolarHBondContact CD1-O 3.47Å; I176-L241 HydrophobicContact CG2-CD2 4.19Å; N237-L241 WeakPolarHBondContact O-CB 3.29Å; N237-L241 WeakPolarHBondContact O-CD1 3.23Å; N237-L241 VanDerWaalsContact O-CG 3.24Å; N237-L241 WeakPolarHBondContact O-CG 3.46Å; N237-L241 PolarHBondContact O-N 3.02Å; R239-L241 PolarHBondContact O-N 3.33Å; R239-L241 VanDerWaalsContact O-N 3.15Å; L241-L244 HydrophobicContact CD2-CD2 4.08Å; L241-L244 PolarHBondContact O-N 2.87Å; L241-D245 PolarHBondContact O-N 2.78Å; L241-V264 HydrophobicContact CD2-CG1 4.35Å; L241-V264 HydrophobicContact CD2-CG2 3.57Å
242	M	66.4	Low	71.4	Confident	74 Å²	74	50 Å²	50	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-65.9	-38.2	169.2	-73.9	-179.6	73.4	0	0	113.2	T169 K238 R239 L244 D245	T169-M242 HydrophobicContact CG2-CE 3.59Å; T169-M242 HydrophobicContact CG2-CG 4.33Å; T169-M242 HydrophobicContact CG2-SD 3.36Å; T169-M242 WeakPolarHBondContact CG2-SD 3.33Å; K238-M242 VanDerWaalsContact O-CG 3.3Å; K238-M242 WeakPolarHBondContact O-CG 3.27Å; K238-M242 PolarHBondContact O-N 2.82Å; K238-M242 VanDerWaalsContact O-N 3.12Å; R239-M242 PolarHBondContact O-N 3.27Å; M242-L244 VanDerWaalsContact C-N 3.34Å; M242-D245 WeakPolarHBondContact O-CB 3.43Å; M242-D245 PolarHBondContact O-N 3.16Å
243	D	65.3	Low	72.8	Confident	45 Å²	45	46 Å²	46	24%	0.241	23%	0.231	C	C	.	.	H	α-helix	trans	-71	-33.7	176.5	-66.8	-25.7	0	0	0	110.3	R239 V246 V247 I341	R239-D243 PolarHBondContact O-N 3.21Å; D243-V246 PolarHBondContact O-N 3.01Å; D243-V247 WeakPolarHBondContact O-CG2 3.27Å; D243-V247 PolarHBondContact O-N 2.97Å; D243-I341 HydrophobicContact CB-CB 4.17Å; D243-I341 HydrophobicContact CB-CG2 3.7Å; D243-I341 WeakPolarHBondContact OD2-CA 3.44Å
244	L	71.6	Confident	73.9	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-34.6	172.9	-175.3	59.2	0	0	0	113.4	I176 I240 L241 M242 V246 V247 L248 C262 V269 I271	I176-L244 HydrophobicContact CG2-CD2 4.44Å; I240-L244 VanDerWaalsContact O-CB 3.28Å; I240-L244 WeakPolarHBondContact O-CB 3.23Å; I240-L244 PolarHBondContact O-N 3.12Å; L241-L244 HydrophobicContact CD2-CD2 4.08Å; L241-L244 PolarHBondContact O-N 2.87Å; M242-L244 VanDerWaalsContact C-N 3.34Å; L244-V246 VanDerWaalsContact C-N 3.31Å; L244-V246 PolarHBondContact O-N 3.31Å; L244-V247 HydrophobicContact CD1-CG1 4.49Å; L244-V247 PolarHBondContact O-N 3.47Å; L244-V247 VanDerWaalsContact O-N 3.17Å; L244-L248 HydrophobicContact CG-CD1 4.33Å; L244-L248 WeakPolarHBondContact O-CG 3.41Å; L244-L248 PolarHBondContact O-N 3.35Å; L244-C262 HydrophobicContact CD1-CB 4.35Å; L244-C262 HydrophobicContact CD2-CB 3.92Å; L244-V269 HydrophobicContact CD2-CG1 4.14Å; L244-I271 HydrophobicContact CD1-CD1 3.93Å; L244-I271 HydrophobicContact CD1-CG1 3.9Å; L244-I271 HydrophobicContact CD1-CG2 4.01Å
245	D	74	Confident	75.1	Confident	15 Å²	15	49 Å²	49	8%	0.08	23%	0.229	C	C	.	.	H	α-helix	trans	-56.9	-43.4	172.4	-175	43.3	0	0	0	111.5	I176 L241 M242 L248 K249	I176-D245 HydrophobicContact CD1-CB 4.23Å; L241-D245 PolarHBondContact O-N 2.78Å; M242-D245 WeakPolarHBondContact O-CB 3.43Å; M242-D245 PolarHBondContact O-N 3.16Å; D245-L248 PolarHBondContact O-N 2.88Å; D245-K249 WeakPolarHBondContact O-CB 3.3Å; D245-K249 WeakPolarHBondContact O-CD 3.46Å; D245-K249 VanDerWaalsContact O-CG 3.28Å; D245-K249 WeakPolarHBondContact O-CG 3.39Å; D245-K249 PolarHBondContact O-N 2.95Å; D245-K249 WeakPolarHBondContact OD1-CE 3.08Å; D245-K249 IonicContact OD1-NZ 3.37Å; D245-K249 PolarHBondContact OD1-NZ 2.7Å; D245-K249 IonicContact OD2-NZ 2.73Å; D245-K249 PolarHBondContact OD2-NZ 2.67Å
246	V	70.9	Confident	76.3	Confident	22 Å²	22	43.7 Å²	43.7	13%	0.133	20%	0.204	C	C	.	.	H	α-helix	trans	-65.6	-40.3	175.7	177	0	0	0	0	111.3	D243 L244 L248 K249 S250 L310 H314 V316	D243-V246 PolarHBondContact O-N 3.01Å; L244-V246 VanDerWaalsContact C-N 3.31Å; L244-V246 PolarHBondContact O-N 3.31Å; V246-L248 PolarHBondContact O-N 3.46Å; V246-K249 CarbonylContact O-C 3.59Å; V246-K249 PolarHBondContact O-N 3.13Å; V246-S250 WeakPolarHBondContact O-CB 3.28Å; V246-S250 PolarHBondContact O-N 2.8Å; V246-S250 PolarHBondContact O-OG 2.8Å; V246-L310 HydrophobicContact CG1-CD2 4.5Å; V246-H314 HydrophobicContact CG1-CB 3.65Å; V246-H314 HydrophobicContact CG2-CB 4.36Å; V246-V316 HydrophobicContact CB-CG2 4.44Å; V246-V316 HydrophobicContact CG1-CG2 3.96Å; V246-V316 HydrophobicContact CG2-CG2 3.96Å
247	V	71.1	Confident	77.5	Confident	8 Å²	8	42.4 Å²	42.4	5%	0.048	20%	0.198	C	C	.	.	H	α-helix	trans	-65.1	-36.9	179.1	169.2	0	0	0	0	112	D243 L244 C259 F339 I341	D243-V247 WeakPolarHBondContact O-CG2 3.27Å; D243-V247 PolarHBondContact O-N 2.97Å; L244-V247 HydrophobicContact CD1-CG1 4.49Å; L244-V247 PolarHBondContact O-N 3.47Å; L244-V247 VanDerWaalsContact O-N 3.17Å; V247-C259 HydrophobicContact CG1-CB 3.63Å; V247-C259 WeakPolarHBondContact O-CB 3.43Å; V247-F339 HydrophobicContact CG2-CB 4.13Å; V247-F339 HydrophobicContact CG2-CD2 3.91Å; V247-F339 HydrophobicContact CG2-CG 4.44Å; V247-I341 HydrophobicContact CG2-CD1 4.29Å
248	L	74.9	Confident	78.5	Confident	33 Å²	33	46.4 Å²	46.4	17%	0.173	22%	0.215	C	C	.	.	H	α-helix	trans	-69.6	-35.6	171.6	-69.1	163.7	0	0	0	112.5	L244 D245 V246 H251 C259	L244-L248 HydrophobicContact CG-CD1 4.33Å; L244-L248 WeakPolarHBondContact O-CG 3.41Å; L244-L248 PolarHBondContact O-N 3.35Å; D245-L248 PolarHBondContact O-N 2.88Å; V246-L248 PolarHBondContact O-N 3.46Å; L248-H251 PolarHBondContact O-ND1 2.9Å; L248-C259 HydrophobicContact CD2-CB 4.31Å; L248-C259 VanDerWaalsContact CD2-SG 3.58Å
249	K	79.1	Confident	79.5	Confident	98 Å²	98	44.2 Å²	44.2	43%	0.426	21%	0.207	S	C	.	.	H	α-helix	trans	-81	-10.3	-179.6	-73.4	168.1	176.9	164.7	0	114.9	D245 V246 H251	D245-K249 WeakPolarHBondContact O-CB 3.3Å; D245-K249 WeakPolarHBondContact O-CD 3.46Å; D245-K249 VanDerWaalsContact O-CG 3.28Å; D245-K249 WeakPolarHBondContact O-CG 3.39Å; D245-K249 PolarHBondContact O-N 2.95Å; D245-K249 WeakPolarHBondContact OD1-CE 3.08Å; D245-K249 IonicContact OD1-NZ 3.37Å; D245-K249 PolarHBondContact OD1-NZ 2.7Å; D245-K249 IonicContact OD2-NZ 2.73Å; D245-K249 PolarHBondContact OD2-NZ 2.67Å; V246-K249 CarbonylContact O-C 3.59Å; V246-K249 PolarHBondContact O-N 3.13Å; K249-H251 VanDerWaalsContact C-N 3.31Å; K249-H251 PolarHBondContact O-N 2.93Å
250	S	80.6	Confident	80.7	Confident	1 Å²	1	41 Å²	41	1%	0.007	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	15.7	-176.5	-62.3	0	0	0	0	115.2	V246 D252 C253 Y309 H314	V246-S250 WeakPolarHBondContact O-CB 3.28Å; V246-S250 PolarHBondContact O-N 2.8Å; V246-S250 PolarHBondContact O-OG 2.8Å; S250-D252 VanDerWaalsContact C-N 3.35Å; S250-D252 PolarHBondContact O-N 3.33Å; S250-C253 PolarHBondContact O-N 3.21Å; S250-Y309 WeakPolarHBondContact CA-OH 3.48Å; S250-H314 PolarHBondContact OG-NE2 3.19Å
251	H	80.7	Confident	81.8	Confident	112 Å²	112	40.6 Å²	40.6	52%	0.519	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-15.7	-167.6	59.9	-100.3	0	0	0	115.6	L248 K249 K258	L248-H251 PolarHBondContact O-ND1 2.9Å; K249-H251 VanDerWaalsContact C-N 3.31Å; K249-H251 PolarHBondContact O-N 2.93Å; H251-K258 WeakPolarHBondContact O-CE 3.37Å
252	D	88	Confident	82.7	Confident	100 Å²	100	40.5 Å²	40.5	54%	0.535	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-18.7	174.4	66.3	-46.7	0	0	0	112.8	S250 K254 Y309	S250-D252 VanDerWaalsContact C-N 3.35Å; S250-D252 PolarHBondContact O-N 3.33Å; D252-K254 PolarHBondContact O-N 3.26Å; D252-Y309 WeakPolarHBondContact OD1-CE2 3.28Å; D252-Y309 VanDerWaalsContact OD1-CZ 3.28Å; D252-Y309 PolarHBondContact OD1-OH 2.82Å; D252-Y309 WeakPolarHBondContact OD2-CE2 3.47Å
253	C	91.1	Very high	83.7	Confident	10 Å²	10	37.3 Å²	37.3	7%	0.068	18%	0.18	C	C	.	.			trans	-78.1	108.8	178.1	-174.8	0	0	0	0	112.2	S250 Y255 I256 Y309	S250-C253 PolarHBondContact O-N 3.21Å; C253-Y255 PolarHBondContact O-N 3.48Å; C253-Y255 VanDerWaalsContact O-N 3.1Å; C253-I256 HydrophobicContact CB-CB 3.97Å; C253-I256 HydrophobicContact CB-CD1 3.82Å; C253-I256 HydrophobicContact CB-CG1 4.06Å; C253-I256 PolarHBondContact O-N 3.09Å; C253-I256 VanDerWaalsContact O-N 3.12Å; C253-Y309 HydrophobicContact CB-CD1 3.65Å; C253-Y309 HydrophobicContact CB-CD2 3.68Å; C253-Y309 HydrophobicContact CB-CE1 3.73Å; C253-Y309 HydrophobicContact CB-CE2 3.7Å; C253-Y309 HydrophobicContact CB-CG 3.68Å
254	K	94.1	Very high	84.5	Confident	141 Å²	141	36.3 Å²	36.3	61%	0.613	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.6	179.8	73.6	-173.6	-174	-175.3	0	115.3	D252 K335	D252-K254 PolarHBondContact O-N 3.26Å; K254-K335 WeakPolarHBondContact O-CE 3.45Å
255	Y	95.7	Very high	84.9	Confident	50 Å²	50	41.3 Å²	41.3	20%	0.196	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	7.3	-179.2	-59	-63.8	0	0	0	113.4	C253 A302 N305 K335 L336	C253-Y255 PolarHBondContact O-N 3.48Å; C253-Y255 VanDerWaalsContact O-N 3.1Å; Y255-A302 WeakPolarHBondContact CB-O 3.26Å; Y255-A302 VanDerWaalsContact CD1-CA 3.44Å; Y255-A302 HydrophobicContact CD1-CB 3.44Å; Y255-A302 VanDerWaalsContact CD1-CB 3.44Å; Y255-A302 HydrophobicContact CE1-CB 3.82Å; Y255-A302 HydrophobicContact CG-CB 4.16Å; Y255-N305 HydrophobicContact CD2-CB 3.4Å; Y255-N305 HydrophobicContact CE2-CB 3.44Å; Y255-N305 VanDerWaalsContact CE2-CB 3.44Å; Y255-N305 HydrophobicContact CG-CB 4.38Å; Y255-K335 CarbonylContact O-C 3.43Å; Y255-K335 VanDerWaalsContact O-CA 3.27Å; Y255-K335 WeakPolarHBondContact O-CA 3.5Å; Y255-L336 PolarHBondContact O-N 3.28Å
256	I	92.9	Very high	85	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-112.8	138	178	-79.2	178.9	0	0	0	108.6	C253 K258 A306 Y309 L310 F339	C253-I256 HydrophobicContact CB-CB 3.97Å; C253-I256 HydrophobicContact CB-CD1 3.82Å; C253-I256 HydrophobicContact CB-CG1 4.06Å; C253-I256 PolarHBondContact O-N 3.09Å; C253-I256 VanDerWaalsContact O-N 3.12Å; I256-K258 PolarHBondContact O-N 3.1Å; I256-A306 HydrophobicContact CG1-CB 3.98Å; I256-Y309 HydrophobicContact CD1-CD1 3.51Å; I256-Y309 HydrophobicContact CD1-CE1 3.89Å; I256-Y309 HydrophobicContact CD1-CG 4.48Å; I256-L310 HydrophobicContact CD1-CD1 4.4Å; I256-L310 HydrophobicContact CD1-CD2 3.84Å; I256-L310 HydrophobicContact CD1-CG 3.86Å; I256-F339 HydrophobicContact CB-CZ 3.88Å; I256-F339 HydrophobicContact CD1-CE1 4.11Å; I256-F339 HydrophobicContact CD1-CZ 4.17Å; I256-F339 HydrophobicContact CG1-CE1 3.84Å; I256-F339 HydrophobicContact CG1-CZ 3.63Å; I256-F339 HydrophobicContact CG2-CE1 4.43Å; I256-F339 HydrophobicContact CG2-CE2 3.72Å; I256-F339 HydrophobicContact CG2-CZ 3.48Å; I256-F339 VanDerWaalsContact CG2-CZ 3.48Å
257	V	91.4	Very high	85.4	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.03	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-62.9	117.5	170.5	170.3	0	0	0	0	109.1	C259 M273 E274 M276 L327 K335 L336 C337	V257-C259 PolarHBondContact O-N 3Å; V257-M273 HydrophobicContact CG1-CB 3.87Å; V257-M273 HydrophobicContact CG1-CG 4.24Å; V257-M273 HydrophobicContact CG1-SD 4.16Å; V257-E274 HydrophobicContact CG1-CG 3.98Å; V257-M276 HydrophobicContact CG2-CG 3.99Å; V257-L327 HydrophobicContact CG2-CD1 3.95Å; V257-L327 HydrophobicContact CG2-CG 4.49Å; V257-K335 HydrophobicContact CG2-CB 3.81Å; V257-K335 HydrophobicContact CG2-CD 4.41Å; V257-L336 WeakPolarHBondContact CG2-O 3.4Å; V257-L336 PolarHBondContact N-O 2.77Å; V257-C337 HydrophobicContact CB-CB 4.07Å; V257-C337 HydrophobicContact CG2-CB 3.76Å
258	K	89.8	Confident	86	Confident	91 Å²	91	50.5 Å²	50.5	40%	0.396	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-65.3	121.7	-179.9	-69.1	-179	174.4	-168.8	0	110.8	H251 I256 M273 E274	H251-K258 WeakPolarHBondContact O-CE 3.37Å; I256-K258 PolarHBondContact O-N 3.1Å; K258-M273 WeakPolarHBondContact O-CA 3.37Å; K258-E274 HydrophobicContact CB-CG 4.2Å; K258-E274 WeakPolarHBondContact CB-OE1 3.28Å; K258-E274 WeakPolarHBondContact CG-OE1 3.38Å; K258-E274 PolarHBondContact N-OE1 2.83Å; K258-E274 PolarHBondContact O-N 2.73Å
259	C	89.9	Confident	86.4	Confident	13 Å²	13	49 Å²	49	9%	0.088	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	127.9	160.4	-165.2	0	0	0	0	109.1	V247 L248 V257 C272	V247-C259 HydrophobicContact CG1-CB 3.63Å; V247-C259 WeakPolarHBondContact O-CB 3.43Å; L248-C259 HydrophobicContact CD2-CB 4.31Å; L248-C259 VanDerWaalsContact CD2-SG 3.58Å; V257-C259 PolarHBondContact O-N 3Å; C259-C272 WeakPolarHBondContact CA-O 3.38Å
260	L	90.5	Very high	86.9	Confident	25 Å²	25	46.3 Å²	46.3	13%	0.131	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	-27.9	176	-53.3	174.6	0	0	0	110.3	L183 N184 I185 I223 C272 M273	L183-L260 CarbonylContact C-O 3.59Å; L183-L260 WeakPolarHBondContact CA-O 3.41Å; N184-L260 PolarHBondContact N-O 2.87Å; N184-L260 WeakPolarHBondContact O-CD2 3.12Å; I185-L260 HydrophobicContact CG1-CB 4.48Å; I185-L260 HydrophobicContact CG1-CD1 4.33Å; I223-L260 HydrophobicContact CB-CD1 4.01Å; I223-L260 HydrophobicContact CG2-CD1 3.39Å; L260-C272 HydrophobicContact CB-CB 4.24Å; L260-C272 PolarHBondContact N-O 3.15Å; L260-M273 WeakPolarHBondContact CD1-O 3.28Å
261	G	89.4	Confident	87.3	Confident	4 Å²	4	46.4 Å²	46.4	4%	0.041	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158	-173.8	-179.4	0	0	0	0	0	110.9	C272	G261-C272 WeakPolarHBondContact O-CB 3.38Å; G261-C272 PolarHBondContact O-N 3.49Å
262	C	88.3	Confident	87.8	Confident	2 Å²	2	41 Å²	41	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	160	-179.7	61.6	0	0	0	0	113.2	T180 L244 W270	T180-C262 VanDerWaalsContact CA-O 3.32Å; T180-C262 WeakPolarHBondContact CA-O 3.45Å; L244-C262 HydrophobicContact CD1-CB 4.35Å; L244-C262 HydrophobicContact CD2-CB 3.92Å; C262-W270 CarbonylContact C-O 3.56Å; C262-W270 VanDerWaalsContact CA-O 3.22Å; C262-W270 WeakPolarHBondContact CA-O 3.24Å
263	F	87.8	Confident	88	Confident	8 Å²	8	37.3 Å²	37.3	4%	0.035	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	126.1	165.8	-43.6	-80	0	0	0	108.2	L183 T192 I194 L197 V269 W270 C272	L183-F263 HydrophobicContact CD1-CZ 4.1Å; L183-F263 HydrophobicContact CD2-CE2 4.16Å; L183-F263 HydrophobicContact CD2-CZ 3.77Å; L183-F263 HydrophobicContact CG-CZ 3.91Å; T192-F263 HydrophobicContact CG2-CE1 4.15Å; T192-F263 HydrophobicContact CG2-CZ 3.69Å; T192-F263 VanDerWaalsContact O-CE1 3.28Å; T192-F263 WeakPolarHBondContact O-CE1 3.49Å; I194-F263 HydrophobicContact CD1-CB 3.96Å; I194-F263 HydrophobicContact CD1-CG 4.34Å; I194-F263 HydrophobicContact CG1-CB 3.98Å; I194-F263 HydrophobicContact CG1-CD1 4.37Å; I194-F263 HydrophobicContact CG1-CD2 3.95Å; I194-F263 HydrophobicContact CG1-CG 3.81Å; L197-F263 HydrophobicContact CD1-CD2 4.49Å; L197-F263 HydrophobicContact CD1-CE2 3.73Å; L197-F263 HydrophobicContact CD1-CZ 4.37Å; F263-V269 WeakPolarHBondContact O-CA 3.43Å; F263-W270 HydrophobicContact CB-CB 4.27Å; F263-W270 HydrophobicContact CD2-CB 3.99Å; F263-W270 PolarHBondContact N-O 3.29Å; F263-W270 PolarHBondContact O-N 3.42Å; F263-C272 VanDerWaalsContact CE2-SG 3.53Å
264	V	83.2	Confident	88	Confident	23 Å²	23	38.9 Å²	38.9	14%	0.139	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	106.1	172.5	-179.9	0	0	0	0	106.1	T180 L241 V269	T180-V264 HydrophobicContact CG2-CB 3.92Å; T180-V264 HydrophobicContact CG2-CG2 3.78Å; L241-V264 HydrophobicContact CD2-CG1 4.35Å; L241-V264 HydrophobicContact CD2-CG2 3.57Å; V264-V269 HydrophobicContact CG1-CG2 4.27Å; V264-V269 HydrophobicContact CG2-CG1 4.45Å; V264-V269 HydrophobicContact CG2-CG2 4.39Å
265	R	78.9	Confident	88	Confident	106 Å²	106	34.9 Å²	34.9	40%	0.4	17%	0.171	S	C	.	.			trans	-113.5	160.7	165.5	-66.1	-169.3	175.3	163.5	0	108.1	D193 I194 P267 D268	D193-R265 IonicContact OD1-CZ 2.83Å; D193-R265 IonicContact OD1-NH1 3.06Å; D193-R265 PolarHBondContact OD1-NH1 3.02Å; D193-R265 IonicContact OD1-NH2 3.47Å; D193-R265 PolarHBondContact OD1-NH2 2.71Å; D193-R265 IonicContact OD2-CZ 2.83Å; D193-R265 IonicContact OD2-NH2 3.45Å; D193-R265 PolarHBondContact OD2-NH2 2.85Å; I194-R265 HydrophobicContact CD1-CG 4.29Å; R265-P267 CarbonylContact O-C 3.6Å; R265-D268 PolarHBondContact N-O 2.72Å; R265-D268 VanDerWaalsContact N-O 3.09Å; R265-D268 CarbonylContact O-C 3.56Å; R265-D268 VanDerWaalsContact O-C 3.29Å; R265-D268 PolarHBondContact O-N 3.25Å
266	D	76.8	Confident	88	Confident	122 Å²	122	33.2 Å²	33.2	65%	0.652	17%	0.165	S	C	*	.	S	Bend	trans	-95.6	122.8	166.3	-72.4	-40.2	0	0	0	108	R230	R230-D266 WeakPolarHBondContact CD-OD1 3.31Å; R230-D266 IonicContact CZ-OD1 3.98Å; R230-D266 IonicContact NE-OD1 3.45Å; R230-D266 PolarHBondContact NE-OD1 3.43Å; R230-D266 IonicContact NH1-OD1 3.23Å; R230-D266 PolarHBondContact NH1-OD1 3.37Å; R230-D266 IonicContact NH1-OD2 2.72Å; R230-D266 PolarHBondContact NH1-OD2 3.18Å; R230-D266 IonicContact NH2-OD1 2.63Å
267	P	79.6	Confident	88	Confident	61 Å²	61	35.6 Å²	35.6	40%	0.396	18%	0.182	S	C	.	.	S	Bend	cis	-101.2	15.2	12.4	40.8	-36	0	0	0	115.6	R229 R230 R265	R229-P267 CarbonylContact C-O 3.58Å; R230-P267 WeakPolarHBondContact CA-O 3.45Å; R230-P267 WeakPolarHBondContact CB-O 3.42Å; R230-P267 PolarHBondContact N-O 2.98Å; R265-P267 CarbonylContact O-C 3.6Å
268	D	83.8	Confident	88	Confident	54 Å²	54	36.8 Å²	36.8	29%	0.289	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.3	-169.8	-59.4	-60.5	0	0	0	114.9	R229 R265	R229-D268 WeakPolarHBondContact CA-OD1 3.29Å; R229-D268 WeakPolarHBondContact CB-OD1 3.31Å; R229-D268 WeakPolarHBondContact CG-OD1 3.32Å; R265-D268 PolarHBondContact N-O 2.72Å; R265-D268 VanDerWaalsContact N-O 3.09Å; R265-D268 CarbonylContact O-C 3.56Å; R265-D268 VanDerWaalsContact O-C 3.29Å; R265-D268 PolarHBondContact O-N 3.25Å
269	V	83.9	Confident	88.1	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.3	168	179.2	0	0	0	0	109.7	M228 R230 L244 F263 V264 I271	M228-V269 HydrophobicContact CB-CB 4.47Å; M228-V269 PolarHBondContact N-O 2.84Å; M228-V269 PolarHBondContact O-N 3.48Å; R230-V269 HydrophobicContact CG-CG2 3.83Å; L244-V269 HydrophobicContact CD2-CG1 4.14Å; F263-V269 WeakPolarHBondContact O-CA 3.43Å; V264-V269 HydrophobicContact CG1-CG2 4.27Å; V264-V269 HydrophobicContact CG2-CG1 4.45Å; V264-V269 HydrophobicContact CG2-CG2 4.39Å; V269-I271 HydrophobicContact CG1-CG1 4.13Å
270	W	88.6	Confident	88.3	Confident	42 Å²	42	32.2 Å²	32.2	16%	0.159	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	111.6	-179.4	-69.8	48.1	0	0	0	108.9	I194 M214 V225 K226 Q227 C262 F263	I194-W270 HydrophobicContact CD1-CD2 3.92Å; I194-W270 HydrophobicContact CD1-CE3 4.26Å; I194-W270 HydrophobicContact CD1-CG 4.12Å; I194-W270 HydrophobicContact CG1-CE3 4.43Å; I194-W270 HydrophobicContact CG2-CD2 4.38Å; I194-W270 HydrophobicContact CG2-CE3 3.84Å; I194-W270 HydrophobicContact CG2-CH2 3.53Å; I194-W270 HydrophobicContact CG2-CZ2 4.09Å; I194-W270 HydrophobicContact CG2-CZ3 3.39Å; M214-W270 HydrophobicContact CE-CH2 4.06Å; M214-W270 HydrophobicContact CE-CZ3 3.55Å; M214-W270 HydrophobicContact SD-CE3 4.44Å; M214-W270 HydrophobicContact SD-CZ3 3.91Å; V225-W270 HydrophobicContact CG1-CB 4.21Å; V225-W270 HydrophobicContact CG1-CD2 4.42Å; V225-W270 HydrophobicContact CG1-CE3 3.81Å; K226-W270 WeakPolarHBondContact O-CA 3.48Å; Q227-W270 HydrophobicContact CG-CD2 3.96Å; Q227-W270 HydrophobicContact CG-CE3 4.35Å; Q227-W270 HydrophobicContact CG-CG 4.32Å; Q227-W270 HydrophobicContact CG-CZ2 4.28Å; Q227-W270 VanDerWaalsContact NE2-CZ2 3.26Å; C262-W270 CarbonylContact C-O 3.56Å; C262-W270 VanDerWaalsContact CA-O 3.22Å; C262-W270 WeakPolarHBondContact CA-O 3.24Å; F263-W270 HydrophobicContact CB-CB 4.27Å; F263-W270 HydrophobicContact CD2-CB 3.99Å; F263-W270 PolarHBondContact N-O 3.29Å; F263-W270 PolarHBondContact O-N 3.42Å
271	I	88.2	Confident	88.3	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.015	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.4	-179.5	-50.4	176	0	0	0	108.7	V225 K226 M228 L244 V269 M273 I341	V225-I271 WeakPolarHBondContact CA-O 3.46Å; K226-I271 HydrophobicContact CB-CB 4.42Å; K226-I271 PolarHBondContact N-O 2.96Å; K226-I271 PolarHBondContact O-N 3.11Å; M228-I271 HydrophobicContact SD-CD1 3.68Å; L244-I271 HydrophobicContact CD1-CD1 3.93Å; L244-I271 HydrophobicContact CD1-CG1 3.9Å; L244-I271 HydrophobicContact CD1-CG2 4.01Å; V269-I271 HydrophobicContact CG1-CG1 4.13Å; I271-M273 HydrophobicContact CG2-CG 4.16Å; I271-I341 HydrophobicContact CD1-CD1 3.8Å
272	C	91.6	Very high	88.3	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	131.9	178.4	-69.7	0	0	0	0	110.8	L183 I223 C259 L260 G261 F263	L183-C272 HydrophobicContact CD1-CB 4.41Å; L183-C272 HydrophobicContact CD2-CB 3.73Å; I223-C272 HydrophobicContact CD1-CB 4.05Å; C259-C272 WeakPolarHBondContact CA-O 3.38Å; L260-C272 HydrophobicContact CB-CB 4.24Å; L260-C272 PolarHBondContact N-O 3.15Å; G261-C272 WeakPolarHBondContact O-CB 3.38Å; G261-C272 PolarHBondContact O-N 3.49Å; F263-C272 VanDerWaalsContact CE2-SG 3.53Å
273	M	92	Very high	88.4	Confident	21 Å²	21	36 Å²	36	10%	0.103	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	155.9	-171.8	-64.7	177.9	-69.2	0	0	110.9	A224 K226 V257 K258 L260 I271	A224-M273 HydrophobicContact CB-CB 4.43Å; A224-M273 PolarHBondContact N-O 3.37Å; A224-M273 PolarHBondContact O-N 3.33Å; K226-M273 HydrophobicContact CB-CE 3.65Å; V257-M273 HydrophobicContact CG1-CB 3.87Å; V257-M273 HydrophobicContact CG1-CG 4.24Å; V257-M273 HydrophobicContact CG1-SD 4.16Å; K258-M273 WeakPolarHBondContact O-CA 3.37Å; L260-M273 WeakPolarHBondContact CD1-O 3.28Å; I271-M273 HydrophobicContact CG2-CG 4.16Å
274	E	92.8	Very high	88.6	Confident	43 Å²	43	36.5 Å²	36.5	20%	0.201	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	140.7	168.2	65.4	-178.2	144.1	0	0	111.4	V257 K258 M276 K335	V257-E274 HydrophobicContact CG1-CG 3.98Å; K258-E274 HydrophobicContact CB-CG 4.2Å; K258-E274 WeakPolarHBondContact CB-OE1 3.28Å; K258-E274 WeakPolarHBondContact CG-OE1 3.38Å; K258-E274 PolarHBondContact N-OE1 2.83Å; K258-E274 PolarHBondContact O-N 2.73Å; E274-M276 PolarHBondContact O-N 3.36Å; E274-K335 WeakPolarHBondContact OE1-CD 3.35Å; E274-K335 IonicContact OE1-NZ 2.67Å; E274-K335 PolarHBondContact OE1-NZ 3.2Å; E274-K335 IonicContact OE2-NZ 2.7Å; E274-K335 PolarHBondContact OE2-NZ 3.04Å
275	L	94.1	Very high	88.9	Confident	57 Å²	57	41.7 Å²	41.7	30%	0.298	21%	0.207	S	C	.	.			trans	-79.6	111.2	-180	-179.7	67.3	0	0	0	110.8	L203 K213 I222 A224	L203-L275 HydrophobicContact CD1-CD1 3.65Å; L203-L275 HydrophobicContact CD2-CD1 4.35Å; K213-L275 HydrophobicContact CD-CD2 4.5Å; K213-L275 HydrophobicContact CG-CD1 4.5Å; K213-L275 HydrophobicContact CG-CD2 4.42Å; I222-L275 HydrophobicContact CB-CD2 4.35Å; I222-L275 HydrophobicContact CG2-CD2 3.78Å; A224-L275 HydrophobicContact CB-CD1 4.18Å
276	M	94.9	Very high	89.3	Confident	15 Å²	15	40.3 Å²	40.3	7%	0.074	21%	0.207	C	C	.	.			trans	-88.8	155.5	166	-58.5	-63.9	-72.3	0	0	110.8	V257 E274 L327 D329 N333 K335	V257-M276 HydrophobicContact CG2-CG 3.99Å; E274-M276 PolarHBondContact O-N 3.36Å; M276-L327 HydrophobicContact CB-CB 3.76Å; M276-L327 HydrophobicContact CB-CD1 3.77Å; M276-L327 HydrophobicContact CB-CG 4.41Å; M276-L327 HydrophobicContact CE-CB 4.18Å; M276-L327 HydrophobicContact CG-CB 3.82Å; M276-L327 HydrophobicContact CG-CD1 3.76Å; M276-L327 HydrophobicContact CG-CG 4.44Å; M276-D329 HydrophobicContact CE-CB 3.89Å; M276-D329 HydrophobicContact SD-CB 4.16Å; M276-N333 WeakPolarHBondContact CE-O 3.32Å; M276-K335 HydrophobicContact CE-CB 4.07Å; M276-K335 HydrophobicContact CE-CD 4Å; M276-K335 HydrophobicContact CE-CG 3.97Å; M276-K335 HydrophobicContact SD-CD 3.88Å; M276-K335 HydrophobicContact SD-CG 4.5Å
277	S	92.5	Very high	89.7	Confident	52 Å²	52	35.6 Å²	35.6	36%	0.364	18%	0.183	S	C	.	.	S	Bend	trans	-77.4	-41.4	-172.5	-58.1	0	0	0	0	113.8	I328 E330	S277-I328 WeakPolarHBondContact CB-O 3.49Å; S277-I328 PolarHBondContact N-O 2.72Å; S277-E330 PolarHBondContact OG-N 3.03Å
278	M	90.8	Very high	90.1	Very high	29 Å²	29	41 Å²	41	14%	0.143	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	171.6	168.5	67.3	177	71.8	0	0	113.1	L283 L286 L327 I328 F470 K474	M278-L283 HydrophobicContact CG-CB 4.45Å; M278-L283 HydrophobicContact SD-CB 3.59Å; M278-L283 VanDerWaalsContact SD-CB 3.59Å; M278-L283 HydrophobicContact SD-CD1 4.1Å; M278-L283 HydrophobicContact SD-CG 3.87Å; M278-L286 HydrophobicContact CE-CD1 3.9Å; M278-L286 HydrophobicContact SD-CD1 4.21Å; M278-L327 CarbonylContact O-C 3.54Å; M278-L327 WeakPolarHBondContact O-CA 3.38Å; M278-I328 HydrophobicContact CG-CG2 3.81Å; M278-I328 PolarHBondContact N-O 2.73Å; M278-I328 VanDerWaalsContact N-O 3.11Å; M278-I328 PolarHBondContact O-N 3.26Å; M278-F470 HydrophobicContact CE-CE2 3.76Å; M278-F470 HydrophobicContact CE-CZ 3.87Å; M278-F470 HydrophobicContact CG-CE2 3.69Å; M278-F470 HydrophobicContact CG-CZ 3.91Å; M278-F470 HydrophobicContact SD-CE2 3.8Å; M278-F470 HydrophobicContact SD-CZ 4.33Å; M278-K474 HydrophobicContact CE-CG 4.46Å
279	C	92.6	Very high	90.3	Very high	9 Å²	9	45 Å²	45	6%	0.061	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	156.9	164.6	59.3	0	0	0	0	111.6	D281 K282 L283 S324 I326 L327	C279-D281 VanDerWaalsContact C-N 3.28Å; C279-D281 PolarHBondContact O-N 2.87Å; C279-K282 PolarHBondContact O-N 3.38Å; C279-K282 VanDerWaalsContact O-N 3.15Å; C279-K282 VanDerWaalsContact SG-CD 3.56Å; C279-K282 VanDerWaalsContact SG-CG 3.55Å; C279-L283 PolarHBondContact O-N 3.42Å; C279-S324 WeakPolarHBondContact CB-O 3.37Å; C279-I326 CarbonylContact C-O 3.59Å; C279-I326 VanDerWaalsContact CA-O 3.28Å; C279-I326 WeakPolarHBondContact CA-O 3.04Å; C279-L327 HydrophobicContact CB-CD2 3.39Å
280	F	94	Very high	90.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-29.2	179.2	-86.5	-92.1	0	0	0	113.4	K282 L283 L284 V291 I295 V299 P323 I326 I328 I334 L389 W469	F280-K282 PolarHBondContact O-N 3.34Å; F280-L283 HydrophobicContact CD1-CD1 4.27Å; F280-L283 HydrophobicContact CE1-CD1 4.19Å; F280-L283 WeakPolarHBondContact O-CB 3.38Å; F280-L283 PolarHBondContact O-N 3.05Å; F280-L284 WeakPolarHBondContact O-CB 3.37Å; F280-L284 PolarHBondContact O-N 3.43Å; F280-V291 HydrophobicContact CD1-CG2 4.36Å; F280-V291 HydrophobicContact CE1-CG1 4.25Å; F280-I295 HydrophobicContact CE1-CG2 4.35Å; F280-I295 HydrophobicContact CZ-CG2 4.42Å; F280-V299 HydrophobicContact CE1-CG2 3.81Å; F280-V299 HydrophobicContact CE2-CG2 3.81Å; F280-V299 HydrophobicContact CZ-CG2 3.37Å; F280-P323 CarbonylContact C-O 3.52Å; F280-P323 WeakPolarHBondContact CA-O 3.34Å; F280-P323 HydrophobicContact CB-CB 4.32Å; F280-P323 PolarHBondContact N-O 3.16Å; F280-I326 HydrophobicContact CD2-CB 4.12Å; F280-I326 HydrophobicContact CD2-CG2 3.64Å; F280-I326 HydrophobicContact CE2-CG2 3.96Å; F280-I326 PolarHBondContact N-O 3.38Å; F280-I328 HydrophobicContact CE2-CB 3.89Å; F280-I328 HydrophobicContact CE2-CG2 4.16Å; F280-I328 HydrophobicContact CZ-CB 4.33Å; F280-I328 HydrophobicContact CZ-CD1 4.12Å; F280-I334 HydrophobicContact CE2-CG1 4.34Å; F280-I334 HydrophobicContact CE2-CG2 4.15Å; F280-I334 HydrophobicContact CZ-CD1 4.47Å; F280-I334 HydrophobicContact CZ-CG1 4.43Å; F280-L389 HydrophobicContact CB-CD1 4.1Å; F280-L389 HydrophobicContact CB-CD2 3.92Å; F280-L389 HydrophobicContact CD1-CD1 4.11Å; F280-L389 HydrophobicContact CD1-CD2 4.23Å; F280-L389 HydrophobicContact CG-CD1 4.25Å; F280-W469 HydrophobicContact CE1-CH2 4.11Å; F280-W469 HydrophobicContact CE1-CZ3 4.39Å
281	D	91	Very high	91	Very high	29 Å²	29	46.2 Å²	46.2	16%	0.155	23%	0.229	C	C	.	.	H	α-helix	trans	-54.8	-47.6	169.6	171.5	91.6	0	0	0	112.3	C279 K285 P323	C279-D281 VanDerWaalsContact C-N 3.28Å; C279-D281 PolarHBondContact O-N 2.87Å; D281-K285 WeakPolarHBondContact O-CD 3.45Å; D281-K285 VanDerWaalsContact O-CG 3.31Å; D281-K285 WeakPolarHBondContact O-CG 3.45Å; D281-K285 PolarHBondContact O-N 2.92Å; D281-K285 VanDerWaalsContact OD1-CE 3.3Å; D281-K285 WeakPolarHBondContact OD1-CE 3.19Å; D281-K285 IonicContact OD1-NZ 3.96Å; D281-K285 PolarHBondContact OD1-NZ 3.08Å; D281-K285 IonicContact OD2-NZ 2.71Å; D281-K285 PolarHBondContact OD2-NZ 3.44Å; D281-P323 HydrophobicContact CB-CB 4.03Å; D281-P323 PolarHBondContact N-O 3.42Å
282	K	89.5	Confident	91.4	Very high	82 Å²	82	48.8 Å²	48.8	36%	0.357	25%	0.246	S	C	.	.	H	α-helix	trans	-70.3	-37.5	176.1	-72.1	168.6	-172.3	161.5	0	111.3	L203 C279 F280 L284 K285 L286	L203-K282 PolarHBondContact O-NZ 3.19Å; C279-K282 PolarHBondContact O-N 3.38Å; C279-K282 VanDerWaalsContact O-N 3.15Å; C279-K282 VanDerWaalsContact SG-CD 3.56Å; C279-K282 VanDerWaalsContact SG-CG 3.55Å; F280-K282 PolarHBondContact O-N 3.34Å; K282-L284 VanDerWaalsContact C-N 3.33Å; K282-L284 PolarHBondContact O-N 3.14Å; K282-K285 PolarHBondContact O-N 3.31Å; K282-L286 VanDerWaalsContact O-CB 3.32Å; K282-L286 WeakPolarHBondContact O-CB 3.47Å; K282-L286 WeakPolarHBondContact O-CG 3.16Å; K282-L286 PolarHBondContact O-N 3.48Å
283	L	91.3	Very high	91.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.5	-45.1	177.1	-162	156.3	0	0	0	111	M278 C279 F280 L286 S287 V291 I328 W469 F470	M278-L283 HydrophobicContact CG-CB 4.45Å; M278-L283 HydrophobicContact SD-CB 3.59Å; M278-L283 VanDerWaalsContact SD-CB 3.59Å; M278-L283 HydrophobicContact SD-CD1 4.1Å; M278-L283 HydrophobicContact SD-CG 3.87Å; C279-L283 PolarHBondContact O-N 3.42Å; F280-L283 HydrophobicContact CD1-CD1 4.27Å; F280-L283 HydrophobicContact CE1-CD1 4.19Å; F280-L283 WeakPolarHBondContact O-CB 3.38Å; F280-L283 PolarHBondContact O-N 3.05Å; L283-L286 PolarHBondContact O-N 3.41Å; L283-S287 VanDerWaalsContact O-CB 3.31Å; L283-S287 WeakPolarHBondContact O-CB 3.44Å; L283-S287 PolarHBondContact O-N 3.06Å; L283-S287 PolarHBondContact O-OG 3.12Å; L283-V291 HydrophobicContact CD2-CG2 4.32Å; L283-I328 HydrophobicContact CD1-CG2 4.1Å; L283-W469 HydrophobicContact CD1-CH2 3.54Å; L283-W469 HydrophobicContact CD1-CZ3 3.81Å; L283-W469 HydrophobicContact CD2-CH2 3.59Å; L283-W469 HydrophobicContact CD2-CZ2 3.96Å; L283-W469 HydrophobicContact CG-CH2 4.23Å; L283-F470 HydrophobicContact CD1-CD2 3.92Å; L283-F470 HydrophobicContact CD1-CE2 4Å
284	L	91	Very high	91.8	Very high	17 Å²	17	54.8 Å²	54.8	9%	0.089	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-45.5	177.7	-150	67.4	0	0	0	111.4	F280 K282 L286 S287 K288 V291 E388 L389 A392	F280-L284 WeakPolarHBondContact O-CB 3.37Å; F280-L284 PolarHBondContact O-N 3.43Å; K282-L284 VanDerWaalsContact C-N 3.33Å; K282-L284 PolarHBondContact O-N 3.14Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 3.41Å; L284-S287 PolarHBondContact O-N 3.35Å; L284-S287 PolarHBondContact O-OG 3.43Å; L284-K288 WeakPolarHBondContact O-CA 3.4Å; L284-K288 PolarHBondContact O-N 3Å; L284-V291 HydrophobicContact CD1-CG2 4.15Å; L284-E388 HydrophobicContact CD2-CG 3.97Å; L284-L389 HydrophobicContact CD1-CD2 3.99Å; L284-L389 HydrophobicContact CD2-CD2 4.16Å; L284-L389 HydrophobicContact CG-CD2 4.47Å; L284-A392 HydrophobicContact CD1-CB 3.84Å; L284-A392 HydrophobicContact CG-CB 4.2Å
285	K	88.9	Confident	92	Very high	133 Å²	133	53 Å²	53	58%	0.578	27%	0.265	S	S	*	.	H	α-helix	trans	-66.1	-29.9	177.7	-69.9	166.8	-171.1	167.7	0	113.6	D281 K282	D281-K285 WeakPolarHBondContact O-CD 3.45Å; D281-K285 VanDerWaalsContact O-CG 3.31Å; D281-K285 WeakPolarHBondContact O-CG 3.45Å; D281-K285 PolarHBondContact O-N 2.92Å; D281-K285 VanDerWaalsContact OD1-CE 3.3Å; D281-K285 WeakPolarHBondContact OD1-CE 3.19Å; D281-K285 IonicContact OD1-NZ 3.96Å; D281-K285 PolarHBondContact OD1-NZ 3.08Å; D281-K285 IonicContact OD2-NZ 2.71Å; D281-K285 PolarHBondContact OD2-NZ 3.44Å; K282-K285 PolarHBondContact O-N 3.31Å
286	L	86.7	Confident	92.2	Very high	77 Å²	77	50.2 Å²	50.2	40%	0.403	25%	0.251	S	S	.	.	H	α-helix	trans	-80.7	-43.9	176	-74	171.2	0	0	0	112.6	M278 K282 L283 L284	M278-L286 HydrophobicContact CE-CD1 3.9Å; M278-L286 HydrophobicContact SD-CD1 4.21Å; K282-L286 VanDerWaalsContact O-CB 3.32Å; K282-L286 WeakPolarHBondContact O-CB 3.47Å; K282-L286 WeakPolarHBondContact O-CG 3.16Å; K282-L286 PolarHBondContact O-N 3.48Å; L283-L286 PolarHBondContact O-N 3.41Å; L284-L286 VanDerWaalsContact C-N 3.32Å; L284-L286 PolarHBondContact O-N 3.41Å
287	S	86.9	Confident	92.4	Very high	22 Å²	22	49.5 Å²	49.5	15%	0.154	25%	0.247	C	C	.	.	H	α-helix	trans	-77.8	-34.7	-177.3	61.8	0	0	0	0	113.2	L283 L284 K289	L283-S287 VanDerWaalsContact O-CB 3.31Å; L283-S287 WeakPolarHBondContact O-CB 3.44Å; L283-S287 PolarHBondContact O-N 3.06Å; L283-S287 PolarHBondContact O-OG 3.12Å; L284-S287 PolarHBondContact O-N 3.35Å; L284-S287 PolarHBondContact O-OG 3.43Å; S287-K289 WeakPolarHBondContact O-CG 3.38Å; S287-K289 PolarHBondContact O-N 2.8Å; S287-K289 VanDerWaalsContact O-N 3.16Å; S287-K289 PolarHBondContact OG-N 2.89Å; S287-K289 PolarHBondContact OG-O 3.01Å
288	K	86.3	Confident	92.6	Very high	175 Å²	175	49.3 Å²	49.3	76%	0.761	24%	0.239	S	C	*	.			trans	48.6	31.3	-167.5	-58.5	-175.1	-180	-179.3	0	113	L284	L284-K288 WeakPolarHBondContact O-CA 3.4Å; L284-K288 PolarHBondContact O-N 3Å
289	K	89.4	Confident	93	Very high	139 Å²	139	47.9 Å²	47.9	60%	0.604	23%	0.233	S	C	*	.	S	Bend	trans	-137.3	146.3	-175.2	-74.5	177.8	-179.6	-175.8	0	110.3	S287 A392	S287-K289 WeakPolarHBondContact O-CG 3.38Å; S287-K289 PolarHBondContact O-N 2.8Å; S287-K289 VanDerWaalsContact O-N 3.16Å; S287-K289 PolarHBondContact OG-N 2.89Å; S287-K289 PolarHBondContact OG-O 3.01Å; K289-A392 VanDerWaalsContact C-CB 3.47Å
290	P	92.6	Very high	93.2	Very high	66 Å²	66	47.5 Å²	47.5	43%	0.429	23%	0.23	S	C	.	.			trans	-45.1	137.5	167.9	-35.4	40.3	0	0	0	113.5	A390 A392	P290-A390 WeakPolarHBondContact CB-O 3.36Å; P290-A392 HydrophobicContact CG-CB 4.39Å
291	V	95	Very high	93.5	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.012	23%	0.231	C	C	.	.			trans	-76.2	125.6	167.1	178.7	0	0	0	0	107.7	F280 L283 L284 I295 L296 L389 W469	F280-V291 HydrophobicContact CD1-CG2 4.36Å; F280-V291 HydrophobicContact CE1-CG1 4.25Å; L283-V291 HydrophobicContact CD2-CG2 4.32Å; L284-V291 HydrophobicContact CD1-CG2 4.15Å; V291-I295 HydrophobicContact CG1-CB 3.78Å; V291-I295 HydrophobicContact CG1-CG2 3.74Å; V291-L296 HydrophobicContact CB-CD2 3.82Å; V291-L296 HydrophobicContact CB-CG 4.17Å; V291-L296 HydrophobicContact CG1-CD2 3.61Å; V291-L296 HydrophobicContact CG1-CG 3.9Å; V291-L296 WeakPolarHBondContact O-CD1 3.36Å; V291-L389 HydrophobicContact CB-CB 4.36Å; V291-L389 WeakPolarHBondContact CB-O 3.49Å; V291-L389 HydrophobicContact CG2-CB 4.19Å; V291-L389 HydrophobicContact CG2-CD2 4.29Å; V291-L389 PolarHBondContact N-O 3.26Å; V291-W469 HydrophobicContact CG1-CH2 4Å; V291-W469 HydrophobicContact CG1-CZ2 3.96Å; V291-W469 HydrophobicContact CG2-CH2 4.49Å; V291-W469 HydrophobicContact CG2-CZ2 4.43Å
292	P	94.9	Very high	93.8	Very high	57 Å²	57	46.4 Å²	46.4	37%	0.37	23%	0.225	S	C	.	.			trans	-60	144.5	-177.8	-24.4	33.9	0	0	0	112.6	Q294 I295 L296	P292-Q294 PolarHBondContact O-N 3.18Å; P292-Q294 VanDerWaalsContact O-N 3.1Å; P292-I295 HydrophobicContact CB-CG1 4.29Å; P292-I295 HydrophobicContact CG-CG1 4.41Å; P292-I295 WeakPolarHBondContact O-CA 3.48Å; P292-I295 WeakPolarHBondContact O-CB 3.17Å; P292-I295 PolarHBondContact O-N 2.71Å; P292-L296 PolarHBondContact O-N 2.72Å; P292-L296 VanDerWaalsContact O-N 3.08Å
293	E	96.3	Very high	94.2	Very high	29 Å²	29	42.5 Å²	42.5	14%	0.136	21%	0.208	C	C	.	.	H	α-helix	trans	-53.4	-38.3	-177	-172.8	-173.4	122.8	0	0	112.7	I295 L296 G297 S426 F429 F455 Y459	E293-I295 PolarHBondContact O-N 2.98Å; E293-L296 CarbonylContact O-C 3.58Å; E293-L296 WeakPolarHBondContact O-CA 3.24Å; E293-L296 WeakPolarHBondContact O-CB 3.01Å; E293-L296 PolarHBondContact O-N 2.99Å; E293-G297 PolarHBondContact O-N 3.49Å; E293-S426 VanDerWaalsContact CD-OG 3.25Å; E293-S426 VanDerWaalsContact OE1-CB 3.27Å; E293-S426 WeakPolarHBondContact OE1-CB 3.46Å; E293-S426 PolarHBondContact OE1-OG 3.2Å; E293-S426 PolarHBondContact OE2-N 2.99Å; E293-S426 PolarHBondContact OE2-OG 3.35Å; E293-F429 HydrophobicContact CB-CD1 4.46Å; E293-F429 HydrophobicContact CG-CB 4.14Å; E293-F429 HydrophobicContact CG-CD1 3.63Å; E293-F429 HydrophobicContact CG-CE1 4.23Å; E293-F429 HydrophobicContact CG-CG 3.96Å; E293-F455 HydrophobicContact CG-CE2 4.03Å; E293-F455 HydrophobicContact CG-CZ 4.5Å; E293-Y459 PolarHBondContact OE1-OH 3.09Å
294	Q	96.4	Very high	94.5	Very high	117 Å²	117	42.5 Å²	42.5	55%	0.547	21%	0.208	S	C	.	.	H	α-helix	trans	-59.4	-35.5	178.7	-63.5	-179	-18.3	0	0	113	P292 K298 Y459 V464	P292-Q294 PolarHBondContact O-N 3.18Å; P292-Q294 VanDerWaalsContact O-N 3.1Å; Q294-K298 PolarHBondContact O-N 3.12Å; Q294-Y459 HydrophobicContact CB-CE1 4.12Å; Q294-Y459 HydrophobicContact CG-CE1 4.17Å; Q294-V464 HydrophobicContact CB-CG1 3.84Å; Q294-V464 HydrophobicContact CB-CG2 4.13Å
295	I	97.5	Very high	94.8	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-74.6	-42.3	174.4	-51.8	-63.7	0	0	0	109.8	F280 V291 P292 E293 G297 K298 V299 V464 V466 W469	F280-I295 HydrophobicContact CE1-CG2 4.35Å; F280-I295 HydrophobicContact CZ-CG2 4.42Å; V291-I295 HydrophobicContact CG1-CB 3.78Å; V291-I295 HydrophobicContact CG1-CG2 3.74Å; P292-I295 HydrophobicContact CB-CG1 4.29Å; P292-I295 HydrophobicContact CG-CG1 4.41Å; P292-I295 WeakPolarHBondContact O-CA 3.48Å; P292-I295 WeakPolarHBondContact O-CB 3.17Å; P292-I295 PolarHBondContact O-N 2.71Å; E293-I295 PolarHBondContact O-N 2.98Å; I295-G297 VanDerWaalsContact C-N 3.26Å; I295-G297 PolarHBondContact O-N 2.76Å; I295-K298 CarbonylContact O-C 3.58Å; I295-K298 PolarHBondContact O-N 3.49Å; I295-V299 HydrophobicContact CG2-CG2 4.49Å; I295-V299 WeakPolarHBondContact O-CG2 3.42Å; I295-V299 PolarHBondContact O-N 2.63Å; I295-V464 HydrophobicContact CD1-CG1 3.92Å; I295-V466 HydrophobicContact CD1-CB 4.34Å; I295-V466 HydrophobicContact CD1-CG1 4.48Å; I295-V466 HydrophobicContact CD1-CG2 3.99Å; I295-W469 HydrophobicContact CD1-CB 3.89Å; I295-W469 HydrophobicContact CD1-CD2 3.73Å; I295-W469 HydrophobicContact CD1-CE3 3.84Å; I295-W469 HydrophobicContact CD1-CG 3.75Å; I295-W469 HydrophobicContact CG1-CD2 3.69Å; I295-W469 HydrophobicContact CG1-CE3 3.98Å; I295-W469 HydrophobicContact CG1-CG 3.94Å; I295-W469 HydrophobicContact CG1-CZ2 4.42Å; I295-W469 HydrophobicContact CG1-CZ3 4.46Å; I295-W469 HydrophobicContact CG2-CD2 4.41Å; I295-W469 HydrophobicContact CG2-CE3 3.91Å; I295-W469 HydrophobicContact CG2-CH2 3.9Å; I295-W469 HydrophobicContact CG2-CZ2 4.4Å; I295-W469 HydrophobicContact CG2-CZ3 3.64Å
296	L	97.9	Very high	95	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-33.3	175.9	-63.7	179.7	0	0	0	112.9	V291 P292 E293 V299 T300 L386 L389 A390 F429	V291-L296 HydrophobicContact CB-CD2 3.82Å; V291-L296 HydrophobicContact CB-CG 4.17Å; V291-L296 HydrophobicContact CG1-CD2 3.61Å; V291-L296 HydrophobicContact CG1-CG 3.9Å; V291-L296 WeakPolarHBondContact O-CD1 3.36Å; P292-L296 PolarHBondContact O-N 2.72Å; P292-L296 VanDerWaalsContact O-N 3.08Å; E293-L296 CarbonylContact O-C 3.58Å; E293-L296 WeakPolarHBondContact O-CA 3.24Å; E293-L296 WeakPolarHBondContact O-CB 3.01Å; E293-L296 PolarHBondContact O-N 2.99Å; L296-V299 PolarHBondContact O-N 3.42Å; L296-T300 VanDerWaalsContact O-CB 3.32Å; L296-T300 WeakPolarHBondContact O-CB 3.12Å; L296-T300 PolarHBondContact O-N 3.18Å; L296-T300 PolarHBondContact O-OG1 3.16Å; L296-L386 HydrophobicContact CB-CD2 4.42Å; L296-L386 HydrophobicContact CD2-CD2 4.4Å; L296-L389 HydrophobicContact CD2-CB 3.6Å; L296-L389 HydrophobicContact CD2-CD1 4.23Å; L296-A390 HydrophobicContact CD1-CB 3.63Å; L296-F429 HydrophobicContact CB-CZ 4.32Å; L296-F429 HydrophobicContact CD1-CE1 3.88Å; L296-F429 HydrophobicContact CD1-CZ 3.63Å
297	G	97.9	Very high	95.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.3	-50.9	169.3	0	0	0	0	0	111.5	E293 I295 V299 T300 V301 Y459	E293-G297 PolarHBondContact O-N 3.49Å; I295-G297 VanDerWaalsContact C-N 3.26Å; I295-G297 PolarHBondContact O-N 2.76Å; G297-V299 PolarHBondContact O-N 3.4Å; G297-T300 PolarHBondContact O-N 2.8Å; G297-V301 WeakPolarHBondContact O-CG2 3.39Å; G297-V301 PolarHBondContact O-N 3.07Å; G297-Y459 VanDerWaalsContact CA-CG 3.48Å
298	K	98.1	Very high	95.7	Very high	47 Å²	47	33.4 Å²	33.4	20%	0.204	17%	0.165	C	C	.	.	H	α-helix	trans	-64.2	-37.1	175.2	-66.2	-61.8	-174.2	-174.1	0	113.1	Q294 I295 A302 I334 Y459 A462 V464 V466	Q294-K298 PolarHBondContact O-N 3.12Å; I295-K298 CarbonylContact O-C 3.58Å; I295-K298 PolarHBondContact O-N 3.49Å; K298-A302 WeakPolarHBondContact O-CB 3.39Å; K298-A302 PolarHBondContact O-N 3.41Å; K298-I334 HydrophobicContact CB-CD1 3.87Å; K298-Y459 WeakPolarHBondContact CD-O 3.39Å; K298-Y459 WeakPolarHBondContact CE-O 3.28Å; K298-Y459 PolarHBondContact NZ-O 2.94Å; K298-A462 WeakPolarHBondContact CE-O 3.49Å; K298-A462 PolarHBondContact NZ-O 2.73Å; K298-V464 HydrophobicContact CG-CB 4.04Å; K298-V464 HydrophobicContact CG-CG1 4.4Å; K298-V464 HydrophobicContact CG-CG2 4.3Å; K298-V466 HydrophobicContact CB-CG2 4.14Å; K298-V466 HydrophobicContact CG-CG2 3.98Å
299	V	98.2	Very high	96.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-45.1	171.9	170.8	0	0	0	0	111.1	F280 I295 L296 G297 A302 T303 I326 I334	F280-V299 HydrophobicContact CE1-CG2 3.81Å; F280-V299 HydrophobicContact CE2-CG2 3.81Å; F280-V299 HydrophobicContact CZ-CG2 3.37Å; I295-V299 HydrophobicContact CG2-CG2 4.49Å; I295-V299 WeakPolarHBondContact O-CG2 3.42Å; I295-V299 PolarHBondContact O-N 2.63Å; L296-V299 PolarHBondContact O-N 3.42Å; G297-V299 PolarHBondContact O-N 3.4Å; V299-A302 PolarHBondContact O-N 3.33Å; V299-T303 VanDerWaalsContact O-CB 3.3Å; V299-T303 WeakPolarHBondContact O-CB 3.39Å; V299-T303 PolarHBondContact O-N 2.62Å; V299-T303 PolarHBondContact O-OG1 3.32Å; V299-I326 HydrophobicContact CG1-CD1 3.99Å; V299-I326 HydrophobicContact CG1-CG2 4.15Å; V299-I334 HydrophobicContact CG2-CD1 3.78Å; V299-I334 HydrophobicContact CG2-CG2 4.27Å
300	T	98.3	Very high	96	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-48.5	-179	-57.9	0	0	0	0	111.1	L296 G297 A302 T303 V304 L386 F432 F455 I456	L296-T300 VanDerWaalsContact O-CB 3.32Å; L296-T300 WeakPolarHBondContact O-CB 3.12Å; L296-T300 PolarHBondContact O-N 3.18Å; L296-T300 PolarHBondContact O-OG1 3.16Å; G297-T300 PolarHBondContact O-N 2.8Å; T300-A302 VanDerWaalsContact C-N 3.32Å; T300-A302 PolarHBondContact O-N 3.32Å; T300-T303 PolarHBondContact O-N 2.74Å; T300-V304 HydrophobicContact CG2-CG2 4.18Å; T300-V304 WeakPolarHBondContact O-CB 3.48Å; T300-V304 WeakPolarHBondContact O-CG2 3.27Å; T300-V304 PolarHBondContact O-N 3.04Å; T300-L386 HydrophobicContact CG2-CD1 4.38Å; T300-L386 VanDerWaalsContact OG1-CD2 3.31Å; T300-L386 WeakPolarHBondContact OG1-CD2 3.47Å; T300-F432 HydrophobicContact CG2-CD1 4.2Å; T300-F432 HydrophobicContact CG2-CE1 3.37Å; T300-F432 HydrophobicContact CG2-CE2 4.12Å; T300-F432 HydrophobicContact CG2-CZ 3.34Å; T300-F455 HydrophobicContact CG2-CD1 4.19Å; T300-F455 HydrophobicContact CG2-CE1 3.98Å; T300-I456 HydrophobicContact CG2-CD1 3.97Å; T300-I456 HydrophobicContact CG2-CG1 3.99Å
301	V	98.3	Very high	95.7	Very high	4 Å²	4	20 Å²	20	2%	0.024	10%	0.099	C	C	.	.	H	α-helix	trans	-55.2	-47.7	175.5	171.6	0	0	0	0	110.7	G297 N305 I456 E460	G297-V301 WeakPolarHBondContact O-CG2 3.39Å; G297-V301 PolarHBondContact O-N 3.07Å; V301-N305 WeakPolarHBondContact O-CB 3.47Å; V301-N305 PolarHBondContact O-N 2.87Å; V301-N305 PolarHBondContact O-ND2 2.9Å; V301-I456 HydrophobicContact CG2-CG2 4.17Å; V301-E460 HydrophobicContact CG1-CG 3.78Å; V301-E460 HydrophobicContact CG2-CG 4.1Å
302	A	97.9	Very high	95.5	Very high	3 Å²	3	24.2 Å²	24.2	3%	0.025	12%	0.122	C	C	.	.	H	α-helix	trans	-64.2	-48.9	178.6	0	0	0	0	0	112.3	Y255 K298 V299 T300 N305 A306 I334	Y255-A302 WeakPolarHBondContact CB-O 3.26Å; Y255-A302 VanDerWaalsContact CD1-CA 3.44Å; Y255-A302 HydrophobicContact CD1-CB 3.44Å; Y255-A302 VanDerWaalsContact CD1-CB 3.44Å; Y255-A302 HydrophobicContact CE1-CB 3.82Å; Y255-A302 HydrophobicContact CG-CB 4.16Å; K298-A302 WeakPolarHBondContact O-CB 3.39Å; K298-A302 PolarHBondContact O-N 3.41Å; V299-A302 PolarHBondContact O-N 3.33Å; T300-A302 VanDerWaalsContact C-N 3.32Å; T300-A302 PolarHBondContact O-N 3.32Å; A302-N305 PolarHBondContact O-N 2.97Å; A302-A306 WeakPolarHBondContact O-CB 3.37Å; A302-A306 PolarHBondContact O-N 2.98Å; A302-I334 HydrophobicContact CB-CB 4.03Å; A302-I334 HydrophobicContact CB-CG2 3.98Å
303	T	97.6	Very high	95.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.2	-44.3	-173.8	-51.8	0	0	0	0	111.8	V299 T300 A306 L307 V321 I326 L336 L382	V299-T303 VanDerWaalsContact O-CB 3.3Å; V299-T303 WeakPolarHBondContact O-CB 3.39Å; V299-T303 PolarHBondContact O-N 2.62Å; V299-T303 PolarHBondContact O-OG1 3.32Å; T300-T303 PolarHBondContact O-N 2.74Å; T303-A306 PolarHBondContact O-N 3.33Å; T303-L307 HydrophobicContact CG2-CD1 3.98Å; T303-L307 HydrophobicContact CG2-CG 4.41Å; T303-L307 WeakPolarHBondContact O-CB 3.35Å; T303-L307 VanDerWaalsContact O-CG 3.23Å; T303-L307 WeakPolarHBondContact O-CG 3.46Å; T303-L307 PolarHBondContact O-N 3.43Å; T303-V321 HydrophobicContact CG2-CG1 4.25Å; T303-I326 HydrophobicContact CG2-CD1 4.27Å; T303-L336 HydrophobicContact CG2-CD1 4.37Å; T303-L336 HydrophobicContact CG2-CD2 4.46Å; T303-L382 HydrophobicContact CG2-CD1 4.02Å
304	V	97.8	Very high	94.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68	-38.3	178.8	179.9	0	0	0	0	111.5	T300 L307 S308 L382 F432 L450 L451 I456	T300-V304 HydrophobicContact CG2-CG2 4.18Å; T300-V304 WeakPolarHBondContact O-CB 3.48Å; T300-V304 WeakPolarHBondContact O-CG2 3.27Å; T300-V304 PolarHBondContact O-N 3.04Å; V304-L307 PolarHBondContact O-N 3.3Å; V304-S308 PolarHBondContact O-N 2.96Å; V304-L382 HydrophobicContact CG2-CD2 3.41Å; V304-L382 VanDerWaalsContact CG2-CD2 3.41Å; V304-F432 HydrophobicContact CG2-CZ 4.3Å; V304-L450 HydrophobicContact CG1-CB 4.04Å; V304-L451 HydrophobicContact CB-CD2 4.32Å; V304-L451 HydrophobicContact CG1-CD2 3.74Å; V304-L451 HydrophobicContact CG1-CG 3.81Å; V304-I456 HydrophobicContact CB-CD1 3.94Å; V304-I456 HydrophobicContact CG1-CD1 4.08Å; V304-I456 HydrophobicContact CG2-CD1 3.89Å
305	N	97.3	Very high	93.6	Very high	44 Å²	44	26.8 Å²	26.8	24%	0.235	14%	0.142	C	C	.	.	H	α-helix	trans	-66.1	-40.3	174.3	-83.7	-81.3	0	0	0	112.2	Y255 V301 A302 Y309	Y255-N305 HydrophobicContact CD2-CB 3.4Å; Y255-N305 HydrophobicContact CE2-CB 3.44Å; Y255-N305 VanDerWaalsContact CE2-CB 3.44Å; Y255-N305 HydrophobicContact CG-CB 4.38Å; V301-N305 WeakPolarHBondContact O-CB 3.47Å; V301-N305 PolarHBondContact O-N 2.87Å; V301-N305 PolarHBondContact O-ND2 2.9Å; A302-N305 PolarHBondContact O-N 2.97Å; N305-Y309 VanDerWaalsContact O-CB 3.26Å; N305-Y309 WeakPolarHBondContact O-CB 3.36Å; N305-Y309 PolarHBondContact O-N 3.05Å
306	A	94.7	Very high	92.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-44.8	173.5	0	0	0	0	0	111.9	I256 A302 T303 Y309 L310 L336	I256-A306 HydrophobicContact CG1-CB 3.98Å; A302-A306 WeakPolarHBondContact O-CB 3.37Å; A302-A306 PolarHBondContact O-N 2.98Å; T303-A306 PolarHBondContact O-N 3.33Å; A306-Y309 PolarHBondContact O-N 3.03Å; A306-L310 VanDerWaalsContact O-CG 3.32Å; A306-L310 WeakPolarHBondContact O-CG 3.39Å; A306-L310 PolarHBondContact O-N 3.33Å; A306-L336 HydrophobicContact CB-CB 3.9Å; A306-L336 HydrophobicContact CB-CD2 3.84Å
307	L	93.5	Very high	92	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-42.6	179	-72.2	172.9	0	0	0	112.9	T303 V304 L310 K311 H318 V321 L336 D378 Y447	T303-L307 HydrophobicContact CG2-CD1 3.98Å; T303-L307 HydrophobicContact CG2-CG 4.41Å; T303-L307 WeakPolarHBondContact O-CB 3.35Å; T303-L307 VanDerWaalsContact O-CG 3.23Å; T303-L307 WeakPolarHBondContact O-CG 3.46Å; T303-L307 PolarHBondContact O-N 3.43Å; V304-L307 PolarHBondContact O-N 3.3Å; L307-L310 PolarHBondContact O-N 2.98Å; L307-K311 WeakPolarHBondContact O-CB 3.33Å; L307-K311 PolarHBondContact O-N 2.93Å; L307-K311 VanDerWaalsContact O-N 3.16Å; L307-H318 HydrophobicContact CD2-CB 3.53Å; L307-V321 HydrophobicContact CD1-CG2 4.18Å; L307-V321 HydrophobicContact CD2-CG2 3.89Å; L307-L336 HydrophobicContact CD2-CD2 3.82Å; L307-L336 HydrophobicContact CG-CD2 3.97Å; L307-D378 HydrophobicContact CD1-CB 4.46Å; L307-D378 HydrophobicContact CD2-CB 4.4Å; L307-Y447 HydrophobicContact CB-CD1 4.22Å; L307-Y447 HydrophobicContact CB-CD2 4.5Å; L307-Y447 HydrophobicContact CB-CE1 3.73Å; L307-Y447 HydrophobicContact CB-CE2 3.99Å; L307-Y447 HydrophobicContact CD1-CE1 4.04Å; L307-Y447 HydrophobicContact CG-CE1 4.45Å; L307-Y447 WeakPolarHBondContact O-CE2 3.44Å
308	S	94.8	Very high	91.3	Very high	12 Å²	12	29.3 Å²	29.3	8%	0.084	16%	0.156	C	C	.	.	H	α-helix	trans	-64.4	-45.3	173.8	-144.4	0	0	0	0	110.9	V304 L310 K311 D312 Y447	V304-S308 PolarHBondContact O-N 2.96Å; S308-L310 PolarHBondContact O-N 2.97Å; S308-K311 PolarHBondContact O-N 3.35Å; S308-D312 VanDerWaalsContact O-CB 3.27Å; S308-D312 WeakPolarHBondContact O-CB 3.19Å; S308-D312 VanDerWaalsContact O-CG 3.25Å; S308-D312 PolarHBondContact O-N 2.97Å; S308-D312 PolarHBondContact OG-OD2 3.07Å; S308-Y447 WeakPolarHBondContact OG-CB 3.41Å
309	Y	92.9	Very high	90.6	Very high	28 Å²	28	30.2 Å²	30.2	11%	0.11	16%	0.158	C	C	.	.	H	α-helix	trans	-53.6	-49.2	176	170.8	-80.7	0	0	0	112.1	S250 D252 C253 I256 N305 A306 K311 D312 K313 H314	S250-Y309 WeakPolarHBondContact CA-OH 3.48Å; D252-Y309 WeakPolarHBondContact OD1-CE2 3.28Å; D252-Y309 VanDerWaalsContact OD1-CZ 3.28Å; D252-Y309 PolarHBondContact OD1-OH 2.82Å; D252-Y309 WeakPolarHBondContact OD2-CE2 3.47Å; C253-Y309 HydrophobicContact CB-CD1 3.65Å; C253-Y309 HydrophobicContact CB-CD2 3.68Å; C253-Y309 HydrophobicContact CB-CE1 3.73Å; C253-Y309 HydrophobicContact CB-CE2 3.7Å; C253-Y309 HydrophobicContact CB-CG 3.68Å; I256-Y309 HydrophobicContact CD1-CD1 3.51Å; I256-Y309 HydrophobicContact CD1-CE1 3.89Å; I256-Y309 HydrophobicContact CD1-CG 4.48Å; N305-Y309 VanDerWaalsContact O-CB 3.26Å; N305-Y309 WeakPolarHBondContact O-CB 3.36Å; N305-Y309 PolarHBondContact O-N 3.05Å; A306-Y309 PolarHBondContact O-N 3.03Å; Y309-K311 VanDerWaalsContact C-N 3.33Å; Y309-K311 PolarHBondContact O-N 2.82Å; Y309-D312 PolarHBondContact O-N 3.49Å; Y309-K313 HydrophobicContact CD2-CG 3.79Å; Y309-K313 HydrophobicContact CE1-CB 4.46Å; Y309-K313 HydrophobicContact CE2-CB 4.24Å; Y309-K313 HydrophobicContact CE2-CG 3.64Å; Y309-K313 HydrophobicContact CG-CG 4.38Å; Y309-K313 VanDerWaalsContact O-CB 3.32Å; Y309-K313 WeakPolarHBondContact O-CB 3.48Å; Y309-K313 PolarHBondContact O-N 2.97Å; Y309-H314 AromaticContact CE1-CD2 3.5Å; Y309-H314 AromaticContact CE1-NE2 3.37Å; Y309-H314 WeakPolarHBondContact CE1-NE2 3.44Å; Y309-H314 AromaticContact CZ-CD2 4Å; Y309-H314 AromaticContact CZ-NE2 3.43Å; Y309-H314 PolarHBondContact OH-NE2 3.34Å
310	L	88	Confident	89.9	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-59.1	-45.1	179	-72.2	161.8	0	0	0	111.9	V246 I256 A306 L307 S308 H314 G315 V316 L336 F339	V246-L310 HydrophobicContact CG1-CD2 4.5Å; I256-L310 HydrophobicContact CD1-CD1 4.4Å; I256-L310 HydrophobicContact CD1-CD2 3.84Å; I256-L310 HydrophobicContact CD1-CG 3.86Å; A306-L310 VanDerWaalsContact O-CG 3.32Å; A306-L310 WeakPolarHBondContact O-CG 3.39Å; A306-L310 PolarHBondContact O-N 3.33Å; L307-L310 PolarHBondContact O-N 2.98Å; S308-L310 PolarHBondContact O-N 2.97Å; L310-H314 CarbonylContact O-C 3.29Å; L310-H314 WeakPolarHBondContact O-CA 3.35Å; L310-H314 WeakPolarHBondContact O-CB 3.49Å; L310-H314 PolarHBondContact O-N 3.03Å; L310-H314 VanDerWaalsContact O-N 3.14Å; L310-G315 PolarHBondContact O-N 2.87Å; L310-V316 HydrophobicContact CB-CB 4.42Å; L310-V316 PolarHBondContact O-N 3.06Å; L310-L336 HydrophobicContact CD1-CD2 4.43Å; L310-F339 HydrophobicContact CD1-CD1 3.5Å; L310-F339 VanDerWaalsContact CD1-CD1 3.5Å; L310-F339 HydrophobicContact CD1-CE1 3.79Å; L310-F339 HydrophobicContact CD2-CD1 3.93Å; L310-F339 HydrophobicContact CD2-CE1 4.37Å; L310-F339 HydrophobicContact CD2-CG 4.4Å; L310-F339 HydrophobicContact CG-CD1 4.32Å
311	K	87.4	Confident	89.5	Confident	68 Å²	68	32 Å²	32	30%	0.296	17%	0.168	S	C	.	.	H	α-helix	trans	-69.2	-38.7	-179.7	158.4	56.1	-147.7	57.8	0	111.9	L307 S308 Y309 G315 V316 I375 Y447	L307-K311 WeakPolarHBondContact O-CB 3.33Å; L307-K311 PolarHBondContact O-N 2.93Å; L307-K311 VanDerWaalsContact O-N 3.16Å; S308-K311 PolarHBondContact O-N 3.35Å; Y309-K311 VanDerWaalsContact C-N 3.33Å; Y309-K311 PolarHBondContact O-N 2.82Å; K311-G315 VanDerWaalsContact O-CA 3.29Å; K311-G315 WeakPolarHBondContact O-CA 3.28Å; K311-G315 PolarHBondContact O-N 2.96Å; K311-V316 WeakPolarHBondContact CA-O 3.2Å; K311-V316 PolarHBondContact N-O 2.85Å; K311-I375 HydrophobicContact CB-CG2 4.13Å; K311-I375 HydrophobicContact CD-CG2 3.92Å; K311-I375 HydrophobicContact CG-CD1 4.24Å; K311-I375 HydrophobicContact CG-CG2 3.91Å; K311-Y447 HydrophobicContact CB-CD2 4.11Å; K311-Y447 HydrophobicContact CB-CE2 3.79Å; K311-Y447 HydrophobicContact CG-CD2 4.18Å; K311-Y447 HydrophobicContact CG-CE2 4.14Å
312	D	89.5	Confident	89.2	Confident	91 Å²	91	32.8 Å²	32.8	49%	0.487	17%	0.171	S	C	.	.	H	α-helix	trans	-96	-25.7	-168.8	-60.7	-39.3	0	0	0	113.8	S308 Y309	S308-D312 VanDerWaalsContact O-CB 3.27Å; S308-D312 WeakPolarHBondContact O-CB 3.19Å; S308-D312 VanDerWaalsContact O-CG 3.25Å; S308-D312 PolarHBondContact O-N 2.97Å; S308-D312 PolarHBondContact OG-OD2 3.07Å; Y309-D312 PolarHBondContact O-N 3.49Å
313	K	87.3	Confident	89	Confident	146 Å²	146	32.7 Å²	32.7	64%	0.635	17%	0.17	S	C	*	.	H	α-helix	trans	-92.7	-39.2	171.9	-64.1	-64.4	-168.8	171	0	113.4	Y309	Y309-K313 HydrophobicContact CD2-CG 3.79Å; Y309-K313 HydrophobicContact CE1-CB 4.46Å; Y309-K313 HydrophobicContact CE2-CB 4.24Å; Y309-K313 HydrophobicContact CE2-CG 3.64Å; Y309-K313 HydrophobicContact CG-CG 4.38Å; Y309-K313 VanDerWaalsContact O-CB 3.32Å; Y309-K313 WeakPolarHBondContact O-CB 3.48Å; Y309-K313 PolarHBondContact O-N 2.97Å
314	H	81.3	Confident	88.5	Confident	54 Å²	54	34.5 Å²	34.5	25%	0.25	18%	0.183	C	C	.	.	S	Bend	trans	-118.2	-5.6	-170.5	-55.4	-67.1	0	0	0	114.4	V246 S250 Y309 L310 V316	V246-H314 HydrophobicContact CG1-CB 3.65Å; V246-H314 HydrophobicContact CG2-CB 4.36Å; S250-H314 PolarHBondContact OG-NE2 3.19Å; Y309-H314 AromaticContact CE1-CD2 3.5Å; Y309-H314 AromaticContact CE1-NE2 3.37Å; Y309-H314 WeakPolarHBondContact CE1-NE2 3.44Å; Y309-H314 AromaticContact CZ-CD2 4Å; Y309-H314 AromaticContact CZ-NE2 3.43Å; Y309-H314 PolarHBondContact OH-NE2 3.34Å; L310-H314 CarbonylContact O-C 3.29Å; L310-H314 WeakPolarHBondContact O-CA 3.35Å; L310-H314 WeakPolarHBondContact O-CB 3.49Å; L310-H314 PolarHBondContact O-N 3.03Å; L310-H314 VanDerWaalsContact O-N 3.14Å; H314-V316 HydrophobicContact CB-CG2 4.19Å; H314-V316 PolarHBondContact O-N 3.15Å
315	G	80	Confident	88.3	Confident	57 Å²	57	35 Å²	35	59%	0.588	19%	0.185	S	C	*	.			trans	72.1	11.1	-177.6	0	0	0	0	0	114.8	L310 K311	L310-G315 PolarHBondContact O-N 2.87Å; K311-G315 VanDerWaalsContact O-CA 3.29Å; K311-G315 WeakPolarHBondContact O-CA 3.28Å; K311-G315 PolarHBondContact O-N 2.96Å
316	V	79.6	Confident	88.2	Confident	27 Å²	27	32.9 Å²	32.9	16%	0.164	17%	0.174	C	C	.	.			trans	-88.6	151.5	-170.8	170.1	0	0	0	0	112.8	V246 L310 K311 H314	V246-V316 HydrophobicContact CB-CG2 4.44Å; V246-V316 HydrophobicContact CG1-CG2 3.96Å; V246-V316 HydrophobicContact CG2-CG2 3.96Å; L310-V316 HydrophobicContact CB-CB 4.42Å; L310-V316 PolarHBondContact O-N 3.06Å; K311-V316 WeakPolarHBondContact CA-O 3.2Å; K311-V316 PolarHBondContact N-O 2.85Å; H314-V316 HydrophobicContact CB-CG2 4.19Å; H314-V316 PolarHBondContact O-N 3.15Å
317	I	81	Confident	88.2	Confident	31 Å²	31	34.2 Å²	34.2	16%	0.159	18%	0.181	C	C	.	.			trans	-122.2	130.3	174.4	-52.4	-179.3	0	0	0	106.4	R319 I375 D378	I317-R319 HydrophobicContact CB-CG 4.38Å; I317-R319 HydrophobicContact CG2-CG 4Å; I317-R319 PolarHBondContact O-NE 3.4Å; I317-I375 HydrophobicContact CD1-CG2 4.3Å; I317-I375 HydrophobicContact CG1-CG2 3.88Å; I317-I375 HydrophobicContact CG2-CG2 4.46Å; I317-D378 WeakPolarHBondContact CG2-OD2 3.44Å
318	H	83.9	Confident	88.3	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	18%	0.181	C	C	.	.			trans	-73.5	-39.9	-168.1	-162.8	-70.3	0	0	0	113.2	L307 D320 V321 L336 C337 D338 F339 G340 D378	L307-H318 HydrophobicContact CD2-CB 3.53Å; H318-D320 PolarHBondContact CE1-O 2.86Å; H318-D320 PolarHBondContact ND1-O 3.45Å; H318-D320 PolarHBondContact O-N 3.2Å; H318-V321 HydrophobicContact CB-CG2 3.93Å; H318-L336 VanDerWaalsContact CD2-CD2 3.41Å; H318-L336 WeakPolarHBondContact CD2-CD2 3.3Å; H318-L336 WeakPolarHBondContact NE2-CG 3.48Å; H318-C337 PolarHBondContact CE1-O 2.9Å; H318-C337 VanDerWaalsContact CE1-O 3.32Å; H318-C337 PolarHBondContact NE2-O 2.77Å; H318-D338 PolarHBondContact CE1-O 3.49Å; H318-F339 AromaticContact CD2-CD1 3.53Å; H318-F339 AromaticContact NE2-CD1 3.47Å; H318-F339 WeakPolarHBondContact NE2-CD1 3.48Å; H318-F339 AromaticContact NE2-CE1 3.9Å; H318-G340 VanDerWaalsContact O-CA 3.32Å; H318-G340 WeakPolarHBondContact O-CA 3.35Å; H318-D378 WeakPolarHBondContact CA-OD2 3.31Å; H318-D378 WeakPolarHBondContact CB-OD2 3.47Å; H318-D378 PolarHBondContact N-OD2 3.47Å
319	R	83.4	Confident	88.3	Confident	65 Å²	65	34.4 Å²	34.4	25%	0.245	18%	0.181	C	C	.	.	S	Bend	trans	64.9	-14.2	175.3	-53.3	168.4	-158.9	-155.4	1.8	116.3	I317 G343 R365 Y373 D378	I317-R319 HydrophobicContact CB-CG 4.38Å; I317-R319 HydrophobicContact CG2-CG 4Å; I317-R319 PolarHBondContact O-NE 3.4Å; R319-G343 PolarHBondContact NH1-O 3.45Å; R319-R365 VanDerWaalsContact O-CZ 3.29Å; R319-R365 PolarHBondContact O-NH1 3.35Å; R319-R365 PolarHBondContact O-NH2 2.89Å; R319-Y373 WeakPolarHBondContact CD-OH 3.43Å; R319-Y373 HydrophobicContact CG-CE2 4.07Å; R319-Y373 PolarHBondContact NH1-OH 3.05Å; R319-D378 WeakPolarHBondContact CA-OD1 3.32Å; R319-D378 PolarHBondContact N-OD1 2.89Å; R319-D378 PolarHBondContact N-OD2 3.27Å
320	D	83.2	Confident	88.3	Confident	38 Å²	38	37.5 Å²	37.5	20%	0.203	20%	0.197	C	C	.	.			trans	-134.1	54	-177	-163.8	33.6	0	0	0	111.8	H318 K322 N325	H318-D320 PolarHBondContact CE1-O 2.86Å; H318-D320 PolarHBondContact ND1-O 3.45Å; H318-D320 PolarHBondContact O-N 3.2Å; D320-K322 WeakPolarHBondContact OD1-CE 3.33Å; D320-K322 IonicContact OD1-NZ 3.43Å; D320-K322 PolarHBondContact OD1-NZ 3.42Å; D320-K322 VanDerWaalsContact OD2-CE 3.3Å; D320-K322 WeakPolarHBondContact OD2-CE 3.12Å; D320-K322 IonicContact OD2-NZ 2.74Å; D320-K322 PolarHBondContact OD2-NZ 3.49Å; D320-N325 PolarHBondContact O-ND2 2.91Å; D320-N325 PolarHBondContact OD2-ND2 2.64Å
321	V	91	Very high	88.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.006	23%	0.232	C	C	.	.			trans	-84.4	120.6	174.7	-178.8	0	0	0	0	109.1	T303 L307 H318 D378 S381 L382	T303-V321 HydrophobicContact CG2-CG1 4.25Å; L307-V321 HydrophobicContact CD1-CG2 4.18Å; L307-V321 HydrophobicContact CD2-CG2 3.89Å; H318-V321 HydrophobicContact CB-CG2 3.93Å; V321-D378 HydrophobicContact CG2-CB 4.02Å; V321-S381 WeakPolarHBondContact O-CB 3.33Å; V321-L382 HydrophobicContact CG1-CB 4.33Å
322	K	91.5	Very high	88.9	Confident	20 Å²	20	44.3 Å²	44.3	9%	0.087	23%	0.225	C	C	.	.	S	Bend	trans	-164.8	162.5	-176.3	59.4	-173.9	178.2	-148.5	0	110.9	D320 S324 N325 I326 Y360 T385	D320-K322 WeakPolarHBondContact OD1-CE 3.33Å; D320-K322 IonicContact OD1-NZ 3.43Å; D320-K322 PolarHBondContact OD1-NZ 3.42Å; D320-K322 VanDerWaalsContact OD2-CE 3.3Å; D320-K322 WeakPolarHBondContact OD2-CE 3.12Å; D320-K322 IonicContact OD2-NZ 2.74Å; D320-K322 PolarHBondContact OD2-NZ 3.49Å; K322-S324 WeakPolarHBondContact CD-OG 3.27Å; K322-S324 WeakPolarHBondContact CE-OG 3.47Å; K322-S324 WeakPolarHBondContact CG-OG 3.32Å; K322-S324 PolarHBondContact O-N 2.88Å; K322-N325 WeakPolarHBondContact CE-OD1 3.15Å; K322-N325 HydrophobicContact CG-CB 4.25Å; K322-N325 PolarHBondContact O-N 2.59Å; K322-I326 PolarHBondContact O-N 2.97Å; K322-Y360 HydrophobicContact CB-CD1 3.94Å; K322-Y360 HydrophobicContact CB-CD2 3.89Å; K322-Y360 HydrophobicContact CB-CE1 3.89Å; K322-Y360 HydrophobicContact CB-CE2 3.86Å; K322-Y360 HydrophobicContact CB-CG 3.94Å; K322-Y360 HydrophobicContact CD-CE2 4.45Å; K322-T385 WeakPolarHBondContact CA-OG1 3.21Å
323	P	92.8	Very high	89.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-26.9	178.5	-28.2	34.1	0	0	0	115.8	F280 D281 N325 Y360 T385 E388 L389	F280-P323 CarbonylContact C-O 3.52Å; F280-P323 WeakPolarHBondContact CA-O 3.34Å; F280-P323 HydrophobicContact CB-CB 4.32Å; F280-P323 PolarHBondContact N-O 3.16Å; D281-P323 HydrophobicContact CB-CB 4.03Å; D281-P323 PolarHBondContact N-O 3.42Å; P323-N325 VanDerWaalsContact C-N 3.35Å; P323-Y360 VanDerWaalsContact CD-CE1 3.41Å; P323-Y360 WeakPolarHBondContact CD-OH 3.35Å; P323-Y360 HydrophobicContact CG-CE1 4.32Å; P323-T385 HydrophobicContact CG-CG2 4.02Å; P323-E388 WeakPolarHBondContact CG-OE2 3.4Å; P323-L389 HydrophobicContact CB-CD2 4.17Å; P323-L389 HydrophobicContact CG-CD2 4.31Å; P323-L389 HydrophobicContact CG-CG 4.35Å
324	S	88.6	Confident	89.7	Confident	39 Å²	39	36.5 Å²	36.5	27%	0.273	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-23.1	178.8	18.1	0	0	0	0	113.6	C279 K322	C279-S324 WeakPolarHBondContact CB-O 3.37Å; K322-S324 WeakPolarHBondContact CD-OG 3.27Å; K322-S324 WeakPolarHBondContact CE-OG 3.47Å; K322-S324 WeakPolarHBondContact CG-OG 3.32Å; K322-S324 PolarHBondContact O-N 2.88Å
325	N	91.9	Very high	90.4	Very high	9 Å²	9	34.7 Å²	34.7	5%	0.048	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	-2.1	-178.1	-67.3	3.4	0	0	0	112.8	D320 K322 P323 C337	D320-N325 PolarHBondContact O-ND2 2.91Å; D320-N325 PolarHBondContact OD2-ND2 2.64Å; K322-N325 WeakPolarHBondContact CE-OD1 3.15Å; K322-N325 HydrophobicContact CG-CB 4.25Å; K322-N325 PolarHBondContact O-N 2.59Å; P323-N325 VanDerWaalsContact C-N 3.35Å; N325-C337 PolarHBondContact O-N 2.86Å; N325-C337 PolarHBondContact O-SG 3.45Å; N325-C337 VanDerWaalsContact O-SG 3.33Å
326	I	95.2	Very high	91.1	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	120.8	168.9	-55.2	177.5	0	0	0	107.8	C279 F280 V299 T303 K322 I334 L336 T385	C279-I326 CarbonylContact C-O 3.59Å; C279-I326 VanDerWaalsContact CA-O 3.28Å; C279-I326 WeakPolarHBondContact CA-O 3.04Å; F280-I326 HydrophobicContact CD2-CB 4.12Å; F280-I326 HydrophobicContact CD2-CG2 3.64Å; F280-I326 HydrophobicContact CE2-CG2 3.96Å; F280-I326 PolarHBondContact N-O 3.38Å; V299-I326 HydrophobicContact CG1-CD1 3.99Å; V299-I326 HydrophobicContact CG1-CG2 4.15Å; T303-I326 HydrophobicContact CG2-CD1 4.27Å; K322-I326 PolarHBondContact O-N 2.97Å; I326-I334 HydrophobicContact CG2-CG2 3.71Å; I326-L336 HydrophobicContact CG1-CD1 4.22Å; I326-T385 HydrophobicContact CD1-CG2 3.77Å
327	L	95.3	Very high	91.4	Very high	29 Å²	29	31.3 Å²	31.3	15%	0.152	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.6	-175.6	-49.9	-166.4	0	0	0	112.1	V257 M276 M278 C279 I334 K335 C337	V257-L327 HydrophobicContact CG2-CD1 3.95Å; V257-L327 HydrophobicContact CG2-CG 4.49Å; M276-L327 HydrophobicContact CB-CB 3.76Å; M276-L327 HydrophobicContact CB-CD1 3.77Å; M276-L327 HydrophobicContact CB-CG 4.41Å; M276-L327 HydrophobicContact CE-CB 4.18Å; M276-L327 HydrophobicContact CG-CB 3.82Å; M276-L327 HydrophobicContact CG-CD1 3.76Å; M276-L327 HydrophobicContact CG-CG 4.44Å; M278-L327 CarbonylContact O-C 3.54Å; M278-L327 WeakPolarHBondContact O-CA 3.38Å; C279-L327 HydrophobicContact CB-CD2 3.39Å; L327-I334 WeakPolarHBondContact O-CA 3.44Å; L327-K335 PolarHBondContact N-O 3.17Å; L327-K335 PolarHBondContact O-N 2.95Å; L327-C337 HydrophobicContact CD1-CB 3.96Å; L327-C337 HydrophobicContact CG-CB 4.15Å
328	I	96.1	Very high	91.1	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143.6	177	-177.2	165.7	0	0	0	110.8	S277 M278 F280 L283 N333 I334 V466 W469 F470	S277-I328 WeakPolarHBondContact CB-O 3.49Å; S277-I328 PolarHBondContact N-O 2.72Å; M278-I328 HydrophobicContact CG-CG2 3.81Å; M278-I328 PolarHBondContact N-O 2.73Å; M278-I328 VanDerWaalsContact N-O 3.11Å; M278-I328 PolarHBondContact O-N 3.26Å; F280-I328 HydrophobicContact CE2-CB 3.89Å; F280-I328 HydrophobicContact CE2-CG2 4.16Å; F280-I328 HydrophobicContact CZ-CB 4.33Å; F280-I328 HydrophobicContact CZ-CD1 4.12Å; L283-I328 HydrophobicContact CD1-CG2 4.1Å; I328-N333 WeakPolarHBondContact CA-O 3.43Å; I328-I334 HydrophobicContact CD1-CG1 4.43Å; I328-I334 HydrophobicContact CG1-CG1 4.44Å; I328-V466 HydrophobicContact CD1-CG1 3.68Å; I328-W469 HydrophobicContact CD1-CE3 4.47Å; I328-W469 HydrophobicContact CD1-CZ3 3.95Å; I328-F470 HydrophobicContact CD1-CB 4.04Å; I328-F470 HydrophobicContact CD1-CD2 3.75Å; I328-F470 HydrophobicContact CD1-CE2 4.41Å; I328-F470 HydrophobicContact CD1-CG 3.93Å; I328-F470 HydrophobicContact CG1-CD2 4.14Å; I328-F470 HydrophobicContact CG1-CE2 4.39Å; I328-F470 HydrophobicContact CG1-CG 4.26Å; I328-F470 HydrophobicContact CG2-CD2 4.02Å; I328-F470 HydrophobicContact CG2-CE2 3.6Å; I328-F470 HydrophobicContact CG2-CZ 4.11Å
329	D	94.8	Very high	90.3	Very high	18 Å²	18	31.6 Å²	31.6	10%	0.096	15%	0.151	C	C	.	.			trans	-112.6	170.9	172.8	79.3	4.5	0	0	0	113.3	M276 R331 G332 N333	M276-D329 HydrophobicContact CE-CB 3.89Å; M276-D329 HydrophobicContact SD-CB 4.16Å; D329-R331 PolarHBondContact O-N 2.82Å; D329-R331 VanDerWaalsContact O-N 3.14Å; D329-R331 VanDerWaalsContact OD1-C 3.27Å; D329-R331 VanDerWaalsContact OD1-CA 3.3Å; D329-R331 WeakPolarHBondContact OD1-CA 3.5Å; D329-R331 WeakPolarHBondContact OD1-CB 3.41Å; D329-R331 PolarHBondContact OD1-N 3.44Å; D329-G332 PolarHBondContact O-N 3.39Å; D329-G332 PolarHBondContact OD1-N 3.3Å; D329-N333 PolarHBondContact N-O 3.24Å; D329-N333 VanDerWaalsContact N-O 3.15Å; D329-N333 WeakPolarHBondContact OD1-CB 3.43Å; D329-N333 PolarHBondContact OD1-N 3.44Å; D329-N333 PolarHBondContact OD1-ND2 3.11Å; D329-N333 PolarHBondContact OD2-ND2 3.31Å
330	E	92.8	Very high	89.1	Confident	93 Å²	93	28.9 Å²	28.9	44%	0.435	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-8.6	178.1	-74.5	172	-155.3	0	0	114.9	S277 F470 K474	S277-E330 PolarHBondContact OG-N 3.03Å; E330-F470 HydrophobicContact CG-CD1 4.32Å; E330-F470 HydrophobicContact CG-CE1 3.84Å; E330-K474 IonicContact OE1-NZ 2.59Å; E330-K474 PolarHBondContact OE1-NZ 3.43Å; E330-K474 IonicContact OE2-NZ 3.69Å; E330-K474 PolarHBondContact OE2-NZ 3.44Å
331	R	94.6	Very high	87.6	Confident	197 Å²	197	27.7 Å²	27.7	74%	0.743	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.4	6.9	175	-56	172.6	64.2	-171.7	1.6	111.5	D329 N333	D329-R331 PolarHBondContact O-N 2.82Å; D329-R331 VanDerWaalsContact O-N 3.14Å; D329-R331 VanDerWaalsContact OD1-C 3.27Å; D329-R331 VanDerWaalsContact OD1-CA 3.3Å; D329-R331 WeakPolarHBondContact OD1-CA 3.5Å; D329-R331 WeakPolarHBondContact OD1-CB 3.41Å; D329-R331 PolarHBondContact OD1-N 3.44Å; R331-N333 PolarHBondContact O-N 2.88Å
332	G	94.1	Very high	85.6	Confident	15 Å²	15	30.9 Å²	30.9	16%	0.155	16%	0.16	C	C	.	.			trans	72.1	12.3	-179.3	0	0	0	0	0	114.4	D329 I334	D329-G332 PolarHBondContact O-N 3.39Å; D329-G332 PolarHBondContact OD1-N 3.3Å; G332-I334 PolarHBondContact O-N 3.04Å
333	N	96.3	Very high	83.3	Confident	61 Å²	61	31 Å²	31	33%	0.326	17%	0.166	S	C	.	.			trans	-70.5	127.1	172.2	-60.3	-65	0	0	0	108.8	M276 I328 D329 R331	M276-N333 WeakPolarHBondContact CE-O 3.32Å; I328-N333 WeakPolarHBondContact CA-O 3.43Å; D329-N333 PolarHBondContact N-O 3.24Å; D329-N333 VanDerWaalsContact N-O 3.15Å; D329-N333 WeakPolarHBondContact OD1-CB 3.43Å; D329-N333 PolarHBondContact OD1-N 3.44Å; D329-N333 PolarHBondContact OD1-ND2 3.11Å; D329-N333 PolarHBondContact OD2-ND2 3.31Å; R331-N333 PolarHBondContact O-N 2.88Å
334	I	97.6	Very high	80.9	Confident	12 Å²	12	39.4 Å²	39.4	6%	0.062	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.2	173.2	-60.9	158.2	0	0	0	108	F280 K298 V299 A302 I326 L327 I328 G332 V466	F280-I334 HydrophobicContact CE2-CG1 4.34Å; F280-I334 HydrophobicContact CE2-CG2 4.15Å; F280-I334 HydrophobicContact CZ-CD1 4.47Å; F280-I334 HydrophobicContact CZ-CG1 4.43Å; K298-I334 HydrophobicContact CB-CD1 3.87Å; V299-I334 HydrophobicContact CG2-CD1 3.78Å; V299-I334 HydrophobicContact CG2-CG2 4.27Å; A302-I334 HydrophobicContact CB-CB 4.03Å; A302-I334 HydrophobicContact CB-CG2 3.98Å; I326-I334 HydrophobicContact CG2-CG2 3.71Å; L327-I334 WeakPolarHBondContact O-CA 3.44Å; I328-I334 HydrophobicContact CD1-CG1 4.43Å; I328-I334 HydrophobicContact CG1-CG1 4.44Å; G332-I334 PolarHBondContact O-N 3.04Å; I334-V466 HydrophobicContact CD1-CG1 4.24Å
335	K	95.6	Very high	78.5	Confident	16 Å²	16	41.5 Å²	41.5	7%	0.07	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.2	-175.4	-61	-177.4	179.7	177.9	0	111.8	K254 Y255 V257 E274 M276 L327	K254-K335 WeakPolarHBondContact O-CE 3.45Å; Y255-K335 CarbonylContact O-C 3.43Å; Y255-K335 VanDerWaalsContact O-CA 3.27Å; Y255-K335 WeakPolarHBondContact O-CA 3.5Å; V257-K335 HydrophobicContact CG2-CB 3.81Å; V257-K335 HydrophobicContact CG2-CD 4.41Å; E274-K335 WeakPolarHBondContact OE1-CD 3.35Å; E274-K335 IonicContact OE1-NZ 2.67Å; E274-K335 PolarHBondContact OE1-NZ 3.2Å; E274-K335 IonicContact OE2-NZ 2.7Å; E274-K335 PolarHBondContact OE2-NZ 3.04Å; M276-K335 HydrophobicContact CE-CB 4.07Å; M276-K335 HydrophobicContact CE-CD 4Å; M276-K335 HydrophobicContact CE-CG 3.97Å; M276-K335 HydrophobicContact SD-CD 3.88Å; M276-K335 HydrophobicContact SD-CG 4.5Å; L327-K335 PolarHBondContact N-O 3.17Å; L327-K335 PolarHBondContact O-N 2.95Å
336	L	93.3	Very high	75.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	146.3	170.9	-168.9	58.2	0	0	0	109.6	Y255 V257 T303 A306 L307 L310 H318 I326 F339	Y255-L336 PolarHBondContact O-N 3.28Å; V257-L336 WeakPolarHBondContact CG2-O 3.4Å; V257-L336 PolarHBondContact N-O 2.77Å; T303-L336 HydrophobicContact CG2-CD1 4.37Å; T303-L336 HydrophobicContact CG2-CD2 4.46Å; A306-L336 HydrophobicContact CB-CB 3.9Å; A306-L336 HydrophobicContact CB-CD2 3.84Å; L307-L336 HydrophobicContact CD2-CD2 3.82Å; L307-L336 HydrophobicContact CG-CD2 3.97Å; L310-L336 HydrophobicContact CD1-CD2 4.43Å; H318-L336 VanDerWaalsContact CD2-CD2 3.41Å; H318-L336 WeakPolarHBondContact CD2-CD2 3.3Å; H318-L336 WeakPolarHBondContact NE2-CG 3.48Å; I326-L336 HydrophobicContact CG1-CD1 4.22Å; L336-F339 HydrophobicContact CB-CE1 4.08Å; L336-F339 HydrophobicContact CB-CZ 4.43Å; L336-F339 HydrophobicContact CD2-CE1 4.14Å; L336-F339 HydrophobicContact CG-CE1 3.87Å; L336-F339 WeakPolarHBondContact O-CZ 3.38Å
337	C	87.4	Confident	72.8	Confident	11 Å²	11	52 Å²	52	7%	0.074	26%	0.264	C	S	.	.			trans	-138.8	176.7	174.6	77	0	0	0	0	111.5	V257 H318 N325 L327	V257-C337 HydrophobicContact CB-CB 4.07Å; V257-C337 HydrophobicContact CG2-CB 3.76Å; H318-C337 PolarHBondContact CE1-O 2.9Å; H318-C337 VanDerWaalsContact CE1-O 3.32Å; H318-C337 PolarHBondContact NE2-O 2.77Å; N325-C337 PolarHBondContact O-N 2.86Å; N325-C337 PolarHBondContact O-SG 3.45Å; N325-C337 VanDerWaalsContact O-SG 3.33Å; L327-C337 HydrophobicContact CD1-CB 3.96Å; L327-C337 HydrophobicContact CG-CB 4.15Å
338	D	74.3	Confident	70	Confident	26 Å²	26	52.8 Å²	52.8	14%	0.139	27%	0.272	C	S	.	.			trans	58.6	55.8	175.2	-92.6	16.4	0	0	0	113.9	S208 K226 H318 G340	S208-D338 PolarHBondContact OG-OD2 3.16Å; K226-D338 WeakPolarHBondContact CD-OD1 3.33Å; K226-D338 IonicContact NZ-OD1 2.62Å; K226-D338 PolarHBondContact NZ-OD1 3.12Å; K226-D338 IonicContact NZ-OD2 2.65Å; K226-D338 PolarHBondContact NZ-OD2 3.43Å; H318-D338 PolarHBondContact CE1-O 3.49Å; D338-G340 PolarHBondContact O-N 2.76Å
339	F	67.6	Low	67.2	Low	12 Å²	12	60 Å²	60	5%	0.053	30%	0.303	C	S	.	.			trans	-66.8	61.9	-177.2	-53.9	-71	0	0	0	115.1	V247 I256 L310 H318 L336 I341	V247-F339 HydrophobicContact CG2-CB 4.13Å; V247-F339 HydrophobicContact CG2-CD2 3.91Å; V247-F339 HydrophobicContact CG2-CG 4.44Å; I256-F339 HydrophobicContact CB-CZ 3.88Å; I256-F339 HydrophobicContact CD1-CE1 4.11Å; I256-F339 HydrophobicContact CD1-CZ 4.17Å; I256-F339 HydrophobicContact CG1-CE1 3.84Å; I256-F339 HydrophobicContact CG1-CZ 3.63Å; I256-F339 HydrophobicContact CG2-CE1 4.43Å; I256-F339 HydrophobicContact CG2-CE2 3.72Å; I256-F339 HydrophobicContact CG2-CZ 3.48Å; I256-F339 VanDerWaalsContact CG2-CZ 3.48Å; L310-F339 HydrophobicContact CD1-CD1 3.5Å; L310-F339 VanDerWaalsContact CD1-CD1 3.5Å; L310-F339 HydrophobicContact CD1-CE1 3.79Å; L310-F339 HydrophobicContact CD2-CD1 3.93Å; L310-F339 HydrophobicContact CD2-CE1 4.37Å; L310-F339 HydrophobicContact CD2-CG 4.4Å; L310-F339 HydrophobicContact CG-CD1 4.32Å; H318-F339 AromaticContact CD2-CD1 3.53Å; H318-F339 AromaticContact NE2-CD1 3.47Å; H318-F339 WeakPolarHBondContact NE2-CD1 3.48Å; H318-F339 AromaticContact NE2-CE1 3.9Å; L336-F339 HydrophobicContact CB-CE1 4.08Å; L336-F339 HydrophobicContact CB-CZ 4.43Å; L336-F339 HydrophobicContact CD2-CE1 4.14Å; L336-F339 HydrophobicContact CG-CE1 3.87Å; L336-F339 WeakPolarHBondContact O-CZ 3.38Å; F339-I341 VanDerWaalsContact C-N 3.25Å; F339-I341 PolarHBondContact O-N 2.84Å
340	G	57.2	Low	64.5	Low	9 Å²	9	62.3 Å²	62.3	9%	0.093	33%	0.325	C	S	.	.			trans	60.8	25.7	161.7	0	0	0	0	0	116.2	H318 D338 S342 G343	H318-G340 VanDerWaalsContact O-CA 3.32Å; H318-G340 WeakPolarHBondContact O-CA 3.35Å; D338-G340 PolarHBondContact O-N 2.76Å; G340-S342 PolarHBondContact O-N 2.88Å; G340-G343 PolarHBondContact O-N 2.7Å
341	I	51.4	Low	61.6	Low	12 Å²	12	64.2 Å²	64.2	6%	0.062	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	22.3	-176.4	-34.6	-179.3	0	0	0	113.7	M228 I240 D243 V247 I271 F339	M228-I341 HydrophobicContact CE-CB 4.29Å; M228-I341 HydrophobicContact CE-CG2 4.17Å; M228-I341 HydrophobicContact SD-CD1 4.38Å; M228-I341 HydrophobicContact SD-CG2 4.45Å; I240-I341 HydrophobicContact CB-CG2 4.49Å; I240-I341 HydrophobicContact CG2-CG2 4.12Å; D243-I341 HydrophobicContact CB-CB 4.17Å; D243-I341 HydrophobicContact CB-CG2 3.7Å; D243-I341 WeakPolarHBondContact OD2-CA 3.44Å; V247-I341 HydrophobicContact CG2-CD1 4.29Å; I271-I341 HydrophobicContact CD1-CD1 3.8Å; F339-I341 VanDerWaalsContact C-N 3.25Å; F339-I341 PolarHBondContact O-N 2.84Å
342	S	49.2	Very low	59	Low	69 Å²	69	58.9 Å²	58.9	48%	0.483	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-153.4	13.4	-179	59.6	0	0	0	0	111.3	G340 R344 L345	G340-S342 PolarHBondContact O-N 2.88Å; S342-R344 PolarHBondContact O-N 2.86Å; S342-L345 PolarHBondContact O-N 2.8Å
343	G	42.9	Very low	56.5	Low	21 Å²	21	66.3 Å²	66.3	22%	0.216	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-8.1	-171.4	0	0	0	0	0	115.3	R319 G340	R319-G343 PolarHBondContact NH1-O 3.45Å; G340-G343 PolarHBondContact O-N 2.7Å
344	R	43.1	Very low	53.6	Low	178 Å²	178	65.4 Å²	65.4	67%	0.672	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.7	52	164.7	-82.3	-173.9	173.4	165.6	-2.7	111.5	R239 S342 V346	R239-R344 PolarHBondContact NH1-O 2.69Å; S342-R344 PolarHBondContact O-N 2.86Å; R344-V346 HydrophobicContact CB-CG2 3.97Å; R344-V346 HydrophobicContact CG-CG2 4.32Å; R344-V346 PolarHBondContact O-N 2.76Å; R344-V346 VanDerWaalsContact O-N 3.11Å
345	L	39	Very low	50.6	Low	83 Å²	83	69.3 Å²	69.3	44%	0.435	38%	0.383	S	S	.	.			trans	-70.1	86.7	144.3	-108.8	168.9	0	0	0	107.1	E236 S342	E236-L345 WeakPolarHBondContact OE1-CD2 3.27Å; E236-L345 WeakPolarHBondContact OE1-CG 3.48Å; S342-L345 PolarHBondContact O-N 2.8Å
346	V	33.9	Very low	48.4	Very low	75 Å²	75	70.1 Å²	70.1	46%	0.455	40%	0.396	S	S	.	.			trans	-69.2	144.5	-171.3	175.7	0	0	0	0	110.2	R344 S348	R344-V346 HydrophobicContact CB-CG2 3.97Å; R344-V346 HydrophobicContact CG-CG2 4.32Å; R344-V346 PolarHBondContact O-N 2.76Å; R344-V346 VanDerWaalsContact O-N 3.11Å; V346-S348 PolarHBondContact O-N 3.44Å
347	D	33.6	Very low	47.1	Very low	155 Å²	155	71.6 Å²	71.6	83%	0.829	41%	0.406	S	S	*	.	S	Bend	trans	57.3	-0.8	172.3	-55.1	-22.8	0	0	0	119.2	K349	D347-K349 PolarHBondContact O-N 2.94Å
348	S	35	Very low	46.4	Very low	44 Å²	44	71.6 Å²	71.6	31%	0.308	41%	0.407	S	S	.	.			trans	-80.1	43.5	172.2	-76.2	0	0	0	0	114.8	V346 A350 N351	V346-S348 PolarHBondContact O-N 3.44Å; S348-A350 PolarHBondContact O-N 3.09Å; S348-N351 PolarHBondContact O-N 3.27Å
349	K	37.4	Very low	46.8	Very low	151 Å²	151	70.6 Å²	70.6	66%	0.657	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-19.3	164.8	-88.5	-165.2	174.2	-171.8	0	112.3	D347 I366	D347-K349 PolarHBondContact O-N 2.94Å; K349-I366 PolarHBondContact NZ-O 3.39Å
350	A	37.9	Very low	47.9	Very low	67 Å²	67	71.1 Å²	71.1	55%	0.554	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-25.1	175.7	0	0	0	0	0	115.1	S348 R353	S348-A350 PolarHBondContact O-N 3.09Å; A350-R353 VanDerWaalsContact O-CD 3.31Å; A350-R353 WeakPolarHBondContact O-CD 3.5Å; A350-R353 WeakPolarHBondContact O-CG 3.43Å
351	N	32.7	Very low	49.4	Very low	134 Å²	134	73 Å²	73	72%	0.717	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	-16.1	-159.9	-144.3	18.2	0	0	0	115.6	S348 R353	S348-N351 PolarHBondContact O-N 3.27Å; N351-R353 PolarHBondContact O-N 3.21Å; N351-R353 VanDerWaalsContact O-N 3.09Å
352	T	40.1	Very low	51.2	Low	84 Å²	84	72.4 Å²	72.4	52%	0.515	41%	0.408	S	S	.	.			trans	-83.4	35.6	171.4	-35.2	0	0	0	0	112.2	S354	T352-S354 PolarHBondContact O-N 3.33Å
353	R	40.1	Very low	53.1	Low	172 Å²	172	69.9 Å²	69.9	65%	0.649	39%	0.39	S	S	*	.			trans	-78.6	57.7	-178.6	-76.1	-179	168.5	-178.6	-4	112.4	A350 N351	A350-R353 VanDerWaalsContact O-CD 3.31Å; A350-R353 WeakPolarHBondContact O-CD 3.5Å; A350-R353 WeakPolarHBondContact O-CG 3.43Å; N351-R353 PolarHBondContact O-N 3.21Å; N351-R353 VanDerWaalsContact O-N 3.09Å
354	S	35.7	Very low	55.2	Low	42 Å²	42	69.4 Å²	69.4	29%	0.294	38%	0.382	S	S	.	.			trans	-93.5	107.1	161.8	58.9	0	0	0	0	108.6	T207 T352 G356 C357	T207-S354 WeakPolarHBondContact CG2-OG 3.41Å; T352-S354 PolarHBondContact O-N 3.33Å; S354-G356 PolarHBondContact O-N 2.89Å; S354-C357 PolarHBondContact O-N 2.81Å
355	A	35.2	Very low	57	Low	93 Å²	93	63.2 Å²	63.2	77%	0.769	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	132.2	-173.1	0	0	0	0	0	112.6	D402	A355-D402 WeakPolarHBondContact CA-OD1 3.37Å
356	G	49.7	Very low	58.9	Low	33 Å²	33	60.3 Å²	60.3	34%	0.34	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-20.9	177.3	0	0	0	0	0	115.3	S354 A358 A359 Y360 D402	S354-G356 PolarHBondContact O-N 2.89Å; G356-A358 PolarHBondContact O-N 3.46Å; G356-A359 WeakPolarHBondContact O-CB 3.4Å; G356-A359 PolarHBondContact O-N 2.82Å; G356-Y360 VanDerWaalsContact O-CE2 3.28Å; G356-Y360 WeakPolarHBondContact O-CE2 3.28Å; G356-D402 PolarHBondContact N-OD1 2.98Å
357	C	64.8	Low	60.5	Low	32 Å²	32	59 Å²	59	22%	0.216	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-66.3	-23.9	173	-161.1	0	0	0	0	112.3	S354 A359	S354-C357 PolarHBondContact O-N 2.81Å; C357-A359 VanDerWaalsContact C-N 3.3Å; C357-A359 PolarHBondContact O-N 2.73Å
358	A	73.1	Confident	61.6	Low	11 Å²	11	56.7 Å²	56.7	9%	0.091	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-64.6	-28.7	175.2	0	0	0	0	0	113.7	G356 Y360 M361 D402 L406	G356-A358 PolarHBondContact O-N 3.46Å; A358-Y360 VanDerWaalsContact C-N 3.27Å; A358-Y360 PolarHBondContact O-N 3.16Å; A358-M361 WeakPolarHBondContact O-CB 3.41Å; A358-M361 PolarHBondContact O-N 2.68Å; A358-M361 VanDerWaalsContact O-N 3.09Å; A358-D402 HydrophobicContact CB-CB 3.95Å; A358-L406 HydrophobicContact CB-CD1 4.44Å; A358-L406 HydrophobicContact CB-CD2 3.96Å; A358-L406 HydrophobicContact CB-CG 4.02Å
359	A	83.4	Confident	62.7	Low	6 Å²	6	62.3 Å²	62.3	5%	0.05	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-61.6	-32.5	-175.6	0	0	0	0	0	113.8	G356 C357 M361 Y396 V405	G356-A359 WeakPolarHBondContact O-CB 3.4Å; G356-A359 PolarHBondContact O-N 2.82Å; C357-A359 VanDerWaalsContact C-N 3.3Å; C357-A359 PolarHBondContact O-N 2.73Å; A359-M361 VanDerWaalsContact C-N 3.34Å; A359-Y396 HydrophobicContact CB-CD2 4.09Å; A359-V405 HydrophobicContact CB-CG1 3.89Å
360	Y	90.4	Very high	63.6	Low	23 Å²	23	59.8 Å²	59.8	9%	0.09	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-85.7	-5.1	-179.6	-44.9	-85.5	0	0	0	112.8	K322 P323 G356 A358 A362 S381 I384 E388	K322-Y360 HydrophobicContact CB-CD1 3.94Å; K322-Y360 HydrophobicContact CB-CD2 3.89Å; K322-Y360 HydrophobicContact CB-CE1 3.89Å; K322-Y360 HydrophobicContact CB-CE2 3.86Å; K322-Y360 HydrophobicContact CB-CG 3.94Å; K322-Y360 HydrophobicContact CD-CE2 4.45Å; P323-Y360 VanDerWaalsContact CD-CE1 3.41Å; P323-Y360 WeakPolarHBondContact CD-OH 3.35Å; P323-Y360 HydrophobicContact CG-CE1 4.32Å; G356-Y360 VanDerWaalsContact O-CE2 3.28Å; G356-Y360 WeakPolarHBondContact O-CE2 3.28Å; A358-Y360 VanDerWaalsContact C-N 3.27Å; A358-Y360 PolarHBondContact O-N 3.16Å; Y360-A362 PolarHBondContact O-N 3.27Å; Y360-S381 WeakPolarHBondContact O-CA 3.42Å; Y360-S381 WeakPolarHBondContact O-CB 3.37Å; Y360-S381 PolarHBondContact O-OG 2.93Å; Y360-I384 HydrophobicContact CD1-CB 4.16Å; Y360-I384 HydrophobicContact CD1-CG2 3.67Å; Y360-I384 HydrophobicContact CE1-CG2 4.05Å; Y360-I384 HydrophobicContact CG-CG2 4.45Å; Y360-E388 VanDerWaalsContact CE1-OE2 3.28Å; Y360-E388 WeakPolarHBondContact CE1-OE2 3.45Å; Y360-E388 PolarHBondContact OH-OE2 3.42Å
361	M	89.3	Confident	64.4	Low	47 Å²	47	62 Å²	62	23%	0.232	34%	0.344	C	S	.	.			trans	-71.6	128.7	-179	-68.1	-172.6	61.9	0	0	111	A358 A359 R365 I366 W380 L406 V409	A358-M361 WeakPolarHBondContact O-CB 3.41Å; A358-M361 PolarHBondContact O-N 2.68Å; A358-M361 VanDerWaalsContact O-N 3.09Å; A359-M361 VanDerWaalsContact C-N 3.34Å; M361-R365 HydrophobicContact CE-CB 3.87Å; M361-I366 HydrophobicContact CB-CD1 4.48Å; M361-I366 HydrophobicContact CB-CG1 4.27Å; M361-I366 HydrophobicContact CE-CG1 4.5Å; M361-W380 PolarHBondContact O-NE1 3.07Å; M361-L406 HydrophobicContact CB-CD2 4.49Å; M361-L406 HydrophobicContact SD-CD2 4.29Å; M361-V409 WeakPolarHBondContact O-CG1 3.34Å
362	A	89.6	Confident	65.9	Low	0 Å²	0	64.6 Å²	64.6	0%	0	35%	0.349	C	S	.	.			trans	-68.5	146.8	174.3	0	0	0	0	0	111.9	Y360 E364 R365 A377 W380	Y360-A362 PolarHBondContact O-N 3.27Å; A362-E364 WeakPolarHBondContact CB-OE1 3.47Å; A362-E364 WeakPolarHBondContact CB-OE2 3.36Å; A362-E364 PolarHBondContact O-N 3.43Å; A362-E364 VanDerWaalsContact O-N 3.11Å; A362-R365 WeakPolarHBondContact O-CB 3.37Å; A362-R365 PolarHBondContact O-N 2.96Å; A362-A377 HydrophobicContact CB-CB 3.98Å; A362-W380 VanDerWaalsContact CA-CD1 3.43Å; A362-W380 HydrophobicContact CB-CB 3.71Å; A362-W380 HydrophobicContact CB-CD2 4.48Å; A362-W380 HydrophobicContact CB-CG 3.75Å
363	P	88.7	Confident	67.4	Low	16 Å²	16	64.1 Å²	64.1	10%	0.104	34%	0.338	C	S	.	.	H	α-helix	trans	-48.7	-42.1	-178.1	-29.1	33.6	0	0	0	114.1	R365 I366 D367 W380 V409 L410 K439	P363-R365 PolarHBondContact O-N 3Å; P363-I366 WeakPolarHBondContact O-CB 3.49Å; P363-I366 PolarHBondContact O-N 3.22Å; P363-D367 PolarHBondContact O-N 3.22Å; P363-W380 HydrophobicContact CG-CE3 4.39Å; P363-W380 HydrophobicContact CG-CH2 3.93Å; P363-W380 HydrophobicContact CG-CZ2 4.12Å; P363-W380 HydrophobicContact CG-CZ3 4.07Å; P363-V409 HydrophobicContact CB-CG1 4.44Å; P363-V409 HydrophobicContact CG-CG1 3.84Å; P363-L410 HydrophobicContact CB-CD2 4.2Å; P363-K439 HydrophobicContact CG-CG 4.36Å
364	E	86.2	Confident	69.5	Low	12 Å²	12	58.2 Å²	58.2	6%	0.056	32%	0.32	C	S	.	.	H	α-helix	trans	-71	-9.2	-179.7	73.3	-76.2	177.4	0	0	115.1	A362 A377 H441 R444	A362-E364 WeakPolarHBondContact CB-OE1 3.47Å; A362-E364 WeakPolarHBondContact CB-OE2 3.36Å; A362-E364 PolarHBondContact O-N 3.43Å; A362-E364 VanDerWaalsContact O-N 3.11Å; E364-A377 WeakPolarHBondContact OE1-CA 3.45Å; E364-H441 HydrophobicContact CB-CB 4.27Å; E364-H441 HydrophobicContact CG-CB 3.81Å; E364-R444 IonicContact OE1-CZ 2.68Å; E364-R444 IonicContact OE1-NH1 2.73Å; E364-R444 PolarHBondContact OE1-NH1 2.87Å; E364-R444 IonicContact OE1-NH2 2.69Å; E364-R444 IonicContact OE2-CZ 2.7Å; E364-R444 IonicContact OE2-NH1 2.73Å; E364-R444 PolarHBondContact OE2-NH1 3.09Å; E364-R444 IonicContact OE2-NH2 2.72Å; E364-R444 PolarHBondContact OE2-NH2 3.39Å
365	R	81.1	Confident	72	Confident	48 Å²	48	57.1 Å²	57.1	18%	0.181	31%	0.31	C	S	.	.	H	α-helix	trans	-88.4	-17	169	-72.6	173.3	59.1	-178.9	4.2	112.8	R319 M361 A362 P363 Y373 A377	R319-R365 VanDerWaalsContact O-CZ 3.29Å; R319-R365 PolarHBondContact O-NH1 3.35Å; R319-R365 PolarHBondContact O-NH2 2.89Å; M361-R365 HydrophobicContact CE-CB 3.87Å; A362-R365 WeakPolarHBondContact O-CB 3.37Å; A362-R365 PolarHBondContact O-N 2.96Å; P363-R365 PolarHBondContact O-N 3Å; R365-Y373 HydrophobicContact CG-CD1 3.77Å; R365-Y373 HydrophobicContact CG-CD2 4.21Å; R365-Y373 HydrophobicContact CG-CE1 4.33Å; R365-Y373 HydrophobicContact CG-CG 3.7Å; R365-A377 HydrophobicContact CG-CB 4.14Å
366	I	78.4	Confident	74.7	Confident	21 Å²	21	53.5 Å²	53.5	11%	0.108	28%	0.277	C	S	.	.	H	α-helix	trans	-89.6	-54	-175.3	-50.3	174.4	0	0	0	109.4	K349 M361 P363 P368 L406 V409 L410	K349-I366 PolarHBondContact NZ-O 3.39Å; M361-I366 HydrophobicContact CB-CD1 4.48Å; M361-I366 HydrophobicContact CB-CG1 4.27Å; M361-I366 HydrophobicContact CE-CG1 4.5Å; P363-I366 WeakPolarHBondContact O-CB 3.49Å; P363-I366 PolarHBondContact O-N 3.22Å; I366-P368 WeakPolarHBondContact O-CD 3.48Å; I366-L406 HydrophobicContact CD1-CB 4.31Å; I366-L406 HydrophobicContact CD1-CD2 3.47Å; I366-L406 VanDerWaalsContact CD1-CD2 3.47Å; I366-L406 HydrophobicContact CD1-CG 4.5Å; I366-L406 HydrophobicContact CG1-CD2 3.73Å; I366-L406 HydrophobicContact CG2-CB 4.21Å; I366-L406 HydrophobicContact CG2-CD2 4.1Å; I366-V409 HydrophobicContact CD1-CB 3.86Å; I366-V409 HydrophobicContact CD1-CG1 3.48Å; I366-V409 VanDerWaalsContact CD1-CG1 3.48Å; I366-L410 HydrophobicContact CB-CD1 4.34Å; I366-L410 HydrophobicContact CB-CD2 4.18Å; I366-L410 HydrophobicContact CB-CG 4.33Å; I366-L410 HydrophobicContact CD1-CG 4.34Å; I366-L410 HydrophobicContact CG2-CD1 3.77Å; I366-L410 HydrophobicContact CG2-CG 4.18Å
367	D	68.9	Low	76.7	Confident	47 Å²	47	52 Å²	52	25%	0.251	26%	0.26	S	S	.	.			trans	-62.2	115.7	-178.9	-178.1	4	0	0	0	111.9	P363 K369 K370	P363-D367 PolarHBondContact O-N 3.22Å; D367-K369 PolarHBondContact O-N 2.81Å; D367-K369 VanDerWaalsContact O-N 3.13Å; D367-K369 VanDerWaalsContact OD1-CB 3.32Å; D367-K369 WeakPolarHBondContact OD1-CB 3.3Å; D367-K369 WeakPolarHBondContact OD1-CD 3.39Å; D367-K369 WeakPolarHBondContact OD1-CG 3.46Å; D367-K369 PolarHBondContact OD1-N 2.63Å; D367-K370 PolarHBondContact O-N 3.47Å
368	P	56.4	Low	78	Confident	108 Å²	108	50.4 Å²	50.4	70%	0.701	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.4	179.1	28	-35.9	0	0	0	114	I366 K370	I366-P368 WeakPolarHBondContact O-CD 3.48Å; P368-K370 PolarHBondContact O-N 2.95Å
369	K	57.3	Low	79.1	Confident	162 Å²	162	50 Å²	50	70%	0.704	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.3	179.7	-61.2	166.2	-168.7	164.3	0	113.6	D367	D367-K369 PolarHBondContact O-N 2.81Å; D367-K369 VanDerWaalsContact O-N 3.13Å; D367-K369 VanDerWaalsContact OD1-CB 3.32Å; D367-K369 WeakPolarHBondContact OD1-CB 3.3Å; D367-K369 WeakPolarHBondContact OD1-CD 3.39Å; D367-K369 WeakPolarHBondContact OD1-CG 3.46Å; D367-K369 PolarHBondContact OD1-N 2.63Å
370	K	56.8	Low	79.7	Confident	98 Å²	98	49.7 Å²	49.7	43%	0.426	24%	0.244	S	C	.	.			trans	-124.1	75.5	-178	-68.6	-174.9	175.2	-174.8	0	111.9	D367 P368 K372 H441	D367-K370 PolarHBondContact O-N 3.47Å; P368-K370 PolarHBondContact O-N 2.95Å; K370-K372 PolarHBondContact O-N 3.33Å; K370-H441 PolarHBondContact NZ-NE2 3.08Å; K370-H441 VanDerWaalsContact NZ-NE2 3.12Å
371	P	54.2	Low	79.9	Confident	112 Å²	112	48.6 Å²	48.6	73%	0.727	24%	0.24	S	C	*	.			trans	-69.5	1.6	-174	28.8	-37	0	0	0	115.7
372	K	64	Low	80.3	Confident	189 Å²	189	46.4 Å²	46.4	82%	0.822	23%	0.229	S	C	*	.			trans	-121.4	104.3	177.4	-69	-177.8	-179.6	177	0	110.2	K370	K370-K372 PolarHBondContact O-N 3.33Å
373	Y	71.6	Confident	80.7	Confident	75 Å²	75	46.4 Å²	46.4	29%	0.294	23%	0.229	S	C	.	.			trans	-97.4	162.5	164.4	60.4	-91	0	0	0	110.3	R319 R365 A377	R319-Y373 WeakPolarHBondContact CD-OH 3.43Å; R319-Y373 HydrophobicContact CG-CE2 4.07Å; R319-Y373 PolarHBondContact NH1-OH 3.05Å; R365-Y373 HydrophobicContact CG-CD1 3.77Å; R365-Y373 HydrophobicContact CG-CD2 4.21Å; R365-Y373 HydrophobicContact CG-CE1 4.33Å; R365-Y373 HydrophobicContact CG-CG 3.7Å; Y373-A377 HydrophobicContact CD2-CB 4.24Å
374	D	84.1	Confident	81.1	Confident	48 Å²	48	45.7 Å²	45.7	26%	0.257	22%	0.224	S	C	.	.			trans	-130.1	-166.9	174.5	67.8	43.7	0	0	0	111.5	R376 A377	D374-R376 PolarHBondContact O-N 2.64Å; D374-R376 VanDerWaalsContact OD1-CB 3.27Å; D374-R376 WeakPolarHBondContact OD1-CB 3.21Å; D374-R376 WeakPolarHBondContact OD1-CG 3.4Å; D374-R376 IonicContact OD1-CZ 3.88Å; D374-R376 PolarHBondContact OD1-N 2.74Å; D374-R376 IonicContact OD1-NE 2.95Å; D374-R376 PolarHBondContact OD1-NE 2.93Å; D374-R376 IonicContact OD1-NH2 3.95Å; D374-R376 IonicContact OD2-CZ 3.32Å; D374-R376 IonicContact OD2-NE 3.15Å; D374-R376 PolarHBondContact OD2-NE 3.27Å; D374-R376 VanDerWaalsContact OD2-NE 3.15Å; D374-R376 IonicContact OD2-NH2 2.71Å; D374-R376 PolarHBondContact OD2-NH2 2.96Å; D374-A377 WeakPolarHBondContact O-CB 3.36Å; D374-A377 PolarHBondContact O-N 3.13Å
375	I	88.4	Confident	81.6	Confident	18 Å²	18	45.1 Å²	45.1	9%	0.092	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-24	178.6	54.7	171.9	0	0	0	114.8	K311 I317 A377 D378 V379 K446 Y447	K311-I375 HydrophobicContact CB-CG2 4.13Å; K311-I375 HydrophobicContact CD-CG2 3.92Å; K311-I375 HydrophobicContact CG-CD1 4.24Å; K311-I375 HydrophobicContact CG-CG2 3.91Å; I317-I375 HydrophobicContact CD1-CG2 4.3Å; I317-I375 HydrophobicContact CG1-CG2 3.88Å; I317-I375 HydrophobicContact CG2-CG2 4.46Å; I375-A377 PolarHBondContact O-N 2.99Å; I375-D378 WeakPolarHBondContact O-CB 3.3Å; I375-D378 PolarHBondContact O-N 2.89Å; I375-V379 PolarHBondContact O-N 3.25Å; I375-K446 HydrophobicContact CD1-CB 4.06Å; I375-K446 HydrophobicContact CD1-CD 4.33Å; I375-K446 HydrophobicContact CD1-CG 3.98Å; I375-K446 HydrophobicContact CG1-CG 4.38Å; I375-Y447 HydrophobicContact CB-CD2 4.44Å; I375-Y447 HydrophobicContact CB-CE1 4.45Å; I375-Y447 HydrophobicContact CB-CE2 3.65Å; I375-Y447 HydrophobicContact CD1-CD2 3.89Å; I375-Y447 HydrophobicContact CD1-CE2 3.95Å; I375-Y447 HydrophobicContact CD1-CG 4.47Å; I375-Y447 HydrophobicContact CG1-CE2 4.38Å; I375-Y447 HydrophobicContact CG2-CE2 3.63Å
376	R	92.7	Very high	82.3	Confident	18 Å²	18	42.8 Å²	42.8	7%	0.068	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-18.3	178	-66.7	173.4	-73.6	176.3	10.7	112.2	D374 V379 W380 H441 Q442 R444 K446	D374-R376 PolarHBondContact O-N 2.64Å; D374-R376 VanDerWaalsContact OD1-CB 3.27Å; D374-R376 WeakPolarHBondContact OD1-CB 3.21Å; D374-R376 WeakPolarHBondContact OD1-CG 3.4Å; D374-R376 IonicContact OD1-CZ 3.88Å; D374-R376 PolarHBondContact OD1-N 2.74Å; D374-R376 IonicContact OD1-NE 2.95Å; D374-R376 PolarHBondContact OD1-NE 2.93Å; D374-R376 IonicContact OD1-NH2 3.95Å; D374-R376 IonicContact OD2-CZ 3.32Å; D374-R376 IonicContact OD2-NE 3.15Å; D374-R376 PolarHBondContact OD2-NE 3.27Å; D374-R376 VanDerWaalsContact OD2-NE 3.15Å; D374-R376 IonicContact OD2-NH2 2.71Å; D374-R376 PolarHBondContact OD2-NH2 2.96Å; R376-V379 WeakPolarHBondContact O-CB 3.43Å; R376-V379 PolarHBondContact O-N 3.49Å; R376-W380 PolarHBondContact O-N 3.12Å; R376-H441 VanDerWaalsContact CD-O 3.23Å; R376-H441 WeakPolarHBondContact CD-O 3.36Å; R376-H441 PolarHBondContact NE-O 2.98Å; R376-H441 PolarHBondContact NH1-O 3.47Å; R376-Q442 PolarHBondContact NH1-O 2.83Å; R376-Q442 VanDerWaalsContact NH1-O 3.08Å; R376-Q442 VanDerWaalsContact NH1-OE1 3.1Å; R376-R444 WeakPolarHBondContact CD-O 3.43Å; R376-R444 VanDerWaalsContact O-CD 3.23Å; R376-R444 WeakPolarHBondContact O-CD 3.33Å; R376-R444 PolarHBondContact O-NH1 3.49Å; R376-K446 HydrophobicContact CG-CG 3.86Å
377	A	90.8	Very high	83.2	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-65.6	-40.7	169.4	0	0	0	0	0	112.4	A362 E364 R365 Y373 D374 I375 V379 W380 S381	A362-A377 HydrophobicContact CB-CB 3.98Å; E364-A377 WeakPolarHBondContact OE1-CA 3.45Å; R365-A377 HydrophobicContact CG-CB 4.14Å; Y373-A377 HydrophobicContact CD2-CB 4.24Å; D374-A377 WeakPolarHBondContact O-CB 3.36Å; D374-A377 PolarHBondContact O-N 3.13Å; I375-A377 PolarHBondContact O-N 2.99Å; A377-V379 VanDerWaalsContact C-N 3.28Å; A377-V379 PolarHBondContact O-N 3.42Å; A377-W380 PolarHBondContact O-N 3.06Å; A377-S381 PolarHBondContact O-N 3.32Å; A377-S381 VanDerWaalsContact O-N 3.12Å; A377-S381 PolarHBondContact O-OG 2.96Å; A377-S381 VanDerWaalsContact O-OG 3.07Å
378	D	92.3	Very high	84.4	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69.4	-29.4	177	-65.5	-17	0	0	0	111.3	L307 I317 H318 R319 V321 I375 S381 L382 Y447	L307-D378 HydrophobicContact CD1-CB 4.46Å; L307-D378 HydrophobicContact CD2-CB 4.4Å; I317-D378 WeakPolarHBondContact CG2-OD2 3.44Å; H318-D378 WeakPolarHBondContact CA-OD2 3.31Å; H318-D378 WeakPolarHBondContact CB-OD2 3.47Å; H318-D378 PolarHBondContact N-OD2 3.47Å; R319-D378 WeakPolarHBondContact CA-OD1 3.32Å; R319-D378 PolarHBondContact N-OD1 2.89Å; R319-D378 PolarHBondContact N-OD2 3.27Å; V321-D378 HydrophobicContact CG2-CB 4.02Å; I375-D378 WeakPolarHBondContact O-CB 3.3Å; I375-D378 PolarHBondContact O-N 2.89Å; D378-S381 PolarHBondContact O-N 3.48Å; D378-L382 WeakPolarHBondContact O-CB 3.21Å; D378-L382 PolarHBondContact O-N 3.23Å; D378-Y447 WeakPolarHBondContact CB-OH 3.44Å; D378-Y447 PolarHBondContact OD2-OH 3.44Å
379	V	96.9	Very high	86.3	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-63.5	-41.6	172.5	171.3	0	0	0	0	111.9	I375 R376 A377 L382 G383 C436 R444 Y447 L450	I375-V379 PolarHBondContact O-N 3.25Å; R376-V379 WeakPolarHBondContact O-CB 3.43Å; R376-V379 PolarHBondContact O-N 3.49Å; A377-V379 VanDerWaalsContact C-N 3.28Å; A377-V379 PolarHBondContact O-N 3.42Å; V379-L382 PolarHBondContact O-N 2.93Å; V379-G383 PolarHBondContact O-N 2.81Å; V379-C436 HydrophobicContact CG1-CB 4.09Å; V379-R444 HydrophobicContact CG1-CG 4.02Å; V379-Y447 HydrophobicContact CG2-CD1 3.93Å; V379-Y447 HydrophobicContact CG2-CE1 3.65Å; V379-L450 HydrophobicContact CB-CD1 4.26Å; V379-L450 HydrophobicContact CG1-CD1 3.75Å; V379-L450 HydrophobicContact CG2-CD1 3.57Å
380	W	96.3	Very high	88.1	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.3	-46.2	171.9	173.1	-78.5	0	0	0	111.3	M361 A362 P363 R376 A377 L382 G383 I384 V409 P414 C436 L437 K439	M361-W380 PolarHBondContact O-NE1 3.07Å; A362-W380 VanDerWaalsContact CA-CD1 3.43Å; A362-W380 HydrophobicContact CB-CB 3.71Å; A362-W380 HydrophobicContact CB-CD2 4.48Å; A362-W380 HydrophobicContact CB-CG 3.75Å; P363-W380 HydrophobicContact CG-CE3 4.39Å; P363-W380 HydrophobicContact CG-CH2 3.93Å; P363-W380 HydrophobicContact CG-CZ2 4.12Å; P363-W380 HydrophobicContact CG-CZ3 4.07Å; R376-W380 PolarHBondContact O-N 3.12Å; A377-W380 PolarHBondContact O-N 3.06Å; W380-L382 VanDerWaalsContact C-N 3.27Å; W380-L382 PolarHBondContact O-N 3.08Å; W380-G383 WeakPolarHBondContact O-CA 3.24Å; W380-G383 PolarHBondContact O-N 2.95Å; W380-I384 HydrophobicContact CZ2-CD1 4.24Å; W380-I384 PolarHBondContact O-N 3.4Å; W380-V409 HydrophobicContact CZ2-CG1 3.95Å; W380-P414 HydrophobicContact CH2-CB 4.02Å; W380-P414 HydrophobicContact CZ3-CB 4.25Å; W380-C436 WeakPolarHBondContact CA-O 3.47Å; W380-L437 HydrophobicContact CD2-CD2 3.73Å; W380-L437 HydrophobicContact CE3-CB 4.43Å; W380-L437 HydrophobicContact CE3-CD2 3.88Å; W380-L437 HydrophobicContact CG-CD2 4.11Å; W380-L437 HydrophobicContact CZ2-CD2 4.39Å; W380-L437 HydrophobicContact CZ3-CB 4.32Å; W380-L437 HydrophobicContact CZ3-CD2 4.28Å; W380-L437 VanDerWaalsContact CZ3-O 3.27Å; W380-L437 WeakPolarHBondContact CZ3-O 3.23Å; W380-L437 WeakPolarHBondContact O-CD2 3.28Å; W380-K439 HydrophobicContact CH2-CG 4.03Å; W380-K439 HydrophobicContact CZ3-CG 3.95Å
381	S	94.9	Very high	89.8	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-58.2	-38	177.7	-55.7	0	0	0	0	112.4	V321 Y360 A377 D378 T385	V321-S381 WeakPolarHBondContact O-CB 3.33Å; Y360-S381 WeakPolarHBondContact O-CA 3.42Å; Y360-S381 WeakPolarHBondContact O-CB 3.37Å; Y360-S381 PolarHBondContact O-OG 2.93Å; A377-S381 PolarHBondContact O-N 3.32Å; A377-S381 VanDerWaalsContact O-N 3.12Å; A377-S381 PolarHBondContact O-OG 2.96Å; A377-S381 VanDerWaalsContact O-OG 3.07Å; D378-S381 PolarHBondContact O-N 3.48Å; S381-T385 WeakPolarHBondContact O-CB 3.14Å; S381-T385 PolarHBondContact O-N 2.86Å; S381-T385 PolarHBondContact O-OG1 3.15Å
382	L	97.3	Very high	91.6	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-43.4	169.5	174.6	63	0	0	0	112.1	T303 V304 V321 D378 V379 W380 I384 T385 L386 F432	T303-L382 HydrophobicContact CG2-CD1 4.02Å; V304-L382 HydrophobicContact CG2-CD2 3.41Å; V304-L382 VanDerWaalsContact CG2-CD2 3.41Å; V321-L382 HydrophobicContact CG1-CB 4.33Å; D378-L382 WeakPolarHBondContact O-CB 3.21Å; D378-L382 PolarHBondContact O-N 3.23Å; V379-L382 PolarHBondContact O-N 2.93Å; W380-L382 VanDerWaalsContact C-N 3.27Å; W380-L382 PolarHBondContact O-N 3.08Å; L382-I384 PolarHBondContact O-N 3.19Å; L382-T385 WeakPolarHBondContact O-CB 3.3Å; L382-T385 PolarHBondContact O-N 3.35Å; L382-L386 HydrophobicContact CD1-CD1 4Å; L382-L386 HydrophobicContact CD1-CG 4.03Å; L382-L386 HydrophobicContact CG-CD1 4Å; L382-L386 HydrophobicContact CG-CG 4.43Å; L382-L386 WeakPolarHBondContact O-CG 3.28Å; L382-L386 PolarHBondContact O-N 2.85Å; L382-F432 HydrophobicContact CD2-CE1 4.48Å
383	G	97.5	Very high	92.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-56.1	-48.9	175.4	0	0	0	0	0	112.8	V379 W380 T385 L386 V387	V379-G383 PolarHBondContact O-N 2.81Å; W380-G383 WeakPolarHBondContact O-CA 3.24Å; W380-G383 PolarHBondContact O-N 2.95Å; G383-T385 PolarHBondContact O-N 2.95Å; G383-L386 PolarHBondContact O-N 2.74Å; G383-V387 PolarHBondContact O-N 2.9Å; G383-V387 VanDerWaalsContact O-N 3.1Å
384	I	96.6	Very high	93.6	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.1	-45.3	176.6	-61.3	-58.6	0	0	0	110.5	Y360 W380 L382 L386 V387 E388 P395 Y396 P415 L437	Y360-I384 HydrophobicContact CD1-CB 4.16Å; Y360-I384 HydrophobicContact CD1-CG2 3.67Å; Y360-I384 HydrophobicContact CE1-CG2 4.05Å; Y360-I384 HydrophobicContact CG-CG2 4.45Å; W380-I384 HydrophobicContact CZ2-CD1 4.24Å; W380-I384 PolarHBondContact O-N 3.4Å; L382-I384 PolarHBondContact O-N 3.19Å; I384-L386 VanDerWaalsContact C-N 3.28Å; I384-L386 PolarHBondContact O-N 2.88Å; I384-V387 PolarHBondContact O-N 2.9Å; I384-E388 PolarHBondContact O-N 3.07Å; I384-P395 HydrophobicContact CG2-CG 4.17Å; I384-Y396 HydrophobicContact CD1-CE2 3.92Å; I384-P415 HydrophobicContact CD1-CG 3.63Å; I384-L437 HydrophobicContact CD1-CD1 4.23Å; I384-L437 HydrophobicContact CD1-CD2 3.6Å; I384-L437 HydrophobicContact CG1-CD2 3.84Å
385	T	96.5	Very high	93.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-56.3	-40.4	176	-61.8	0	0	0	0	112.2	K322 P323 I326 S381 L382 G383 L389	K322-T385 WeakPolarHBondContact CA-OG1 3.21Å; P323-T385 HydrophobicContact CG-CG2 4.02Å; I326-T385 HydrophobicContact CD1-CG2 3.77Å; S381-T385 WeakPolarHBondContact O-CB 3.14Å; S381-T385 PolarHBondContact O-N 2.86Å; S381-T385 PolarHBondContact O-OG1 3.15Å; L382-T385 WeakPolarHBondContact O-CB 3.3Å; L382-T385 PolarHBondContact O-N 3.35Å; G383-T385 PolarHBondContact O-N 2.95Å; T385-L389 HydrophobicContact CG2-CD1 3.95Å; T385-L389 WeakPolarHBondContact O-CB 3.45Å; T385-L389 VanDerWaalsContact O-CG 3.26Å; T385-L389 WeakPolarHBondContact O-CG 3.47Å; T385-L389 PolarHBondContact O-N 2.81Å; T385-L389 VanDerWaalsContact O-N 3.09Å
386	L	97.5	Very high	93.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-73.2	-38.5	-179.8	-70.3	171.1	0	0	0	112.6	L296 T300 L382 G383 I384 A390 F429 F432 V433	L296-L386 HydrophobicContact CB-CD2 4.42Å; L296-L386 HydrophobicContact CD2-CD2 4.4Å; T300-L386 HydrophobicContact CG2-CD1 4.38Å; T300-L386 VanDerWaalsContact OG1-CD2 3.31Å; T300-L386 WeakPolarHBondContact OG1-CD2 3.47Å; L382-L386 HydrophobicContact CD1-CD1 4Å; L382-L386 HydrophobicContact CD1-CG 4.03Å; L382-L386 HydrophobicContact CG-CD1 4Å; L382-L386 HydrophobicContact CG-CG 4.43Å; L382-L386 WeakPolarHBondContact O-CG 3.28Å; L382-L386 PolarHBondContact O-N 2.85Å; G383-L386 PolarHBondContact O-N 2.74Å; I384-L386 VanDerWaalsContact C-N 3.28Å; I384-L386 PolarHBondContact O-N 2.88Å; L386-A390 WeakPolarHBondContact O-CB 3.44Å; L386-A390 PolarHBondContact O-N 3.43Å; L386-F429 HydrophobicContact CB-CE2 4.24Å; L386-F429 HydrophobicContact CB-CZ 4.41Å; L386-F429 HydrophobicContact CD1-CE2 4.44Å; L386-F429 HydrophobicContact CD2-CE2 4.49Å; L386-F432 HydrophobicContact CD1-CD1 4.03Å; L386-F432 HydrophobicContact CD1-CE1 3.75Å; L386-V433 HydrophobicContact CB-CG2 4.1Å; L386-V433 HydrophobicContact CD1-CG2 4.43Å
387	V	96.1	Very high	93.1	Very high	4 Å²	4	18 Å²	18	2%	0.024	9%	0.093	C	C	.	.	H	α-helix	trans	-63.4	-43.8	173.4	179.7	0	0	0	0	110.8	G383 I384 A390 T391 P395 L417 V433 L437	G383-V387 PolarHBondContact O-N 2.9Å; G383-V387 VanDerWaalsContact O-N 3.1Å; I384-V387 PolarHBondContact O-N 2.9Å; V387-A390 PolarHBondContact O-N 2.92Å; V387-T391 HydrophobicContact CG1-CG2 4.34Å; V387-T391 WeakPolarHBondContact O-CB 3.32Å; V387-T391 WeakPolarHBondContact O-CG2 3.29Å; V387-T391 PolarHBondContact O-N 2.7Å; V387-T391 PolarHBondContact O-OG1 2.96Å; V387-P395 HydrophobicContact CB-CG 3.98Å; V387-P395 HydrophobicContact CG1-CB 4.25Å; V387-P395 HydrophobicContact CG1-CG 3.84Å; V387-L417 HydrophobicContact CB-CD2 4.42Å; V387-L417 HydrophobicContact CG2-CD2 4.16Å; V387-V433 HydrophobicContact CG2-CG1 3.53Å; V387-L437 HydrophobicContact CG2-CD1 3.92Å
388	E	95.3	Very high	92.6	Very high	23 Å²	23	21.3 Å²	21.3	11%	0.107	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-48.4	179.6	-175.2	-178.6	175.8	0	0	112.1	L284 P323 Y360 I384 A390 T391 A392 R393 P395	L284-E388 HydrophobicContact CD2-CG 3.97Å; P323-E388 WeakPolarHBondContact CG-OE2 3.4Å; Y360-E388 VanDerWaalsContact CE1-OE2 3.28Å; Y360-E388 WeakPolarHBondContact CE1-OE2 3.45Å; Y360-E388 PolarHBondContact OH-OE2 3.42Å; I384-E388 PolarHBondContact O-N 3.07Å; E388-A390 PolarHBondContact O-N 3.48Å; E388-T391 PolarHBondContact O-N 3.37Å; E388-A392 VanDerWaalsContact O-CA 3.28Å; E388-A392 WeakPolarHBondContact O-CA 3.29Å; E388-A392 PolarHBondContact O-N 2.9Å; E388-R393 WeakPolarHBondContact CA-O 3.5Å; E388-R393 PolarHBondContact O-N 3.35Å; E388-P395 HydrophobicContact CB-CG 4.31Å
389	L	95.7	Very high	92.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-69.6	-32.7	179.6	-64.1	174.4	0	0	0	112.7	F280 L284 V291 L296 P323 T385	F280-L389 HydrophobicContact CB-CD1 4.1Å; F280-L389 HydrophobicContact CB-CD2 3.92Å; F280-L389 HydrophobicContact CD1-CD1 4.11Å; F280-L389 HydrophobicContact CD1-CD2 4.23Å; F280-L389 HydrophobicContact CG-CD1 4.25Å; L284-L389 HydrophobicContact CD1-CD2 3.99Å; L284-L389 HydrophobicContact CD2-CD2 4.16Å; L284-L389 HydrophobicContact CG-CD2 4.47Å; V291-L389 HydrophobicContact CB-CB 4.36Å; V291-L389 WeakPolarHBondContact CB-O 3.49Å; V291-L389 HydrophobicContact CG2-CB 4.19Å; V291-L389 HydrophobicContact CG2-CD2 4.29Å; V291-L389 PolarHBondContact N-O 3.26Å; L296-L389 HydrophobicContact CD2-CB 3.6Å; L296-L389 HydrophobicContact CD2-CD1 4.23Å; P323-L389 HydrophobicContact CB-CD2 4.17Å; P323-L389 HydrophobicContact CG-CD2 4.31Å; P323-L389 HydrophobicContact CG-CG 4.35Å; T385-L389 HydrophobicContact CG2-CD1 3.95Å; T385-L389 WeakPolarHBondContact O-CB 3.45Å; T385-L389 VanDerWaalsContact O-CG 3.26Å; T385-L389 WeakPolarHBondContact O-CG 3.47Å; T385-L389 PolarHBondContact O-N 2.81Å; T385-L389 VanDerWaalsContact O-N 3.09Å
390	A	95.4	Very high	91.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-71.7	-29.3	175.3	0	0	0	0	0	113.6	P290 L296 L386 V387 E388 L417 F425 F429	P290-A390 WeakPolarHBondContact CB-O 3.36Å; L296-A390 HydrophobicContact CD1-CB 3.63Å; L386-A390 WeakPolarHBondContact O-CB 3.44Å; L386-A390 PolarHBondContact O-N 3.43Å; V387-A390 PolarHBondContact O-N 2.92Å; E388-A390 PolarHBondContact O-N 3.48Å; A390-L417 HydrophobicContact CB-CD2 3.54Å; A390-F425 HydrophobicContact CB-CE1 3.96Å; A390-F425 HydrophobicContact CB-CZ 3.77Å; A390-F425 WeakPolarHBondContact O-CZ 3.47Å; A390-F429 HydrophobicContact CB-CE1 3.95Å; A390-F429 HydrophobicContact CB-CZ 4.06Å
391	T	92.8	Very high	90.8	Very high	12 Å²	12	32.7 Å²	32.7	7%	0.074	19%	0.191	C	C	.	.	H	α-helix	trans	-104.3	-13.4	-176.8	59.7	0	0	0	0	114	V387 E388 R393 P418	V387-T391 HydrophobicContact CG1-CG2 4.34Å; V387-T391 WeakPolarHBondContact O-CB 3.32Å; V387-T391 WeakPolarHBondContact O-CG2 3.29Å; V387-T391 PolarHBondContact O-N 2.7Å; V387-T391 PolarHBondContact O-OG1 2.96Å; E388-T391 PolarHBondContact O-N 3.37Å; T391-R393 PolarHBondContact O-N 3.02Å; T391-R393 PolarHBondContact OG1-N 2.88Å; T391-R393 PolarHBondContact OG1-O 2.87Å; T391-P418 HydrophobicContact CG2-CG 3.87Å
392	A	91.9	Very high	90.2	Very high	28 Å²	28	34.4 Å²	34.4	23%	0.231	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.8	-167.3	0	0	0	0	0	114.4	L284 K289 P290 E388	L284-A392 HydrophobicContact CD1-CB 3.84Å; L284-A392 HydrophobicContact CG-CB 4.2Å; K289-A392 VanDerWaalsContact C-CB 3.47Å; P290-A392 HydrophobicContact CG-CB 4.39Å; E388-A392 VanDerWaalsContact O-CA 3.28Å; E388-A392 WeakPolarHBondContact O-CA 3.29Å; E388-A392 PolarHBondContact O-N 2.9Å
393	R	89.1	Confident	89.5	Confident	121 Å²	121	40 Å²	40	46%	0.457	23%	0.225	S	C	.	.	S	Bend	trans	-141.9	150.5	-171.9	-80.8	-167.4	-72.9	160.8	-6.4	110.6	E388 T391 P395 E397 Y423	E388-R393 WeakPolarHBondContact CA-O 3.5Å; E388-R393 PolarHBondContact O-N 3.35Å; T391-R393 PolarHBondContact O-N 3.02Å; T391-R393 PolarHBondContact OG1-N 2.88Å; T391-R393 PolarHBondContact OG1-O 2.87Å; R393-P395 WeakPolarHBondContact O-CD 3.45Å; R393-E397 WeakPolarHBondContact CA-OE1 3.22Å; R393-E397 WeakPolarHBondContact CB-OE1 3.46Å; R393-E397 WeakPolarHBondContact CG-OE1 3.49Å; R393-Y423 PolarHBondContact NH2-OH 3.28Å
394	S	87.7	Confident	89	Confident	48 Å²	48	43.1 Å²	43.1	34%	0.336	24%	0.239	S	C	.	.			trans	-75.5	128.5	179	174.2	0	0	0	0	109.6	Y396 E397	S394-Y396 PolarHBondContact O-N 2.99Å; S394-Y396 PolarHBondContact OG-N 3.25Å; S394-E397 PolarHBondContact N-OE1 3.31Å; S394-E397 WeakPolarHBondContact O-CG 3.17Å; S394-E397 PolarHBondContact O-N 3.4Å; S394-E397 VanDerWaalsContact O-N 3.07Å
395	P	86.6	Confident	88.6	Confident	29 Å²	29	43.7 Å²	43.7	19%	0.188	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-15.1	179	-26.2	36.5	0	0	0	114.4	I384 V387 E388 R393 P415	I384-P395 HydrophobicContact CG2-CG 4.17Å; V387-P395 HydrophobicContact CB-CG 3.98Å; V387-P395 HydrophobicContact CG1-CB 4.25Å; V387-P395 HydrophobicContact CG1-CG 3.84Å; E388-P395 HydrophobicContact CB-CG 4.31Å; R393-P395 WeakPolarHBondContact O-CD 3.45Å; P395-P415 HydrophobicContact CB-CB 3.75Å; P395-P415 HydrophobicContact CB-CG 3.74Å
396	Y	87.8	Confident	88.2	Confident	12 Å²	12	45.6 Å²	45.6	5%	0.047	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	40.2	177	-57.6	-66.5	0	0	0	112.3	A359 I384 S394 C399 V405 K408 V409 P415	A359-Y396 HydrophobicContact CB-CD2 4.09Å; I384-Y396 HydrophobicContact CD1-CE2 3.92Å; S394-Y396 PolarHBondContact O-N 2.99Å; S394-Y396 PolarHBondContact OG-N 3.25Å; Y396-C399 WeakPolarHBondContact O-CB 3.34Å; Y396-C399 PolarHBondContact O-N 3.14Å; Y396-C399 PolarHBondContact O-SG 3.16Å; Y396-V405 HydrophobicContact CD2-CG1 4.01Å; Y396-V405 HydrophobicContact CG-CG1 4.2Å; Y396-K408 HydrophobicContact CD1-CB 3.83Å; Y396-K408 HydrophobicContact CD1-CD 4.15Å; Y396-K408 HydrophobicContact CE1-CB 4.11Å; Y396-V409 HydrophobicContact CD2-CG2 4.39Å; Y396-V409 HydrophobicContact CE1-CG2 4.19Å; Y396-V409 HydrophobicContact CE2-CG2 3.66Å; Y396-P415 HydrophobicContact CE1-CG 4.4Å; Y396-P415 VanDerWaalsContact OH-CD 3.28Å; Y396-P415 WeakPolarHBondContact OH-CD 3.32Å
397	E	79.9	Confident	87.7	Confident	99 Å²	99	47.9 Å²	47.9	46%	0.463	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	152.2	171.3	-94.7	164.6	-156.8	0	0	113.3	R393 S394 C399 K408	R393-E397 WeakPolarHBondContact CA-OE1 3.22Å; R393-E397 WeakPolarHBondContact CB-OE1 3.46Å; R393-E397 WeakPolarHBondContact CG-OE1 3.49Å; S394-E397 PolarHBondContact N-OE1 3.31Å; S394-E397 WeakPolarHBondContact O-CG 3.17Å; S394-E397 PolarHBondContact O-N 3.4Å; S394-E397 VanDerWaalsContact O-N 3.07Å; E397-C399 PolarHBondContact O-N 3.21Å; E397-K408 PolarHBondContact O-NZ 2.52Å
398	G	81.2	Confident	87.4	Confident	68 Å²	68	51 Å²	51	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	1.5	-175.7	0	0	0	0	0	115.8
399	C	82.9	Confident	87.1	Confident	28 Å²	28	49.9 Å²	49.9	19%	0.189	28%	0.275	C	S	.	.			trans	-83.3	126.9	168.5	-67.9	0	0	0	0	110.9	Y396 E397 E404 V405 K408	Y396-C399 WeakPolarHBondContact O-CB 3.34Å; Y396-C399 PolarHBondContact O-N 3.14Å; Y396-C399 PolarHBondContact O-SG 3.16Å; E397-C399 PolarHBondContact O-N 3.21Å; C399-E404 WeakPolarHBondContact CA-OE2 3.28Å; C399-E404 HydrophobicContact CB-CB 3.95Å; C399-V405 HydrophobicContact CB-CG2 3.44Å; C399-V405 VanDerWaalsContact CB-CG2 3.44Å; C399-K408 WeakPolarHBondContact SG-CD 3.46Å; C399-K408 WeakPolarHBondContact SG-CE 3.44Å; C399-K408 PolarHBondContact SG-NZ 3.47Å
400	N	80.4	Confident	86.8	Confident	146 Å²	146	53 Å²	53	78%	0.781	29%	0.291	S	S	*	.			trans	-94.3	-21.1	180	-58.8	-77	0	0	0	112.7	E404	N400-E404 PolarHBondContact N-OE2 2.89Å
401	T	84.1	Confident	86.4	Confident	67 Å²	67	58.9 Å²	58.9	41%	0.411	32%	0.323	S	S	.	.	S	Bend	trans	-126.8	152	177.7	66.7	0	0	0	0	112.3	F403 E404 V405	T401-F403 PolarHBondContact O-N 2.78Å; T401-F403 VanDerWaalsContact O-N 3.16Å; T401-E404 VanDerWaalsContact CB-OE1 3.3Å; T401-E404 WeakPolarHBondContact CB-OE1 3.45Å; T401-E404 VanDerWaalsContact CG2-OE1 3.31Å; T401-E404 WeakPolarHBondContact CG2-OE1 3.41Å; T401-E404 PolarHBondContact N-OE1 2.82Å; T401-E404 PolarHBondContact O-N 3.34Å; T401-E404 VanDerWaalsContact O-N 3.14Å; T401-E404 WeakPolarHBondContact OG1-CG 3.46Å; T401-E404 PolarHBondContact OG1-N 2.93Å; T401-E404 PolarHBondContact OG1-OE1 2.84Å; T401-V405 PolarHBondContact O-N 2.83Å
402	D	81.3	Confident	86.2	Confident	37 Å²	37	60.9 Å²	60.9	20%	0.198	34%	0.338	C	S	.	.	H	α-helix	trans	-57.5	-27.2	170.5	-70.2	-50.8	0	0	0	111.7	A355 G356 A358 V405 L406	A355-D402 WeakPolarHBondContact CA-OD1 3.37Å; G356-D402 PolarHBondContact N-OD1 2.98Å; A358-D402 HydrophobicContact CB-CB 3.95Å; D402-V405 PolarHBondContact O-N 2.86Å; D402-L406 WeakPolarHBondContact O-CB 3.11Å; D402-L406 WeakPolarHBondContact O-CD1 3.43Å; D402-L406 WeakPolarHBondContact O-CG 3.33Å; D402-L406 PolarHBondContact O-N 3Å
403	F	83.6	Confident	86.1	Confident	118 Å²	118	67.8 Å²	67.8	52%	0.518	37%	0.365	S	S	.	.	H	α-helix	trans	-68	-41.7	176.8	-175.9	-97	0	0	0	112.2	T401 V405 L406 T407 I655	T401-F403 PolarHBondContact O-N 2.78Å; T401-F403 VanDerWaalsContact O-N 3.16Å; F403-V405 VanDerWaalsContact C-N 3.32Å; F403-V405 PolarHBondContact O-N 2.84Å; F403-L406 PolarHBondContact O-N 3.13Å; F403-T407 WeakPolarHBondContact O-CB 3.42Å; F403-T407 PolarHBondContact O-N 2.77Å; F403-T407 PolarHBondContact O-OG1 2.79Å; F403-I655 HydrophobicContact CE2-CG2 4.38Å
404	E	87.8	Confident	86.2	Confident	65 Å²	65	64.4 Å²	64.4	30%	0.304	36%	0.359	S	S	.	.	H	α-helix	trans	-61.3	-41	172.1	-70.8	150.6	-111.8	0	0	111.6	C399 N400 T401 T407 K408	C399-E404 WeakPolarHBondContact CA-OE2 3.28Å; C399-E404 HydrophobicContact CB-CB 3.95Å; N400-E404 PolarHBondContact N-OE2 2.89Å; T401-E404 VanDerWaalsContact CB-OE1 3.3Å; T401-E404 WeakPolarHBondContact CB-OE1 3.45Å; T401-E404 VanDerWaalsContact CG2-OE1 3.31Å; T401-E404 WeakPolarHBondContact CG2-OE1 3.41Å; T401-E404 PolarHBondContact N-OE1 2.82Å; T401-E404 PolarHBondContact O-N 3.34Å; T401-E404 VanDerWaalsContact O-N 3.14Å; T401-E404 WeakPolarHBondContact OG1-CG 3.46Å; T401-E404 PolarHBondContact OG1-N 2.93Å; T401-E404 PolarHBondContact OG1-OE1 2.84Å; E404-T407 PolarHBondContact O-N 2.93Å; E404-K408 PolarHBondContact O-N 3.2Å
405	V	88.1	Confident	86.4	Confident	13 Å²	13	63.2 Å²	63.2	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-61.8	-51.2	176.5	178	0	0	0	0	110.8	A359 Y396 C399 T401 D402 F403 T407 K408 V409	A359-V405 HydrophobicContact CB-CG1 3.89Å; Y396-V405 HydrophobicContact CD2-CG1 4.01Å; Y396-V405 HydrophobicContact CG-CG1 4.2Å; C399-V405 HydrophobicContact CB-CG2 3.44Å; C399-V405 VanDerWaalsContact CB-CG2 3.44Å; T401-V405 PolarHBondContact O-N 2.83Å; D402-V405 PolarHBondContact O-N 2.86Å; F403-V405 VanDerWaalsContact C-N 3.32Å; F403-V405 PolarHBondContact O-N 2.84Å; V405-T407 VanDerWaalsContact C-N 3.25Å; V405-T407 PolarHBondContact O-N 2.82Å; V405-K408 PolarHBondContact O-N 2.98Å; V405-V409 WeakPolarHBondContact O-CG2 3.38Å; V405-V409 PolarHBondContact O-N 3.43Å
406	L	87.5	Confident	86.5	Confident	39 Å²	39	66 Å²	66	20%	0.204	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-34.6	178.2	-67	166.9	0	0	0	112	A358 M361 I366 D402 F403 L410	A358-L406 HydrophobicContact CB-CD1 4.44Å; A358-L406 HydrophobicContact CB-CD2 3.96Å; A358-L406 HydrophobicContact CB-CG 4.02Å; M361-L406 HydrophobicContact CB-CD2 4.49Å; M361-L406 HydrophobicContact SD-CD2 4.29Å; I366-L406 HydrophobicContact CD1-CB 4.31Å; I366-L406 HydrophobicContact CD1-CD2 3.47Å; I366-L406 VanDerWaalsContact CD1-CD2 3.47Å; I366-L406 HydrophobicContact CD1-CG 4.5Å; I366-L406 HydrophobicContact CG1-CD2 3.73Å; I366-L406 HydrophobicContact CG2-CB 4.21Å; I366-L406 HydrophobicContact CG2-CD2 4.1Å; D402-L406 WeakPolarHBondContact O-CB 3.11Å; D402-L406 WeakPolarHBondContact O-CD1 3.43Å; D402-L406 WeakPolarHBondContact O-CG 3.33Å; D402-L406 PolarHBondContact O-N 3Å; F403-L406 PolarHBondContact O-N 3.13Å; L406-L410 WeakPolarHBondContact O-CG 3.4Å; L406-L410 PolarHBondContact O-N 3.49Å; L406-L410 VanDerWaalsContact O-N 3.12Å
407	T	87.2	Confident	86.7	Confident	48 Å²	48	66.1 Å²	66.1	29%	0.294	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-46.6	174.7	-54.4	0	0	0	0	110.9	F403 E404 V405 V409 L410 D411	F403-T407 WeakPolarHBondContact O-CB 3.42Å; F403-T407 PolarHBondContact O-N 2.77Å; F403-T407 PolarHBondContact O-OG1 2.79Å; E404-T407 PolarHBondContact O-N 2.93Å; V405-T407 VanDerWaalsContact C-N 3.25Å; V405-T407 PolarHBondContact O-N 2.82Å; T407-V409 VanDerWaalsContact C-N 3.33Å; T407-V409 PolarHBondContact O-N 3.16Å; T407-L410 PolarHBondContact O-N 2.62Å; T407-L410 VanDerWaalsContact O-N 3.16Å; T407-D411 WeakPolarHBondContact CG2-OD2 3.34Å; T407-D411 WeakPolarHBondContact O-CB 3.39Å; T407-D411 PolarHBondContact O-N 3.42Å
408	K	89.2	Confident	87.1	Confident	69 Å²	69	63.2 Å²	63.2	30%	0.3	36%	0.36	S	S	.	.	H	α-helix	trans	-59.7	-40.4	173.7	-73.5	-170	-173.4	167.7	0	112.2	Y396 E397 C399 E404 V405 L410 S412	Y396-K408 HydrophobicContact CD1-CB 3.83Å; Y396-K408 HydrophobicContact CD1-CD 4.15Å; Y396-K408 HydrophobicContact CE1-CB 4.11Å; E397-K408 PolarHBondContact O-NZ 2.52Å; C399-K408 WeakPolarHBondContact SG-CD 3.46Å; C399-K408 WeakPolarHBondContact SG-CE 3.44Å; C399-K408 PolarHBondContact SG-NZ 3.47Å; E404-K408 PolarHBondContact O-N 3.2Å; V405-K408 PolarHBondContact O-N 2.98Å; K408-L410 VanDerWaalsContact C-N 3.32Å; K408-L410 PolarHBondContact O-N 2.96Å; K408-S412 WeakPolarHBondContact O-CA 3.33Å; K408-S412 VanDerWaalsContact O-CB 3.27Å; K408-S412 WeakPolarHBondContact O-CB 3.4Å; K408-S412 PolarHBondContact O-N 2.65Å
409	V	89.8	Confident	87.1	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-60.2	-40.4	175.5	171.3	0	0	0	0	111.9	M361 P363 I366 W380 Y396 V405 T407 K439	M361-V409 WeakPolarHBondContact O-CG1 3.34Å; P363-V409 HydrophobicContact CB-CG1 4.44Å; P363-V409 HydrophobicContact CG-CG1 3.84Å; I366-V409 HydrophobicContact CD1-CB 3.86Å; I366-V409 HydrophobicContact CD1-CG1 3.48Å; I366-V409 VanDerWaalsContact CD1-CG1 3.48Å; W380-V409 HydrophobicContact CZ2-CG1 3.95Å; Y396-V409 HydrophobicContact CD2-CG2 4.39Å; Y396-V409 HydrophobicContact CE1-CG2 4.19Å; Y396-V409 HydrophobicContact CE2-CG2 3.66Å; V405-V409 WeakPolarHBondContact O-CG2 3.38Å; V405-V409 PolarHBondContact O-N 3.43Å; T407-V409 VanDerWaalsContact C-N 3.33Å; T407-V409 PolarHBondContact O-N 3.16Å; V409-K439 VanDerWaalsContact O-CE 3.24Å; V409-K439 WeakPolarHBondContact O-CE 3.47Å; V409-K439 PolarHBondContact O-NZ 2.85Å
410	L	87.6	Confident	86.8	Confident	65 Å²	65	69.2 Å²	69.2	34%	0.34	37%	0.369	S	S	.	.	H	α-helix	trans	-75.6	-45	178.8	-73.9	176.7	0	0	0	113	P363 I366 L406 T407 K408 K439	P363-L410 HydrophobicContact CB-CD2 4.2Å; I366-L410 HydrophobicContact CB-CD1 4.34Å; I366-L410 HydrophobicContact CB-CD2 4.18Å; I366-L410 HydrophobicContact CB-CG 4.33Å; I366-L410 HydrophobicContact CD1-CG 4.34Å; I366-L410 HydrophobicContact CG2-CD1 3.77Å; I366-L410 HydrophobicContact CG2-CG 4.18Å; L406-L410 WeakPolarHBondContact O-CG 3.4Å; L406-L410 PolarHBondContact O-N 3.49Å; L406-L410 VanDerWaalsContact O-N 3.12Å; T407-L410 PolarHBondContact O-N 2.62Å; T407-L410 VanDerWaalsContact O-N 3.16Å; K408-L410 VanDerWaalsContact C-N 3.32Å; K408-L410 PolarHBondContact O-N 2.96Å; L410-K439 VanDerWaalsContact C-NZ 3.31Å; L410-K439 PolarHBondContact O-NZ 3.37Å
411	D	87.6	Confident	85.9	Confident	124 Å²	124	71.6 Å²	71.6	66%	0.663	38%	0.375	S	S	*	.	H	α-helix	trans	-104.5	-42.6	-164	-60.6	-21.4	0	0	0	113.2	T407	T407-D411 WeakPolarHBondContact CG2-OD2 3.34Å; T407-D411 WeakPolarHBondContact O-CB 3.39Å; T407-D411 PolarHBondContact O-N 3.42Å
412	S	88.6	Confident	85.4	Confident	55 Å²	55	72 Å²	72	39%	0.385	39%	0.393	S	S	.	.	S	Bend	trans	-77.5	157	-178.9	-49.6	0	0	0	0	112.6	K408 K439	K408-S412 WeakPolarHBondContact O-CA 3.33Å; K408-S412 VanDerWaalsContact O-CB 3.27Å; K408-S412 WeakPolarHBondContact O-CB 3.4Å; K408-S412 PolarHBondContact O-N 2.65Å; S412-K439 WeakPolarHBondContact O-CE 3.46Å; S412-K439 PolarHBondContact O-NZ 3.06Å
413	E	90.1	Very high	85.4	Confident	173 Å²	173	72.6 Å²	72.6	81%	0.808	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-56.2	149.3	175.6	-68.3	-169.4	159.1	0	0	112.5
414	P	91.9	Very high	85.5	Confident	50 Å²	50	74.3 Å²	74.3	33%	0.325	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-60.6	136.9	175.7	25.9	-33.6	0	0	0	110.5	W380 C416 L437	W380-P414 HydrophobicContact CH2-CB 4.02Å; W380-P414 HydrophobicContact CZ3-CB 4.25Å; P414-C416 PolarHBondContact O-N 3.18Å; P414-L437 HydrophobicContact CB-CB 4.04Å; P414-L437 VanDerWaalsContact CB-O 3.23Å; P414-L437 WeakPolarHBondContact CB-O 3.4Å
415	P	91.1	Very high	85.8	Confident	22 Å²	22	72.3 Å²	72.3	14%	0.143	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-66.1	129.7	-177.7	26.3	-33.1	0	0	0	110.5	I384 P395 Y396 L437	I384-P415 HydrophobicContact CD1-CG 3.63Å; P395-P415 HydrophobicContact CB-CB 3.75Å; P395-P415 HydrophobicContact CB-CG 3.74Å; Y396-P415 HydrophobicContact CE1-CG 4.4Å; Y396-P415 VanDerWaalsContact OH-CD 3.28Å; Y396-P415 WeakPolarHBondContact OH-CD 3.32Å; P415-L437 HydrophobicContact CG-CD1 4.17Å; P415-L437 WeakPolarHBondContact O-CD1 3.18Å
416	C	88.8	Confident	86.2	Confident	89 Å²	89	73.1 Å²	73.1	60%	0.601	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-99.4	164.1	177	55.4	0	0	0	0	111.6	P414	P414-C416 PolarHBondContact O-N 3.18Å
417	L	91.5	Very high	86.5	Confident	13 Å²	13	75.4 Å²	75.4	7%	0.068	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-70	133.6	165.4	-68.6	175.9	0	0	0	109.1	V387 A390 F425 F429 R430 V433	V387-L417 HydrophobicContact CB-CD2 4.42Å; V387-L417 HydrophobicContact CG2-CD2 4.16Å; A390-L417 HydrophobicContact CB-CD2 3.54Å; L417-F425 HydrophobicContact CB-CD2 3.99Å; L417-F425 HydrophobicContact CB-CE2 4.31Å; L417-F425 HydrophobicContact CD1-CB 4.44Å; L417-F425 HydrophobicContact CD1-CD2 4.28Å; L417-F425 HydrophobicContact CD1-CG 4.24Å; L417-F425 HydrophobicContact CD2-CE2 4.32Å; L417-F429 HydrophobicContact CD1-CD1 3.45Å; L417-F429 VanDerWaalsContact CD1-CD1 3.45Å; L417-F429 HydrophobicContact CD1-CD2 4.28Å; L417-F429 HydrophobicContact CD1-CE1 3.4Å; L417-F429 HydrophobicContact CD1-CE2 4.23Å; L417-F429 HydrophobicContact CD1-CG 3.89Å; L417-F429 HydrophobicContact CD1-CZ 3.8Å; L417-F429 HydrophobicContact CD2-CE1 4.2Å; L417-F429 HydrophobicContact CD2-CZ 4.33Å; L417-F429 HydrophobicContact CG-CE1 4.47Å; L417-R430 HydrophobicContact CB-CG 4.15Å; L417-R430 HydrophobicContact CD1-CG 3.94Å; L417-V433 HydrophobicContact CD1-CB 4.32Å; L417-V433 HydrophobicContact CD1-CG2 3.96Å; L417-V433 HydrophobicContact CG-CB 4.39Å; L417-V433 HydrophobicContact CG-CG1 4.28Å; L417-V433 HydrophobicContact CG-CG2 4.27Å
418	P	88.1	Confident	86.9	Confident	39 Å²	39	77.1 Å²	77.1	25%	0.253	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-64.4	156.5	177	27.6	-34.9	0	0	0	111.7	T391 Y423 F425	T391-P418 HydrophobicContact CG2-CG 3.87Å; P418-Y423 HydrophobicContact CB-CD2 4Å; P418-Y423 HydrophobicContact CB-CE2 4.41Å; P418-Y423 HydrophobicContact CB-CG 4.12Å; P418-Y423 HydrophobicContact CG-CD1 3.69Å; P418-Y423 HydrophobicContact CG-CD2 3.81Å; P418-Y423 HydrophobicContact CG-CE1 3.94Å; P418-Y423 HydrophobicContact CG-CE2 4.05Å; P418-Y423 HydrophobicContact CG-CG 3.6Å; P418-F425 HydrophobicContact CG-CE2 4.25Å
419	Y	82.4	Confident	87.3	Confident	190 Å²	190	73.8 Å²	73.8	75%	0.745	40%	0.404	S	S	*	.			trans	-131.6	138.9	177.4	180	-96.1	0	0	0	109.2
420	G	76.1	Confident	87.6	Confident	32 Å²	32	76.1 Å²	76.1	33%	0.33	41%	0.412	S	S	.	.	S	Bend	trans	125.5	-163.1	-175.1	0	0	0	0	0	112.3	G422 Y423	G420-G422 PolarHBondContact O-N 2.96Å; G420-Y423 PolarHBondContact O-N 2.9Å
421	E	62.7	Low	88	Confident	196 Å²	196	75.9 Å²	75.9	92%	0.916	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	133	-174.6	-62.5	-165.3	154.4	0	0	112.7	Y423	E421-Y423 VanDerWaalsContact C-N 3.26Å; E421-Y423 PolarHBondContact O-N 3.46Å
422	G	72.4	Confident	88.5	Confident	75 Å²	75	70 Å²	70	77%	0.773	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-9.9	-175.4	0	0	0	0	0	115.8	G420	G420-G422 PolarHBondContact O-N 2.96Å
423	Y	81.4	Confident	88.9	Confident	50 Å²	50	67.5 Å²	67.5	20%	0.196	36%	0.362	C	S	.	.			trans	-126.1	59	-171.5	-66	-66.1	0	0	0	113.3	R393 P418 G420 E421 F425	R393-Y423 PolarHBondContact NH2-OH 3.28Å; P418-Y423 HydrophobicContact CB-CD2 4Å; P418-Y423 HydrophobicContact CB-CE2 4.41Å; P418-Y423 HydrophobicContact CB-CG 4.12Å; P418-Y423 HydrophobicContact CG-CD1 3.69Å; P418-Y423 HydrophobicContact CG-CD2 3.81Å; P418-Y423 HydrophobicContact CG-CE1 3.94Å; P418-Y423 HydrophobicContact CG-CE2 4.05Å; P418-Y423 HydrophobicContact CG-CG 3.6Å; G420-Y423 PolarHBondContact O-N 2.9Å; E421-Y423 VanDerWaalsContact C-N 3.26Å; E421-Y423 PolarHBondContact O-N 3.46Å; Y423-F425 AromaticContact CD1-CE2 3.6Å; Y423-F425 HydrophobicContact CD1-CE2 3.6Å; Y423-F425 AromaticContact CD1-CZ 3.83Å; Y423-F425 HydrophobicContact CD1-CZ 3.83Å; Y423-F425 HydrophobicContact CG-CE2 4.18Å; Y423-F425 PolarHBondContact O-N 2.94Å
424	N	86.5	Confident	89.2	Confident	153 Å²	153	64 Å²	64	82%	0.818	35%	0.348	S	S	*	.			trans	-80.3	56.5	-179.3	-65.4	-16.4	0	0	0	113.1
425	F	94.1	Very high	89.4	Confident	23 Å²	23	65.5 Å²	65.5	10%	0.101	35%	0.349	C	S	.	.			trans	-74.9	140.4	178.5	-61.4	-60.6	0	0	0	112.7	A390 L417 P418 Y423 F429 R430	A390-F425 HydrophobicContact CB-CE1 3.96Å; A390-F425 HydrophobicContact CB-CZ 3.77Å; A390-F425 WeakPolarHBondContact O-CZ 3.47Å; L417-F425 HydrophobicContact CB-CD2 3.99Å; L417-F425 HydrophobicContact CB-CE2 4.31Å; L417-F425 HydrophobicContact CD1-CB 4.44Å; L417-F425 HydrophobicContact CD1-CD2 4.28Å; L417-F425 HydrophobicContact CD1-CG 4.24Å; L417-F425 HydrophobicContact CD2-CE2 4.32Å; P418-F425 HydrophobicContact CG-CE2 4.25Å; Y423-F425 AromaticContact CD1-CE2 3.6Å; Y423-F425 HydrophobicContact CD1-CE2 3.6Å; Y423-F425 AromaticContact CD1-CZ 3.83Å; Y423-F425 HydrophobicContact CD1-CZ 3.83Å; Y423-F425 HydrophobicContact CG-CE2 4.18Å; Y423-F425 PolarHBondContact O-N 2.94Å; F425-F429 HydrophobicContact CB-CD1 4.14Å; F425-F429 AromaticContact CD1-CD1 3.69Å; F425-F429 HydrophobicContact CD1-CD1 3.69Å; F425-F429 AromaticContact CD1-CE1 3.76Å; F425-F429 HydrophobicContact CD1-CE1 3.76Å; F425-F429 HydrophobicContact CE1-CD1 4.42Å; F425-F429 HydrophobicContact CE1-CE1 4.03Å; F425-F429 HydrophobicContact CG-CD1 4.1Å; F425-F429 HydrophobicContact CG-CE1 4.37Å; F425-R430 HydrophobicContact CB-CG 4.05Å; F425-R430 PolarHBondContact O-NE 3.11Å; F425-R430 PolarHBondContact O-NH2 3.46Å
426	S	95.3	Very high	89.7	Confident	31 Å²	31	64.4 Å²	64.4	22%	0.217	34%	0.343	C	S	.	.			trans	-59.9	150.9	174.9	73.2	0	0	0	0	111.4	E293 Q428 F429 R430	E293-S426 VanDerWaalsContact CD-OG 3.25Å; E293-S426 VanDerWaalsContact OE1-CB 3.27Å; E293-S426 WeakPolarHBondContact OE1-CB 3.46Å; E293-S426 PolarHBondContact OE1-OG 3.2Å; E293-S426 PolarHBondContact OE2-N 2.99Å; E293-S426 PolarHBondContact OE2-OG 3.35Å; S426-Q428 PolarHBondContact O-N 2.82Å; S426-F429 PolarHBondContact O-N 3.26Å; S426-F429 WeakPolarHBondContact OG-CB 3.33Å; S426-F429 PolarHBondContact OG-N 2.89Å; S426-F429 VanDerWaalsContact OG-N 3.08Å; S426-R430 PolarHBondContact O-N 3.38Å; S426-R430 VanDerWaalsContact O-N 3.12Å; S426-R430 PolarHBondContact O-NE 3.05Å
427	Q	94.4	Very high	90.1	Very high	87 Å²	87	60.4 Å²	60.4	41%	0.407	32%	0.315	S	S	.	.	H	α-helix	trans	-62.2	-37.8	176	-170.8	62.4	45.7	0	0	110.1	F429 R430 D431	Q427-F429 VanDerWaalsContact C-N 3.33Å; Q427-F429 PolarHBondContact O-N 2.93Å; Q427-R430 PolarHBondContact O-N 3.32Å; Q427-D431 PolarHBondContact NE2-OD1 2.97Å; Q427-D431 WeakPolarHBondContact O-CB 2.8Å; Q427-D431 PolarHBondContact O-N 2.72Å
428	Q	96.4	Very high	90.3	Very high	83 Å²	83	61.6 Å²	61.6	39%	0.388	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-38.9	179	-62	76.3	10.3	0	0	111.9	S426 F432 P454 F455 I458	S426-Q428 PolarHBondContact O-N 2.82Å; Q428-F432 WeakPolarHBondContact O-CB 3.31Å; Q428-F432 PolarHBondContact O-N 3.03Å; Q428-F432 VanDerWaalsContact O-N 3.08Å; Q428-P454 HydrophobicContact CG-CB 4.18Å; Q428-F455 HydrophobicContact CB-CB 4.22Å; Q428-I458 HydrophobicContact CG-CD1 4.19Å
429	F	97.1	Very high	90.5	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-69.3	-44.1	174.4	-175.7	-147.8	0	0	0	111.9	E293 L296 L386 A390 L417 F425 S426 Q427 F432 V433 F455	E293-F429 HydrophobicContact CB-CD1 4.46Å; E293-F429 HydrophobicContact CG-CB 4.14Å; E293-F429 HydrophobicContact CG-CD1 3.63Å; E293-F429 HydrophobicContact CG-CE1 4.23Å; E293-F429 HydrophobicContact CG-CG 3.96Å; L296-F429 HydrophobicContact CB-CZ 4.32Å; L296-F429 HydrophobicContact CD1-CE1 3.88Å; L296-F429 HydrophobicContact CD1-CZ 3.63Å; L386-F429 HydrophobicContact CB-CE2 4.24Å; L386-F429 HydrophobicContact CB-CZ 4.41Å; L386-F429 HydrophobicContact CD1-CE2 4.44Å; L386-F429 HydrophobicContact CD2-CE2 4.49Å; A390-F429 HydrophobicContact CB-CE1 3.95Å; A390-F429 HydrophobicContact CB-CZ 4.06Å; L417-F429 HydrophobicContact CD1-CD1 3.45Å; L417-F429 VanDerWaalsContact CD1-CD1 3.45Å; L417-F429 HydrophobicContact CD1-CD2 4.28Å; L417-F429 HydrophobicContact CD1-CE1 3.4Å; L417-F429 HydrophobicContact CD1-CE2 4.23Å; L417-F429 HydrophobicContact CD1-CG 3.89Å; L417-F429 HydrophobicContact CD1-CZ 3.8Å; L417-F429 HydrophobicContact CD2-CE1 4.2Å; L417-F429 HydrophobicContact CD2-CZ 4.33Å; L417-F429 HydrophobicContact CG-CE1 4.47Å; F425-F429 HydrophobicContact CB-CD1 4.14Å; F425-F429 AromaticContact CD1-CD1 3.69Å; F425-F429 HydrophobicContact CD1-CD1 3.69Å; F425-F429 AromaticContact CD1-CE1 3.76Å; F425-F429 HydrophobicContact CD1-CE1 3.76Å; F425-F429 HydrophobicContact CE1-CD1 4.42Å; F425-F429 HydrophobicContact CE1-CE1 4.03Å; F425-F429 HydrophobicContact CG-CD1 4.1Å; F425-F429 HydrophobicContact CG-CE1 4.37Å; S426-F429 PolarHBondContact O-N 3.26Å; S426-F429 WeakPolarHBondContact OG-CB 3.33Å; S426-F429 PolarHBondContact OG-N 2.89Å; S426-F429 VanDerWaalsContact OG-N 3.08Å; Q427-F429 VanDerWaalsContact C-N 3.33Å; Q427-F429 PolarHBondContact O-N 2.93Å; F429-F432 PolarHBondContact O-N 3.03Å; F429-V433 HydrophobicContact CD2-CG2 3.97Å; F429-V433 HydrophobicContact CE2-CG2 3.6Å; F429-V433 HydrophobicContact CZ-CG2 4.2Å; F429-V433 PolarHBondContact O-N 2.82Å; F429-F455 HydrophobicContact CB-CD2 3.76Å; F429-F455 HydrophobicContact CB-CE2 3.44Å; F429-F455 VanDerWaalsContact CB-CE2 3.44Å; F429-F455 HydrophobicContact CB-CZ 4.11Å; F429-F455 HydrophobicContact CD2-CD1 4.43Å; F429-F455 HydrophobicContact CD2-CD2 4.28Å; F429-F455 AromaticContact CD2-CE1 3.73Å; F429-F455 HydrophobicContact CD2-CE1 3.73Å; F429-F455 AromaticContact CD2-CE2 3.56Å; F429-F455 HydrophobicContact CD2-CE2 3.56Å; F429-F455 AromaticContact CD2-CZ 3.25Å; F429-F455 HydrophobicContact CD2-CZ 3.25Å; F429-F455 HydrophobicContact CE2-CE1 4.23Å; F429-F455 AromaticContact CE2-CZ 3.85Å; F429-F455 HydrophobicContact CE2-CZ 3.85Å; F429-F455 HydrophobicContact CG-CD2 4.38Å; F429-F455 AromaticContact CG-CE2 3.66Å; F429-F455 HydrophobicContact CG-CE2 3.66Å; F429-F455 AromaticContact CG-CZ 3.82Å; F429-F455 HydrophobicContact CG-CZ 3.82Å
430	R	95.6	Very high	90.9	Very high	48 Å²	48	56.9 Å²	56.9	18%	0.181	31%	0.305	C	S	.	.	H	α-helix	trans	-60.5	-47.9	176.8	-73.1	-176.8	-84.8	121.6	2	111.7	L417 F425 S426 Q427 F432 V433 I434	L417-R430 HydrophobicContact CB-CG 4.15Å; L417-R430 HydrophobicContact CD1-CG 3.94Å; F425-R430 HydrophobicContact CB-CG 4.05Å; F425-R430 PolarHBondContact O-NE 3.11Å; F425-R430 PolarHBondContact O-NH2 3.46Å; S426-R430 PolarHBondContact O-N 3.38Å; S426-R430 VanDerWaalsContact O-N 3.12Å; S426-R430 PolarHBondContact O-NE 3.05Å; Q427-R430 PolarHBondContact O-N 3.32Å; R430-F432 VanDerWaalsContact C-N 3.32Å; R430-F432 PolarHBondContact O-N 3.35Å; R430-V433 PolarHBondContact O-N 3.11Å; R430-I434 WeakPolarHBondContact O-CD1 3.43Å; R430-I434 VanDerWaalsContact O-CG1 3.25Å; R430-I434 WeakPolarHBondContact O-CG1 3.46Å; R430-I434 PolarHBondContact O-N 3.43Å
431	D	95.8	Very high	91.6	Very high	60 Å²	60	56.5 Å²	56.5	32%	0.321	30%	0.295	S	S	.	.	H	α-helix	trans	-59.9	-39.9	175.5	-64	-14.7	0	0	0	112.2	Q427 K435	Q427-D431 PolarHBondContact NE2-OD1 2.97Å; Q427-D431 WeakPolarHBondContact O-CB 2.8Å; Q427-D431 PolarHBondContact O-N 2.72Å; D431-K435 WeakPolarHBondContact O-CB 3.33Å; D431-K435 VanDerWaalsContact O-CG 3.25Å; D431-K435 WeakPolarHBondContact O-CG 3.36Å; D431-K435 PolarHBondContact O-N 2.92Å
432	F	97.9	Very high	93	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.009	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-46.7	177.5	-175.2	-87.9	0	0	0	111.7	T300 V304 L382 L386 Q428 F429 R430 K435 C436 L450 Q453 F455 I456	T300-F432 HydrophobicContact CG2-CD1 4.2Å; T300-F432 HydrophobicContact CG2-CE1 3.37Å; T300-F432 HydrophobicContact CG2-CE2 4.12Å; T300-F432 HydrophobicContact CG2-CZ 3.34Å; V304-F432 HydrophobicContact CG2-CZ 4.3Å; L382-F432 HydrophobicContact CD2-CE1 4.48Å; L386-F432 HydrophobicContact CD1-CD1 4.03Å; L386-F432 HydrophobicContact CD1-CE1 3.75Å; Q428-F432 WeakPolarHBondContact O-CB 3.31Å; Q428-F432 PolarHBondContact O-N 3.03Å; Q428-F432 VanDerWaalsContact O-N 3.08Å; F429-F432 PolarHBondContact O-N 3.03Å; R430-F432 VanDerWaalsContact C-N 3.32Å; R430-F432 PolarHBondContact O-N 3.35Å; F432-K435 PolarHBondContact O-N 2.71Å; F432-C436 WeakPolarHBondContact CE1-SG 3.24Å; F432-C436 PolarHBondContact O-N 2.82Å; F432-C436 PolarHBondContact O-SG 3.25Å; F432-C436 VanDerWaalsContact O-SG 3.32Å; F432-L450 HydrophobicContact CD2-CD2 4.46Å; F432-L450 HydrophobicContact CE2-CB 4.27Å; F432-L450 HydrophobicContact CE2-CD2 3.75Å; F432-L450 HydrophobicContact CZ-CD2 3.94Å; F432-Q453 HydrophobicContact CD2-CB 3.88Å; F432-Q453 HydrophobicContact CD2-CG 3.99Å; F432-Q453 HydrophobicContact CE2-CB 4.31Å; F432-Q453 HydrophobicContact CE2-CG 4.3Å; F432-F455 HydrophobicContact CB-CB 4.04Å; F432-F455 HydrophobicContact CB-CD1 4.02Å; F432-F455 HydrophobicContact CB-CG 4.18Å; F432-F455 HydrophobicContact CD1-CD1 4.05Å; F432-F455 HydrophobicContact CD1-CE1 4.38Å; F432-F455 HydrophobicContact CD2-CB 4.27Å; F432-F455 HydrophobicContact CD2-CD1 4.07Å; F432-F455 HydrophobicContact CG-CB 4.33Å; F432-F455 AromaticContact CG-CD1 3.76Å; F432-F455 HydrophobicContact CG-CD1 3.76Å; F432-F455 HydrophobicContact CG-CG 4.36Å; F432-I456 HydrophobicContact CD2-CG1 4.43Å; F432-I456 HydrophobicContact CE2-CD1 3.71Å; F432-I456 HydrophobicContact CE2-CG1 3.78Å; F432-I456 HydrophobicContact CZ-CD1 3.98Å; F432-I456 HydrophobicContact CZ-CG1 4.31Å
433	V	97.6	Very high	94	Very high	2 Å²	2	54.3 Å²	54.3	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-65.3	-42.5	178.4	170.9	0	0	0	0	111.6	L386 V387 L417 F429 R430 K435 C436 L437	L386-V433 HydrophobicContact CB-CG2 4.1Å; L386-V433 HydrophobicContact CD1-CG2 4.43Å; V387-V433 HydrophobicContact CG2-CG1 3.53Å; L417-V433 HydrophobicContact CD1-CB 4.32Å; L417-V433 HydrophobicContact CD1-CG2 3.96Å; L417-V433 HydrophobicContact CG-CB 4.39Å; L417-V433 HydrophobicContact CG-CG1 4.28Å; L417-V433 HydrophobicContact CG-CG2 4.27Å; F429-V433 HydrophobicContact CD2-CG2 3.97Å; F429-V433 HydrophobicContact CE2-CG2 3.6Å; F429-V433 HydrophobicContact CZ-CG2 4.2Å; F429-V433 PolarHBondContact O-N 2.82Å; R430-V433 PolarHBondContact O-N 3.11Å; V433-K435 VanDerWaalsContact C-N 3.33Å; V433-K435 PolarHBondContact O-N 2.8Å; V433-C436 PolarHBondContact O-N 2.81Å; V433-L437 HydrophobicContact CG1-CD1 3.85Å; V433-L437 HydrophobicContact CG1-CG 4.47Å; V433-L437 WeakPolarHBondContact O-CB 3.33Å; V433-L437 PolarHBondContact O-N 2.79Å
434	I	96.3	Very high	94.7	Very high	98 Å²	98	52 Å²	52	50%	0.503	26%	0.26	S	S	.	.	H	α-helix	trans	-59.5	-43.6	176.6	-69.7	163.5	0	0	0	111.1	R430 L437 T438	R430-I434 WeakPolarHBondContact O-CD1 3.43Å; R430-I434 VanDerWaalsContact O-CG1 3.25Å; R430-I434 WeakPolarHBondContact O-CG1 3.46Å; R430-I434 PolarHBondContact O-N 3.43Å; I434-L437 CarbonylContact O-C 3.21Å; I434-L437 PolarHBondContact O-N 3.49Å; I434-T438 PolarHBondContact O-N 3.09Å; I434-T438 VanDerWaalsContact O-N 3.14Å; I434-T438 PolarHBondContact O-OG1 3.19Å; I434-T438 VanDerWaalsContact O-OG1 3.12Å
435	K	96.7	Very high	95.2	Very high	82 Å²	82	45.5 Å²	45.5	36%	0.357	23%	0.225	S	C	.	.	H	α-helix	trans	-64.1	-42.9	175.5	-70.4	172.8	-164.5	-174.3	0	111.7	D431 F432 V433 L437 T438 P445	D431-K435 WeakPolarHBondContact O-CB 3.33Å; D431-K435 VanDerWaalsContact O-CG 3.25Å; D431-K435 WeakPolarHBondContact O-CG 3.36Å; D431-K435 PolarHBondContact O-N 2.92Å; F432-K435 PolarHBondContact O-N 2.71Å; V433-K435 VanDerWaalsContact C-N 3.33Å; V433-K435 PolarHBondContact O-N 2.8Å; K435-L437 VanDerWaalsContact C-N 3.3Å; K435-L437 PolarHBondContact O-N 2.83Å; K435-T438 WeakPolarHBondContact O-CB 3.47Å; K435-T438 PolarHBondContact O-N 3.45Å; K435-T438 PolarHBondContact O-OG1 3.06Å; K435-P445 HydrophobicContact CB-CG 4.16Å; K435-P445 VanDerWaalsContact O-CD 3.29Å; K435-P445 WeakPolarHBondContact O-CD 3.47Å
436	C	97.6	Very high	95.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-36.5	174.9	-71.1	0	0	0	0	113	V379 W380 F432 V433 R444	V379-C436 HydrophobicContact CG1-CB 4.09Å; W380-C436 WeakPolarHBondContact CA-O 3.47Å; F432-C436 WeakPolarHBondContact CE1-SG 3.24Å; F432-C436 PolarHBondContact O-N 2.82Å; F432-C436 PolarHBondContact O-SG 3.25Å; F432-C436 VanDerWaalsContact O-SG 3.32Å; V433-C436 PolarHBondContact O-N 2.81Å; C436-R444 VanDerWaalsContact O-CD 3.29Å; C436-R444 WeakPolarHBondContact O-CD 3.37Å
437	L	96.9	Very high	95.3	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.021	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	23.4	-178	-63.1	178.7	0	0	0	114	W380 I384 V387 P414 P415 V433 I434 K435 K439	W380-L437 HydrophobicContact CD2-CD2 3.73Å; W380-L437 HydrophobicContact CE3-CB 4.43Å; W380-L437 HydrophobicContact CE3-CD2 3.88Å; W380-L437 HydrophobicContact CG-CD2 4.11Å; W380-L437 HydrophobicContact CZ2-CD2 4.39Å; W380-L437 HydrophobicContact CZ3-CB 4.32Å; W380-L437 HydrophobicContact CZ3-CD2 4.28Å; W380-L437 VanDerWaalsContact CZ3-O 3.27Å; W380-L437 WeakPolarHBondContact CZ3-O 3.23Å; W380-L437 WeakPolarHBondContact O-CD2 3.28Å; I384-L437 HydrophobicContact CD1-CD1 4.23Å; I384-L437 HydrophobicContact CD1-CD2 3.6Å; I384-L437 HydrophobicContact CG1-CD2 3.84Å; V387-L437 HydrophobicContact CG2-CD1 3.92Å; P414-L437 HydrophobicContact CB-CB 4.04Å; P414-L437 VanDerWaalsContact CB-O 3.23Å; P414-L437 WeakPolarHBondContact CB-O 3.4Å; P415-L437 HydrophobicContact CG-CD1 4.17Å; P415-L437 WeakPolarHBondContact O-CD1 3.18Å; V433-L437 HydrophobicContact CG1-CD1 3.85Å; V433-L437 HydrophobicContact CG1-CG 4.47Å; V433-L437 WeakPolarHBondContact O-CB 3.33Å; V433-L437 PolarHBondContact O-N 2.79Å; I434-L437 CarbonylContact O-C 3.21Å; I434-L437 PolarHBondContact O-N 3.49Å; K435-L437 VanDerWaalsContact C-N 3.3Å; K435-L437 PolarHBondContact O-N 2.83Å; L437-K439 PolarHBondContact O-N 2.61Å; L437-K439 VanDerWaalsContact O-N 3.16Å
438	T	95.8	Very high	95.4	Very high	39 Å²	39	46.5 Å²	46.5	24%	0.239	23%	0.233	C	C	.	.			trans	-65.6	113.9	170.3	-64.9	0	0	0	0	109.7	I434 K435 N440 D443 R444	I434-T438 PolarHBondContact O-N 3.09Å; I434-T438 VanDerWaalsContact O-N 3.14Å; I434-T438 PolarHBondContact O-OG1 3.19Å; I434-T438 VanDerWaalsContact O-OG1 3.12Å; K435-T438 WeakPolarHBondContact O-CB 3.47Å; K435-T438 PolarHBondContact O-N 3.45Å; K435-T438 PolarHBondContact O-OG1 3.06Å; T438-N440 PolarHBondContact O-N 3.24Å; T438-D443 HydrophobicContact CG2-CB 3.93Å; T438-R444 HydrophobicContact CG2-CB 4.47Å; T438-R444 PolarHBondContact O-NE 2.87Å; T438-R444 PolarHBondContact O-NH2 3.2Å
439	K	91.7	Very high	95.4	Very high	62 Å²	62	47.3 Å²	47.3	27%	0.27	24%	0.236	S	C	.	.	S	Bend	trans	-58	-46.2	-174.8	-94.8	-164.4	172.7	-173.1	0	113	P363 W380 V409 L410 S412 L437 H441 R444	P363-K439 HydrophobicContact CG-CG 4.36Å; W380-K439 HydrophobicContact CH2-CG 4.03Å; W380-K439 HydrophobicContact CZ3-CG 3.95Å; V409-K439 VanDerWaalsContact O-CE 3.24Å; V409-K439 WeakPolarHBondContact O-CE 3.47Å; V409-K439 PolarHBondContact O-NZ 2.85Å; L410-K439 VanDerWaalsContact C-NZ 3.31Å; L410-K439 PolarHBondContact O-NZ 3.37Å; S412-K439 WeakPolarHBondContact O-CE 3.46Å; S412-K439 PolarHBondContact O-NZ 3.06Å; L437-K439 PolarHBondContact O-N 2.61Å; L437-K439 VanDerWaalsContact O-N 3.16Å; K439-H441 PolarHBondContact O-N 3.25Å; K439-R444 PolarHBondContact O-NH2 3.02Å; K439-R444 VanDerWaalsContact O-NH2 3.09Å
440	N	91.1	Very high	95.3	Very high	67 Å²	67	47.3 Å²	47.3	36%	0.358	24%	0.236	S	C	.	.	S	Bend	trans	-68	108.8	174.8	-177.1	12.6	0	0	0	109.8	T438 Q442 D443 R444	T438-N440 PolarHBondContact O-N 3.24Å; N440-Q442 PolarHBondContact O-N 2.96Å; N440-Q442 PolarHBondContact OD1-N 3.34Å; N440-Q442 VanDerWaalsContact OD1-N 3.11Å; N440-D443 VanDerWaalsContact CB-OD2 3.31Å; N440-D443 WeakPolarHBondContact CB-OD2 3.36Å; N440-D443 PolarHBondContact ND2-OD1 3.47Å; N440-D443 VanDerWaalsContact ND2-OD1 3.15Å; N440-D443 PolarHBondContact ND2-OD2 3.02Å; N440-D443 PolarHBondContact O-N 3.22Å; N440-D443 VanDerWaalsContact O-N 3.09Å; N440-R444 PolarHBondContact O-N 3.13Å; N440-R444 VanDerWaalsContact O-N 3.14Å
441	H	90.6	Very high	95.4	Very high	24 Å²	24	46.2 Å²	46.2	11%	0.111	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-13.9	178.6	75.2	88.5	0	0	0	113.9	E364 K370 R376 K439	E364-H441 HydrophobicContact CB-CB 4.27Å; E364-H441 HydrophobicContact CG-CB 3.81Å; K370-H441 PolarHBondContact NZ-NE2 3.08Å; K370-H441 VanDerWaalsContact NZ-NE2 3.12Å; R376-H441 VanDerWaalsContact CD-O 3.23Å; R376-H441 WeakPolarHBondContact CD-O 3.36Å; R376-H441 PolarHBondContact NE-O 2.98Å; R376-H441 PolarHBondContact NH1-O 3.47Å; K439-H441 PolarHBondContact O-N 3.25Å
442	Q	90.9	Very high	95.4	Very high	111 Å²	111	46.1 Å²	46.1	52%	0.519	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-38.6	173.9	-63	-66.5	26.5	0	0	112.8	R376 N440	R376-Q442 PolarHBondContact NH1-O 2.83Å; R376-Q442 VanDerWaalsContact NH1-O 3.08Å; R376-Q442 VanDerWaalsContact NH1-OE1 3.1Å; N440-Q442 PolarHBondContact O-N 2.96Å; N440-Q442 PolarHBondContact OD1-N 3.34Å; N440-Q442 VanDerWaalsContact OD1-N 3.11Å
443	D	94.3	Very high	95.4	Very high	115 Å²	115	47.6 Å²	47.6	62%	0.615	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-18	-177.3	-43.3	-29.4	0	0	0	111.8	T438 N440	T438-D443 HydrophobicContact CG2-CB 3.93Å; N440-D443 VanDerWaalsContact CB-OD2 3.31Å; N440-D443 WeakPolarHBondContact CB-OD2 3.36Å; N440-D443 PolarHBondContact ND2-OD1 3.47Å; N440-D443 VanDerWaalsContact ND2-OD1 3.15Å; N440-D443 PolarHBondContact ND2-OD2 3.02Å; N440-D443 PolarHBondContact O-N 3.22Å; N440-D443 VanDerWaalsContact O-N 3.09Å
444	R	96.3	Very high	95.4	Very high	2 Å²	2	51 Å²	51	1%	0.008	27%	0.271	C	S	.	.	S	Bend	trans	-64.7	128.9	174.1	-161.3	-171.5	-54.7	144.4	8.9	110.2	E364 R376 V379 C436 T438 K439 N440	E364-R444 IonicContact OE1-CZ 2.68Å; E364-R444 IonicContact OE1-NH1 2.73Å; E364-R444 PolarHBondContact OE1-NH1 2.87Å; E364-R444 IonicContact OE1-NH2 2.69Å; E364-R444 IonicContact OE2-CZ 2.7Å; E364-R444 IonicContact OE2-NH1 2.73Å; E364-R444 PolarHBondContact OE2-NH1 3.09Å; E364-R444 IonicContact OE2-NH2 2.72Å; E364-R444 PolarHBondContact OE2-NH2 3.39Å; R376-R444 WeakPolarHBondContact CD-O 3.43Å; R376-R444 VanDerWaalsContact O-CD 3.23Å; R376-R444 WeakPolarHBondContact O-CD 3.33Å; R376-R444 PolarHBondContact O-NH1 3.49Å; V379-R444 HydrophobicContact CG1-CG 4.02Å; C436-R444 VanDerWaalsContact O-CD 3.29Å; C436-R444 WeakPolarHBondContact O-CD 3.37Å; T438-R444 HydrophobicContact CG2-CB 4.47Å; T438-R444 PolarHBondContact O-NE 2.87Å; T438-R444 PolarHBondContact O-NH2 3.2Å; K439-R444 PolarHBondContact O-NH2 3.02Å; K439-R444 VanDerWaalsContact O-NH2 3.09Å; N440-R444 PolarHBondContact O-N 3.13Å; N440-R444 VanDerWaalsContact O-N 3.14Å
445	P	96.4	Very high	95.4	Very high	15 Å²	15	46.4 Å²	46.4	10%	0.097	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-71.4	158.7	-172.4	29.4	-37.5	0	0	0	113.8	K435 E449 L450	K435-P445 HydrophobicContact CB-CG 4.16Å; K435-P445 VanDerWaalsContact O-CD 3.29Å; K435-P445 WeakPolarHBondContact O-CD 3.47Å; P445-E449 WeakPolarHBondContact CA-OE2 3.31Å; P445-E449 HydrophobicContact CB-CB 3.84Å; P445-E449 WeakPolarHBondContact CB-OE2 3.3Å; P445-L450 HydrophobicContact CB-CD2 4.33Å; P445-L450 HydrophobicContact CB-CG 4.34Å; P445-L450 HydrophobicContact CG-CD2 3.6Å; P445-L450 HydrophobicContact CG-CG 4.06Å
446	K	95.7	Very high	95.5	Very high	81 Å²	81	42.5 Å²	42.5	35%	0.352	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-93.6	168.2	172.1	-67.8	173.9	-178.3	165.3	0	111.4	I375 R376 P448 E449 L450	I375-K446 HydrophobicContact CD1-CB 4.06Å; I375-K446 HydrophobicContact CD1-CD 4.33Å; I375-K446 HydrophobicContact CD1-CG 3.98Å; I375-K446 HydrophobicContact CG1-CG 4.38Å; R376-K446 HydrophobicContact CG-CG 3.86Å; K446-P448 VanDerWaalsContact C-CD 3.48Å; K446-E449 PolarHBondContact N-OE2 3.49Å; K446-E449 WeakPolarHBondContact O-CB 3.3Å; K446-E449 PolarHBondContact O-N 3.49Å; K446-L450 PolarHBondContact O-N 3.33Å
447	Y	96.3	Very high	95.5	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-52.4	-41	-176.2	-49.5	-44.9	0	0	0	115.2	L307 S308 K311 I375 D378 V379 E449 L450 L451	L307-Y447 HydrophobicContact CB-CD1 4.22Å; L307-Y447 HydrophobicContact CB-CD2 4.5Å; L307-Y447 HydrophobicContact CB-CE1 3.73Å; L307-Y447 HydrophobicContact CB-CE2 3.99Å; L307-Y447 HydrophobicContact CD1-CE1 4.04Å; L307-Y447 HydrophobicContact CG-CE1 4.45Å; L307-Y447 WeakPolarHBondContact O-CE2 3.44Å; S308-Y447 WeakPolarHBondContact OG-CB 3.41Å; K311-Y447 HydrophobicContact CB-CD2 4.11Å; K311-Y447 HydrophobicContact CB-CE2 3.79Å; K311-Y447 HydrophobicContact CG-CD2 4.18Å; K311-Y447 HydrophobicContact CG-CE2 4.14Å; I375-Y447 HydrophobicContact CB-CD2 4.44Å; I375-Y447 HydrophobicContact CB-CE1 4.45Å; I375-Y447 HydrophobicContact CB-CE2 3.65Å; I375-Y447 HydrophobicContact CD1-CD2 3.89Å; I375-Y447 HydrophobicContact CD1-CE2 3.95Å; I375-Y447 HydrophobicContact CD1-CG 4.47Å; I375-Y447 HydrophobicContact CG1-CE2 4.38Å; I375-Y447 HydrophobicContact CG2-CE2 3.63Å; D378-Y447 WeakPolarHBondContact CB-OH 3.44Å; D378-Y447 PolarHBondContact OD2-OH 3.44Å; V379-Y447 HydrophobicContact CG2-CD1 3.93Å; V379-Y447 HydrophobicContact CG2-CE1 3.65Å; Y447-E449 VanDerWaalsContact C-N 3.34Å; Y447-E449 PolarHBondContact O-N 2.95Å; Y447-L450 HydrophobicContact CD1-CD1 4.37Å; Y447-L450 PolarHBondContact O-N 3.01Å; Y447-L451 WeakPolarHBondContact O-CB 3.36Å; Y447-L451 VanDerWaalsContact O-CG 3.28Å; Y447-L451 WeakPolarHBondContact O-CG 3.34Å; Y447-L451 PolarHBondContact O-N 2.82Å
448	P	95.9	Very high	95.4	Very high	80 Å²	80	52.1 Å²	52.1	52%	0.519	27%	0.271	S	S	.	.	H	α-helix	trans	-62.6	-38.3	176.7	-24.2	36	0	0	0	113.6	K446 A452	K446-P448 VanDerWaalsContact C-CD 3.48Å; P448-A452 PolarHBondContact O-N 3.14Å; P448-A452 VanDerWaalsContact O-N 3.16Å
449	E	96.4	Very high	95.5	Very high	99 Å²	99	51.4 Å²	51.4	46%	0.463	26%	0.264	S	S	.	.	H	α-helix	trans	-72.3	-33.2	177.4	-65.2	144.6	-154	0	0	111.5	P445 K446 Y447 A452 Q453	P445-E449 WeakPolarHBondContact CA-OE2 3.31Å; P445-E449 HydrophobicContact CB-CB 3.84Å; P445-E449 WeakPolarHBondContact CB-OE2 3.3Å; K446-E449 PolarHBondContact N-OE2 3.49Å; K446-E449 WeakPolarHBondContact O-CB 3.3Å; K446-E449 PolarHBondContact O-N 3.49Å; Y447-E449 VanDerWaalsContact C-N 3.34Å; Y447-E449 PolarHBondContact O-N 2.95Å; E449-A452 PolarHBondContact O-N 2.88Å; E449-Q453 WeakPolarHBondContact O-CG 3.44Å; E449-Q453 PolarHBondContact O-NE2 3.45Å
450	L	96.1	Very high	95.7	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-45.7	172	-71	174.6	0	0	0	111.9	V304 V379 F432 P445 K446 Y447 A452 Q453 I456	V304-L450 HydrophobicContact CG1-CB 4.04Å; V379-L450 HydrophobicContact CB-CD1 4.26Å; V379-L450 HydrophobicContact CG1-CD1 3.75Å; V379-L450 HydrophobicContact CG2-CD1 3.57Å; F432-L450 HydrophobicContact CD2-CD2 4.46Å; F432-L450 HydrophobicContact CE2-CB 4.27Å; F432-L450 HydrophobicContact CE2-CD2 3.75Å; F432-L450 HydrophobicContact CZ-CD2 3.94Å; P445-L450 HydrophobicContact CB-CD2 4.33Å; P445-L450 HydrophobicContact CB-CG 4.34Å; P445-L450 HydrophobicContact CG-CD2 3.6Å; P445-L450 HydrophobicContact CG-CG 4.06Å; K446-L450 PolarHBondContact O-N 3.33Å; Y447-L450 HydrophobicContact CD1-CD1 4.37Å; Y447-L450 PolarHBondContact O-N 3.01Å; L450-A452 PolarHBondContact O-N 3.43Å; L450-Q453 WeakPolarHBondContact O-CB 3.45Å; L450-Q453 WeakPolarHBondContact O-CG 3.4Å; L450-Q453 PolarHBondContact O-N 3.24Å; L450-I456 WeakPolarHBondContact O-CD1 3.27Å
451	L	96.8	Very high	95.9	Very high	26 Å²	26	53.3 Å²	53.3	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-26.8	175.8	-70.5	170.4	0	0	0	112.1	V304 Y447 Q453 I456 R457	V304-L451 HydrophobicContact CB-CD2 4.32Å; V304-L451 HydrophobicContact CG1-CD2 3.74Å; V304-L451 HydrophobicContact CG1-CG 3.81Å; Y447-L451 WeakPolarHBondContact O-CB 3.36Å; Y447-L451 VanDerWaalsContact O-CG 3.28Å; Y447-L451 WeakPolarHBondContact O-CG 3.34Å; Y447-L451 PolarHBondContact O-N 2.82Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; L451-I456 HydrophobicContact CD2-CD1 4.4Å; L451-I456 HydrophobicContact CD2-CG2 4.22Å; L451-R457 PolarHBondContact O-NE 3.29Å; L451-R457 PolarHBondContact O-NH2 3.44Å
452	A	96.6	Very high	96.1	Very high	58 Å²	58	53.6 Å²	53.6	48%	0.479	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-10.2	173.3	0	0	0	0	0	114.7	P448 E449 L450	P448-A452 PolarHBondContact O-N 3.14Å; P448-A452 VanDerWaalsContact O-N 3.16Å; E449-A452 PolarHBondContact O-N 2.88Å; L450-A452 PolarHBondContact O-N 3.43Å
453	Q	97.3	Very high	96.3	Very high	32 Å²	32	58.5 Å²	58.5	15%	0.15	31%	0.309	C	S	.	.	S	Bend	trans	-69.9	143.9	-176.4	-62.7	-54.5	-62.6	0	0	112.5	F432 E449 L450 L451 F455 I456 R457	F432-Q453 HydrophobicContact CD2-CB 3.88Å; F432-Q453 HydrophobicContact CD2-CG 3.99Å; F432-Q453 HydrophobicContact CE2-CB 4.31Å; F432-Q453 HydrophobicContact CE2-CG 4.3Å; E449-Q453 WeakPolarHBondContact O-CG 3.44Å; E449-Q453 PolarHBondContact O-NE2 3.45Å; L450-Q453 WeakPolarHBondContact O-CB 3.45Å; L450-Q453 WeakPolarHBondContact O-CG 3.4Å; L450-Q453 PolarHBondContact O-N 3.24Å; L451-Q453 VanDerWaalsContact C-N 3.34Å; Q453-F455 PolarHBondContact O-N 3.31Å; Q453-F455 VanDerWaalsContact O-N 3.16Å; Q453-I456 PolarHBondContact O-N 3.23Å; Q453-R457 PolarHBondContact O-N 3.12Å; Q453-R457 VanDerWaalsContact O-N 3.14Å
454	P	97.1	Very high	96.4	Very high	74 Å²	74	54.3 Å²	54.3	48%	0.481	29%	0.287	S	S	.	.	H	α-helix	trans	-52.5	-39.9	179.4	-29	35.5	0	0	0	113.9	Q428 I456 R457 I458	Q428-P454 HydrophobicContact CG-CB 4.18Å; P454-I456 PolarHBondContact O-N 3.3Å; P454-R457 PolarHBondContact O-N 3.45Å; P454-I458 WeakPolarHBondContact O-CB 3.45Å; P454-I458 WeakPolarHBondContact O-CD1 3.21Å; P454-I458 WeakPolarHBondContact O-CG1 3.15Å; P454-I458 PolarHBondContact O-N 3.38Å
455	F	97.8	Very high	96.4	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.009	31%	0.309	C	S	.	.	H	α-helix	trans	-56.6	-45.7	177.3	-176.5	-110.9	0	0	0	112.7	E293 T300 Q428 F429 F432 Q453 Y459	E293-F455 HydrophobicContact CG-CE2 4.03Å; E293-F455 HydrophobicContact CG-CZ 4.5Å; T300-F455 HydrophobicContact CG2-CD1 4.19Å; T300-F455 HydrophobicContact CG2-CE1 3.98Å; Q428-F455 HydrophobicContact CB-CB 4.22Å; F429-F455 HydrophobicContact CB-CD2 3.76Å; F429-F455 HydrophobicContact CB-CE2 3.44Å; F429-F455 VanDerWaalsContact CB-CE2 3.44Å; F429-F455 HydrophobicContact CB-CZ 4.11Å; F429-F455 HydrophobicContact CD2-CD1 4.43Å; F429-F455 HydrophobicContact CD2-CD2 4.28Å; F429-F455 AromaticContact CD2-CE1 3.73Å; F429-F455 HydrophobicContact CD2-CE1 3.73Å; F429-F455 AromaticContact CD2-CE2 3.56Å; F429-F455 HydrophobicContact CD2-CE2 3.56Å; F429-F455 AromaticContact CD2-CZ 3.25Å; F429-F455 HydrophobicContact CD2-CZ 3.25Å; F429-F455 HydrophobicContact CE2-CE1 4.23Å; F429-F455 AromaticContact CE2-CZ 3.85Å; F429-F455 HydrophobicContact CE2-CZ 3.85Å; F429-F455 HydrophobicContact CG-CD2 4.38Å; F429-F455 AromaticContact CG-CE2 3.66Å; F429-F455 HydrophobicContact CG-CE2 3.66Å; F429-F455 AromaticContact CG-CZ 3.82Å; F429-F455 HydrophobicContact CG-CZ 3.82Å; F432-F455 HydrophobicContact CB-CB 4.04Å; F432-F455 HydrophobicContact CB-CD1 4.02Å; F432-F455 HydrophobicContact CB-CG 4.18Å; F432-F455 HydrophobicContact CD1-CD1 4.05Å; F432-F455 HydrophobicContact CD1-CE1 4.38Å; F432-F455 HydrophobicContact CD2-CB 4.27Å; F432-F455 HydrophobicContact CD2-CD1 4.07Å; F432-F455 HydrophobicContact CG-CB 4.33Å; F432-F455 AromaticContact CG-CD1 3.76Å; F432-F455 HydrophobicContact CG-CD1 3.76Å; F432-F455 HydrophobicContact CG-CG 4.36Å; Q453-F455 PolarHBondContact O-N 3.31Å; Q453-F455 VanDerWaalsContact O-N 3.16Å; F455-Y459 AromaticContact CD2-CD2 3.81Å; F455-Y459 HydrophobicContact CD2-CD2 3.81Å; F455-Y459 AromaticContact CD2-CE2 3.69Å; F455-Y459 HydrophobicContact CD2-CE2 3.69Å; F455-Y459 AromaticContact CE2-CD2 3.64Å; F455-Y459 HydrophobicContact CE2-CD2 3.64Å; F455-Y459 AromaticContact CE2-CE2 3.34Å; F455-Y459 HydrophobicContact CE2-CE2 3.34Å; F455-Y459 HydrophobicContact CG-CD2 4.38Å; F455-Y459 HydrophobicContact CZ-CD2 4.08Å; F455-Y459 HydrophobicContact CZ-CE2 4.09Å; F455-Y459 VanDerWaalsContact O-CD2 3.29Å; F455-Y459 WeakPolarHBondContact O-CD2 3.36Å; F455-Y459 PolarHBondContact O-N 3.4Å; F455-Y459 VanDerWaalsContact O-N 3.16Å
456	I	97.3	Very high	96.4	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.3	-45	176.5	-69.3	-165.2	0	0	0	110.6	T300 V301 V304 F432 L450 L451 Q453 P454 I458 Y459 E460	T300-I456 HydrophobicContact CG2-CD1 3.97Å; T300-I456 HydrophobicContact CG2-CG1 3.99Å; V301-I456 HydrophobicContact CG2-CG2 4.17Å; V304-I456 HydrophobicContact CB-CD1 3.94Å; V304-I456 HydrophobicContact CG1-CD1 4.08Å; V304-I456 HydrophobicContact CG2-CD1 3.89Å; F432-I456 HydrophobicContact CD2-CG1 4.43Å; F432-I456 HydrophobicContact CE2-CD1 3.71Å; F432-I456 HydrophobicContact CE2-CG1 3.78Å; F432-I456 HydrophobicContact CZ-CD1 3.98Å; F432-I456 HydrophobicContact CZ-CG1 4.31Å; L450-I456 WeakPolarHBondContact O-CD1 3.27Å; L451-I456 HydrophobicContact CD2-CD1 4.4Å; L451-I456 HydrophobicContact CD2-CG2 4.22Å; Q453-I456 PolarHBondContact O-N 3.23Å; P454-I456 PolarHBondContact O-N 3.3Å; I456-I458 VanDerWaalsContact C-N 3.33Å; I456-I458 PolarHBondContact O-N 3.28Å; I456-Y459 CarbonylContact O-C 3.03Å; I456-Y459 PolarHBondContact O-N 2.63Å; I456-Y459 VanDerWaalsContact O-N 3.14Å; I456-E460 HydrophobicContact CG2-CG 3.95Å; I456-E460 WeakPolarHBondContact O-CB 3.48Å; I456-E460 WeakPolarHBondContact O-CG 3.33Å; I456-E460 PolarHBondContact O-N 3.23Å
457	R	97.4	Very high	96.4	Very high	128 Å²	128	56.2 Å²	56.2	48%	0.483	30%	0.303	S	S	.	.	H	α-helix	trans	-61.9	-37.7	-179.7	-62.5	-49.2	-168.2	-164.2	-5.1	113.7	L451 Q453 P454 E460 S461	L451-R457 PolarHBondContact O-NE 3.29Å; L451-R457 PolarHBondContact O-NH2 3.44Å; Q453-R457 PolarHBondContact O-N 3.12Å; Q453-R457 VanDerWaalsContact O-N 3.14Å; P454-R457 PolarHBondContact O-N 3.45Å; R457-E460 WeakPolarHBondContact CD-OE2 3.35Å; R457-E460 IonicContact CZ-OE2 3.67Å; R457-E460 IonicContact NE-OE2 3.83Å; R457-E460 IonicContact NH1-OE1 3.25Å; R457-E460 PolarHBondContact NH1-OE1 2.8Å; R457-E460 IonicContact NH1-OE2 2.73Å; R457-E460 PolarHBondContact NH1-OE2 2.6Å; R457-S461 PolarHBondContact O-OG 3.14Å; R457-S461 VanDerWaalsContact O-OG 3.09Å
458	I	96.6	Very high	96.4	Very high	77 Å²	77	61.1 Å²	61.1	40%	0.395	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-53.3	171.9	-69.3	162.5	0	0	0	109.6	Q428 P454 I456 E460 S461 A462	Q428-I458 HydrophobicContact CG-CD1 4.19Å; P454-I458 WeakPolarHBondContact O-CB 3.45Å; P454-I458 WeakPolarHBondContact O-CD1 3.21Å; P454-I458 WeakPolarHBondContact O-CG1 3.15Å; P454-I458 PolarHBondContact O-N 3.38Å; I456-I458 VanDerWaalsContact C-N 3.33Å; I456-I458 PolarHBondContact O-N 3.28Å; I458-E460 PolarHBondContact O-N 2.73Å; I458-S461 PolarHBondContact O-N 3.09Å; I458-S461 PolarHBondContact O-OG 3.06Å; I458-S461 VanDerWaalsContact O-OG 3.1Å; I458-A462 VanDerWaalsContact O-CB 3.24Å; I458-A462 WeakPolarHBondContact O-CB 3.1Å; I458-A462 PolarHBondContact O-N 3.22Å
459	Y	97.5	Very high	96.3	Very high	25 Å²	25	59.2 Å²	59.2	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-82.3	-10.3	-174.1	-70.8	-67.5	0	0	0	115.4	E293 Q294 G297 K298 F455 I456 A462 V464	E293-Y459 PolarHBondContact OE1-OH 3.09Å; Q294-Y459 HydrophobicContact CB-CE1 4.12Å; Q294-Y459 HydrophobicContact CG-CE1 4.17Å; G297-Y459 VanDerWaalsContact CA-CG 3.48Å; K298-Y459 WeakPolarHBondContact CD-O 3.39Å; K298-Y459 WeakPolarHBondContact CE-O 3.28Å; K298-Y459 PolarHBondContact NZ-O 2.94Å; F455-Y459 AromaticContact CD2-CD2 3.81Å; F455-Y459 HydrophobicContact CD2-CD2 3.81Å; F455-Y459 AromaticContact CD2-CE2 3.69Å; F455-Y459 HydrophobicContact CD2-CE2 3.69Å; F455-Y459 AromaticContact CE2-CD2 3.64Å; F455-Y459 HydrophobicContact CE2-CD2 3.64Å; F455-Y459 AromaticContact CE2-CE2 3.34Å; F455-Y459 HydrophobicContact CE2-CE2 3.34Å; F455-Y459 HydrophobicContact CG-CD2 4.38Å; F455-Y459 HydrophobicContact CZ-CD2 4.08Å; F455-Y459 HydrophobicContact CZ-CE2 4.09Å; F455-Y459 VanDerWaalsContact O-CD2 3.29Å; F455-Y459 WeakPolarHBondContact O-CD2 3.36Å; F455-Y459 PolarHBondContact O-N 3.4Å; F455-Y459 VanDerWaalsContact O-N 3.16Å; I456-Y459 CarbonylContact O-C 3.03Å; I456-Y459 PolarHBondContact O-N 2.63Å; I456-Y459 VanDerWaalsContact O-N 3.14Å; Y459-A462 HydrophobicContact CD1-CB 4.14Å; Y459-V464 HydrophobicContact CD1-CG2 4.22Å; Y459-V464 HydrophobicContact CE1-CG2 4.37Å
460	E	95.6	Very high	96.3	Very high	70 Å²	70	54.5 Å²	54.5	33%	0.327	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-48.6	163.4	-81.6	175.2	156.9	0	0	110.2	V301 I456 R457 I458	V301-E460 HydrophobicContact CG1-CG 3.78Å; V301-E460 HydrophobicContact CG2-CG 4.1Å; I456-E460 HydrophobicContact CG2-CG 3.95Å; I456-E460 WeakPolarHBondContact O-CB 3.48Å; I456-E460 WeakPolarHBondContact O-CG 3.33Å; I456-E460 PolarHBondContact O-N 3.23Å; R457-E460 WeakPolarHBondContact CD-OE2 3.35Å; R457-E460 IonicContact CZ-OE2 3.67Å; R457-E460 IonicContact NE-OE2 3.83Å; R457-E460 IonicContact NH1-OE1 3.25Å; R457-E460 PolarHBondContact NH1-OE1 2.8Å; R457-E460 IonicContact NH1-OE2 2.73Å; R457-E460 PolarHBondContact NH1-OE2 2.6Å; I458-E460 PolarHBondContact O-N 2.73Å
461	S	94.9	Very high	96.1	Very high	98 Å²	98	57 Å²	57	69%	0.685	30%	0.302	S	S	*	.	H	α-helix	trans	-87.9	-32.5	-174.5	57.8	0	0	0	0	114.6	R457 I458 K463	R457-S461 PolarHBondContact O-OG 3.14Å; R457-S461 VanDerWaalsContact O-OG 3.09Å; I458-S461 PolarHBondContact O-N 3.09Å; I458-S461 PolarHBondContact O-OG 3.06Å; I458-S461 VanDerWaalsContact O-OG 3.1Å; S461-K463 PolarHBondContact O-N 3.22Å
462	A	95.7	Very high	95.8	Very high	30 Å²	30	58.1 Å²	58.1	25%	0.248	31%	0.312	C	S	.	.	S	Bend	trans	-59.6	134.1	-176.6	0	0	0	0	0	112.9	K298 I458 Y459 V464	K298-A462 WeakPolarHBondContact CE-O 3.49Å; K298-A462 PolarHBondContact NZ-O 2.73Å; I458-A462 VanDerWaalsContact O-CB 3.24Å; I458-A462 WeakPolarHBondContact O-CB 3.1Å; I458-A462 PolarHBondContact O-N 3.22Å; Y459-A462 HydrophobicContact CD1-CB 4.14Å; A462-V464 HydrophobicContact CB-CG2 4.26Å; A462-V464 PolarHBondContact O-N 3.09Å
463	K	94.8	Very high	95.5	Very high	215 Å²	215	56.8 Å²	56.8	94%	0.935	30%	0.296	S	S	*	.			trans	-80.1	114.2	169.7	-65.6	179.2	-178.3	176.6	0	108.3	S461	S461-K463 PolarHBondContact O-N 3.22Å
464	V	96.3	Very high	95	Very high	27 Å²	27	58 Å²	58	16%	0.164	30%	0.301	C	S	.	.			trans	-126.7	127.1	-179.7	178.8	0	0	0	0	108.4	Q294 I295 K298 Y459 A462 V466	Q294-V464 HydrophobicContact CB-CG1 3.84Å; Q294-V464 HydrophobicContact CB-CG2 4.13Å; I295-V464 HydrophobicContact CD1-CG1 3.92Å; K298-V464 HydrophobicContact CG-CB 4.04Å; K298-V464 HydrophobicContact CG-CG1 4.4Å; K298-V464 HydrophobicContact CG-CG2 4.3Å; Y459-V464 HydrophobicContact CD1-CG2 4.22Å; Y459-V464 HydrophobicContact CE1-CG2 4.37Å; A462-V464 HydrophobicContact CB-CG2 4.26Å; A462-V464 PolarHBondContact O-N 3.09Å; V464-V466 VanDerWaalsContact C-N 3.25Å; V464-V466 HydrophobicContact CG1-CG2 4.08Å; V464-V466 PolarHBondContact O-N 3.34Å
465	D	96.3	Very high	94.4	Very high	88 Å²	88	58.5 Å²	58.5	47%	0.471	30%	0.3	S	S	.	.			trans	-83.1	68.1	-177.8	-163.1	-16.7	0	0	0	111.8	P467 N468 W469	D465-P467 VanDerWaalsContact C-CD 3.42Å; D465-P467 WeakPolarHBondContact OD1-CD 3.31Å; D465-N468 WeakPolarHBondContact OD1-CB 3.44Å; D465-N468 PolarHBondContact OD1-N 3.35Å; D465-N468 PolarHBondContact OD1-ND2 2.88Å; D465-N468 PolarHBondContact OD2-ND2 3.05Å; D465-W469 WeakPolarHBondContact O-CB 3.45Å; D465-W469 PolarHBondContact O-N 2.99Å; D465-W469 VanDerWaalsContact O-N 3.15Å
466	V	96.6	Very high	93.5	Very high	7 Å²	7	62.9 Å²	62.9	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-57.4	-40.3	172.8	-172.7	0	0	0	0	112.3	I295 K298 I328 I334 V464 F470	I295-V466 HydrophobicContact CD1-CB 4.34Å; I295-V466 HydrophobicContact CD1-CG1 4.48Å; I295-V466 HydrophobicContact CD1-CG2 3.99Å; K298-V466 HydrophobicContact CB-CG2 4.14Å; K298-V466 HydrophobicContact CG-CG2 3.98Å; I328-V466 HydrophobicContact CD1-CG1 3.68Å; I334-V466 HydrophobicContact CD1-CG1 4.24Å; V464-V466 VanDerWaalsContact C-N 3.25Å; V464-V466 HydrophobicContact CG1-CG2 4.08Å; V464-V466 PolarHBondContact O-N 3.34Å; V466-F470 VanDerWaalsContact O-CB 3.22Å; V466-F470 WeakPolarHBondContact O-CB 3.38Å; V466-F470 PolarHBondContact O-N 3.3Å
467	P	96	Very high	92.1	Very high	42 Å²	42	69 Å²	69	27%	0.273	35%	0.347	S	S	.	.	H	α-helix	trans	-58.8	-54.4	177.2	-22.9	32.5	0	0	0	113.7	D465 W469 F470 Q471	D465-P467 VanDerWaalsContact C-CD 3.42Å; D465-P467 WeakPolarHBondContact OD1-CD 3.31Å; P467-W469 PolarHBondContact O-N 2.67Å; P467-F470 PolarHBondContact O-N 2.82Å; P467-Q471 WeakPolarHBondContact O-CG 3.43Å; P467-Q471 PolarHBondContact O-N 3.48Å
468	N	95.4	Very high	90.3	Very high	106 Å²	106	68.1 Å²	68.1	57%	0.567	35%	0.351	S	S	*	.	H	α-helix	trans	-71.6	-33.7	-175.8	-71.1	-36	0	0	0	111.9	D465 F470 S472	D465-N468 WeakPolarHBondContact OD1-CB 3.44Å; D465-N468 PolarHBondContact OD1-N 3.35Å; D465-N468 PolarHBondContact OD1-ND2 2.88Å; D465-N468 PolarHBondContact OD2-ND2 3.05Å; N468-F470 VanDerWaalsContact C-N 3.35Å; N468-F470 PolarHBondContact O-N 3.45Å; N468-S472 WeakPolarHBondContact O-CB 3.48Å; N468-S472 PolarHBondContact O-N 3.28Å
469	W	94.9	Very high	88.5	Confident	40 Å²	40	74.6 Å²	74.6	15%	0.152	37%	0.37	C	S	.	.	H	α-helix	trans	-56.4	-50.1	167.8	171.7	78	0	0	0	111.1	F280 L283 V291 I295 I328 D465 P467 S472 I473	F280-W469 HydrophobicContact CE1-CH2 4.11Å; F280-W469 HydrophobicContact CE1-CZ3 4.39Å; L283-W469 HydrophobicContact CD1-CH2 3.54Å; L283-W469 HydrophobicContact CD1-CZ3 3.81Å; L283-W469 HydrophobicContact CD2-CH2 3.59Å; L283-W469 HydrophobicContact CD2-CZ2 3.96Å; L283-W469 HydrophobicContact CG-CH2 4.23Å; V291-W469 HydrophobicContact CG1-CH2 4Å; V291-W469 HydrophobicContact CG1-CZ2 3.96Å; V291-W469 HydrophobicContact CG2-CH2 4.49Å; V291-W469 HydrophobicContact CG2-CZ2 4.43Å; I295-W469 HydrophobicContact CD1-CB 3.89Å; I295-W469 HydrophobicContact CD1-CD2 3.73Å; I295-W469 HydrophobicContact CD1-CE3 3.84Å; I295-W469 HydrophobicContact CD1-CG 3.75Å; I295-W469 HydrophobicContact CG1-CD2 3.69Å; I295-W469 HydrophobicContact CG1-CE3 3.98Å; I295-W469 HydrophobicContact CG1-CG 3.94Å; I295-W469 HydrophobicContact CG1-CZ2 4.42Å; I295-W469 HydrophobicContact CG1-CZ3 4.46Å; I295-W469 HydrophobicContact CG2-CD2 4.41Å; I295-W469 HydrophobicContact CG2-CE3 3.91Å; I295-W469 HydrophobicContact CG2-CH2 3.9Å; I295-W469 HydrophobicContact CG2-CZ2 4.4Å; I295-W469 HydrophobicContact CG2-CZ3 3.64Å; I328-W469 HydrophobicContact CD1-CE3 4.47Å; I328-W469 HydrophobicContact CD1-CZ3 3.95Å; D465-W469 WeakPolarHBondContact O-CB 3.45Å; D465-W469 PolarHBondContact O-N 2.99Å; D465-W469 VanDerWaalsContact O-N 3.15Å; P467-W469 PolarHBondContact O-N 2.67Å; W469-S472 WeakPolarHBondContact O-CB 3.41Å; W469-S472 PolarHBondContact O-N 2.85Å; W469-S472 PolarHBondContact O-OG 3.03Å; W469-I473 HydrophobicContact CZ2-CG1 4.32Å; W469-I473 PolarHBondContact O-N 3.24Å
470	F	94.5	Very high	86.8	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-65.5	-43.3	-177	179.7	-113.1	0	0	0	112.9	M278 L283 I328 E330 V466 P467 N468 S472 I473 K474	M278-F470 HydrophobicContact CE-CE2 3.76Å; M278-F470 HydrophobicContact CE-CZ 3.87Å; M278-F470 HydrophobicContact CG-CE2 3.69Å; M278-F470 HydrophobicContact CG-CZ 3.91Å; M278-F470 HydrophobicContact SD-CE2 3.8Å; M278-F470 HydrophobicContact SD-CZ 4.33Å; L283-F470 HydrophobicContact CD1-CD2 3.92Å; L283-F470 HydrophobicContact CD1-CE2 4Å; I328-F470 HydrophobicContact CD1-CB 4.04Å; I328-F470 HydrophobicContact CD1-CD2 3.75Å; I328-F470 HydrophobicContact CD1-CE2 4.41Å; I328-F470 HydrophobicContact CD1-CG 3.93Å; I328-F470 HydrophobicContact CG1-CD2 4.14Å; I328-F470 HydrophobicContact CG1-CE2 4.39Å; I328-F470 HydrophobicContact CG1-CG 4.26Å; I328-F470 HydrophobicContact CG2-CD2 4.02Å; I328-F470 HydrophobicContact CG2-CE2 3.6Å; I328-F470 HydrophobicContact CG2-CZ 4.11Å; E330-F470 HydrophobicContact CG-CD1 4.32Å; E330-F470 HydrophobicContact CG-CE1 3.84Å; V466-F470 VanDerWaalsContact O-CB 3.22Å; V466-F470 WeakPolarHBondContact O-CB 3.38Å; V466-F470 PolarHBondContact O-N 3.3Å; P467-F470 PolarHBondContact O-N 2.82Å; N468-F470 VanDerWaalsContact C-N 3.35Å; N468-F470 PolarHBondContact O-N 3.45Å; F470-S472 VanDerWaalsContact C-N 3.31Å; F470-S472 PolarHBondContact O-N 2.97Å; F470-I473 PolarHBondContact O-N 3.34Å; F470-K474 HydrophobicContact CD1-CD 4.27Å; F470-K474 HydrophobicContact CE1-CD 3.75Å; F470-K474 HydrophobicContact CZ-CD 4.05Å; F470-K474 HydrophobicContact CZ-CG 4.48Å; F470-K474 PolarHBondContact O-N 3.21Å
471	Q	92.4	Very high	85	Confident	52 Å²	52	79.4 Å²	79.4	24%	0.243	41%	0.411	C	S	.	.	H	α-helix	trans	-63.6	-37.2	174.9	-61.2	-71.4	25.1	0	0	111.1	P467 I473 K474 D475	P467-Q471 WeakPolarHBondContact O-CG 3.43Å; P467-Q471 PolarHBondContact O-N 3.48Å; Q471-I473 VanDerWaalsContact C-N 3.27Å; Q471-I473 PolarHBondContact O-N 3.45Å; Q471-K474 CarbonylContact O-C 3.55Å; Q471-K474 WeakPolarHBondContact O-CA 3.46Å; Q471-K474 WeakPolarHBondContact O-CB 3.45Å; Q471-K474 PolarHBondContact O-N 2.86Å; Q471-D475 PolarHBondContact O-N 3.27Å
472	S	91.7	Very high	82.7	Confident	50 Å²	50	77.6 Å²	77.6	35%	0.35	41%	0.408	S	S	.	.	H	α-helix	trans	-59.8	-35	175.2	83.5	0	0	0	0	113.1	N468 W469 F470 N476	N468-S472 WeakPolarHBondContact O-CB 3.48Å; N468-S472 PolarHBondContact O-N 3.28Å; W469-S472 WeakPolarHBondContact O-CB 3.41Å; W469-S472 PolarHBondContact O-N 2.85Å; W469-S472 PolarHBondContact O-OG 3.03Å; F470-S472 VanDerWaalsContact C-N 3.31Å; F470-S472 PolarHBondContact O-N 2.97Å; S472-N476 WeakPolarHBondContact O-CB 3.21Å; S472-N476 PolarHBondContact O-N 3.46Å; S472-N476 VanDerWaalsContact O-N 3.12Å; S472-N476 PolarHBondContact O-ND2 3.16Å
473	I	90.1	Very high	80.1	Confident	30 Å²	30	80.8 Å²	80.8	15%	0.154	42%	0.421	C	S	.	.	H	α-helix	trans	-68.6	-37.8	174.5	-60.3	-61.9	0	0	0	110.8	W469 F470 Q471 R477	W469-I473 HydrophobicContact CZ2-CG1 4.32Å; W469-I473 PolarHBondContact O-N 3.24Å; F470-I473 PolarHBondContact O-N 3.34Å; Q471-I473 VanDerWaalsContact C-N 3.27Å; Q471-I473 PolarHBondContact O-N 3.45Å; I473-R477 PolarHBondContact O-N 2.91Å
474	K	86.1	Confident	77.7	Confident	56 Å²	56	76 Å²	76	24%	0.243	41%	0.411	C	S	.	.	H	α-helix	trans	-68.9	-43.7	175.4	-73.1	173.6	52.8	-161.9	0	112.9	M278 E330 F470 Q471 R477 L478	M278-K474 HydrophobicContact CE-CG 4.46Å; E330-K474 IonicContact OE1-NZ 2.59Å; E330-K474 PolarHBondContact OE1-NZ 3.43Å; E330-K474 IonicContact OE2-NZ 3.69Å; E330-K474 PolarHBondContact OE2-NZ 3.44Å; F470-K474 HydrophobicContact CD1-CD 4.27Å; F470-K474 HydrophobicContact CE1-CD 3.75Å; F470-K474 HydrophobicContact CZ-CD 4.05Å; F470-K474 HydrophobicContact CZ-CG 4.48Å; F470-K474 PolarHBondContact O-N 3.21Å; Q471-K474 CarbonylContact O-C 3.55Å; Q471-K474 WeakPolarHBondContact O-CA 3.46Å; Q471-K474 WeakPolarHBondContact O-CB 3.45Å; Q471-K474 PolarHBondContact O-N 2.86Å; K474-R477 VanDerWaalsContact O-CB 3.31Å; K474-R477 WeakPolarHBondContact O-CB 3.32Å; K474-R477 PolarHBondContact O-N 3.47Å; K474-R477 VanDerWaalsContact O-N 3.08Å; K474-L478 PolarHBondContact O-N 3.05Å
475	D	85.1	Confident	75.3	Confident	86 Å²	86	79.9 Å²	79.9	46%	0.46	44%	0.436	S	S	.	.	H	α-helix	trans	-69.7	-35.3	-177.6	-68.8	-14.5	0	0	0	111.8	Q471 R477 L478 R479	Q471-D475 PolarHBondContact O-N 3.27Å; D475-R477 PolarHBondContact O-N 3.12Å; D475-L478 PolarHBondContact O-N 3.31Å; D475-L478 VanDerWaalsContact O-N 3.14Å; D475-R479 PolarHBondContact O-N 2.68Å
476	N	78.2	Confident	72.8	Confident	94 Å²	94	82.4 Å²	82.4	50%	0.503	45%	0.448	S	S	.	.	H	α-helix	trans	-60.3	-32.5	170.3	-81	-53.2	0	0	0	112.3	S472 A480	S472-N476 WeakPolarHBondContact O-CB 3.21Å; S472-N476 PolarHBondContact O-N 3.46Å; S472-N476 VanDerWaalsContact O-N 3.12Å; S472-N476 PolarHBondContact O-ND2 3.16Å; N476-A480 VanDerWaalsContact O-CB 3.24Å; N476-A480 WeakPolarHBondContact O-CB 3.46Å; N476-A480 PolarHBondContact O-N 2.99Å
477	R	68.8	Low	70	Confident	129 Å²	129	90.8 Å²	90.8	49%	0.487	49%	0.487	S	S	.	.	H	α-helix	trans	-68.8	-41.9	172	178.5	-172.1	172	171.4	-4	112.1	I473 K474 D475 R479 A480 N481	I473-R477 PolarHBondContact O-N 2.91Å; K474-R477 VanDerWaalsContact O-CB 3.31Å; K474-R477 WeakPolarHBondContact O-CB 3.32Å; K474-R477 PolarHBondContact O-N 3.47Å; K474-R477 VanDerWaalsContact O-N 3.08Å; D475-R477 PolarHBondContact O-N 3.12Å; R477-R479 VanDerWaalsContact C-N 3.29Å; R477-R479 PolarHBondContact O-N 3.25Å; R477-A480 PolarHBondContact O-N 3.37Å; R477-N481 VanDerWaalsContact O-CB 3.27Å; R477-N481 WeakPolarHBondContact O-CB 3.02Å; R477-N481 PolarHBondContact O-N 3.32Å; R477-N481 PolarHBondContact O-OD1 3.17Å
478	L	58.8	Low	67	Low	108 Å²	108	99.3 Å²	99.3	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-59.8	-42.8	177.2	-65.3	176.8	0	0	0	110.9	K474 D475	K474-L478 PolarHBondContact O-N 3.05Å; D475-L478 PolarHBondContact O-N 3.31Å; D475-L478 VanDerWaalsContact O-N 3.14Å
479	R	60	Low	64.2	Low	213 Å²	213	98.9 Å²	98.9	80%	0.804	53%	0.525	S	S	*	.	H	α-helix	trans	-65.5	-45.5	174.3	-71.7	178.8	163.3	-166.3	-7.4	113	D475 R477 N481 G482	D475-R479 PolarHBondContact O-N 2.68Å; R477-R479 VanDerWaalsContact C-N 3.29Å; R477-R479 PolarHBondContact O-N 3.25Å; R479-N481 VanDerWaalsContact C-N 3.31Å; R479-N481 PolarHBondContact O-N 3.03Å; R479-G482 PolarHBondContact O-N 3.11Å
480	A	60.2	Low	61.4	Low	83 Å²	83	102.9 Å²	102.9	69%	0.686	55%	0.554	S	S	*	*	H	α-helix	trans	-69.4	-25.4	-179.6	0	0	0	0	0	113.8	N476 R477	N476-A480 VanDerWaalsContact O-CB 3.24Å; N476-A480 WeakPolarHBondContact O-CB 3.46Å; N476-A480 PolarHBondContact O-N 2.99Å; R477-A480 PolarHBondContact O-N 3.37Å
481	N	57.6	Low	58.5	Low	114 Å²	114	107.8 Å²	107.8	61%	0.61	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-2.8	179.3	-79	26.7	0	0	0	114.2	R477 R479	R477-N481 VanDerWaalsContact O-CB 3.27Å; R477-N481 WeakPolarHBondContact O-CB 3.02Å; R477-N481 PolarHBondContact O-N 3.32Å; R477-N481 PolarHBondContact O-OD1 3.17Å; R479-N481 VanDerWaalsContact C-N 3.31Å; R479-N481 PolarHBondContact O-N 3.03Å
482	G	48.3	Very low	55.8	Low	59 Å²	59	112 Å²	112	61%	0.608	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.3	47.3	163.7	0	0	0	0	0	116.4	R479 P484	R479-G482 PolarHBondContact O-N 3.11Å; G482-P484 WeakPolarHBondContact O-CD 3.33Å
483	D	40.6	Very low	52.9	Low	97 Å²	97	113 Å²	113	52%	0.519	64%	0.642	S	S	.	*			trans	-91	108.4	161.8	-171	-19.6	0	0	0	110	T485	D483-T485 VanDerWaalsContact C-N 3.27Å; D483-T485 PolarHBondContact O-N 3.08Å; D483-T485 WeakPolarHBondContact OD1-CB 3.5Å; D483-T485 WeakPolarHBondContact OD1-CG2 3.47Å; D483-T485 PolarHBondContact OD1-N 3.08Å; D483-T485 PolarHBondContact OD1-OG1 3.16Å; D483-T485 PolarHBondContact OD2-OG1 2.95Å
484	P	43	Very low	50	Low	114 Å²	114	117.6 Å²	117.6	74%	0.74	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-7.1	-179.5	33.2	-36.3	0	0	0	113.7	G482 L486	G482-P484 WeakPolarHBondContact O-CD 3.33Å; P484-L486 PolarHBondContact O-N 3.3Å
485	T	47.6	Very low	47.3	Very low	110 Å²	110	119.8 Å²	119.8	68%	0.675	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	-14.9	-171.8	67.3	0	0	0	0	114.1	D483 Q487	D483-T485 VanDerWaalsContact C-N 3.27Å; D483-T485 PolarHBondContact O-N 3.08Å; D483-T485 WeakPolarHBondContact OD1-CB 3.5Å; D483-T485 WeakPolarHBondContact OD1-CG2 3.47Å; D483-T485 PolarHBondContact OD1-N 3.08Å; D483-T485 PolarHBondContact OD1-OG1 3.16Å; D483-T485 PolarHBondContact OD2-OG1 2.95Å; T485-Q487 PolarHBondContact O-N 2.9Å
486	L	43.6	Very low	44.6	Very low	140 Å²	140	124 Å²	124	73%	0.733	73%	0.726	S	S	*	*			trans	-98	52.5	177.4	-70.8	177.3	0	0	0	113.4	P484 R488	P484-L486 PolarHBondContact O-N 3.3Å; L486-R488 PolarHBondContact O-N 3.16Å; L486-R488 VanDerWaalsContact O-N 3.08Å
487	Q	36.7	Very low	42.2	Very low	183 Å²	183	123.1 Å²	123.1	86%	0.855	74%	0.74	S	S	*	*			trans	-65.7	100.3	148.5	-75.1	-168.2	-5.4	0	0	108.3	T485 A489	T485-Q487 PolarHBondContact O-N 2.9Å; Q487-A489 PolarHBondContact O-N 3.38Å; Q487-A489 VanDerWaalsContact O-N 3.15Å
488	R	34.2	Very low	40.4	Very low	221 Å²	221	123.4 Å²	123.4	83%	0.834	76%	0.761	S	S	*	*			trans	-56.8	120.1	168.9	169.1	179.9	-83.4	-174.2	-4.8	108.2	L486 T490	L486-R488 PolarHBondContact O-N 3.16Å; L486-R488 VanDerWaalsContact O-N 3.08Å; R488-T490 PolarHBondContact O-N 3.09Å
489	A	35.6	Very low	38.8	Very low	98 Å²	98	121.7 Å²	121.7	81%	0.81	77%	0.77	S	S	*	*			trans	-60.9	102.3	170.6	0	0	0	0	0	110.2	Q487	Q487-A489 PolarHBondContact O-N 3.38Å; Q487-A489 VanDerWaalsContact O-N 3.15Å
490	T	36.8	Very low	37.4	Very low	123 Å²	123	117 Å²	117	76%	0.755	78%	0.777	S	S	*	*			trans	-81.4	112.7	164	30.8	0	0	0	0	108.5	R488	R488-T490 PolarHBondContact O-N 3.09Å
491	A	33.3	Very low	35.8	Very low	104 Å²	104	116.4 Å²	116.4	86%	0.86	78%	0.778	S	S	*	*			trans	-64	132.7	-174.9	0	0	0	0	0	112.3
492	T	35.2	Very low	34.4	Very low	141 Å²	141	116.7 Å²	116.7	87%	0.865	79%	0.789	S	S	*	*			trans	-87.1	108.4	173.2	47.5	0	0	0	0	111.1
493	G	31.6	Very low	33.4	Very low	70 Å²	70	121.9 Å²	121.9	72%	0.722	80%	0.802	S	S	*	*			trans	81.2	115	145.2	0	0	0	0	0	118.6
494	S	28.8	Very low	32.9	Very low	126 Å²	126	122 Å²	122	88%	0.881	82%	0.817	S	S	*	*			trans	-154	101.6	135.4	-82.8	0	0	0	0	109.1
495	A	29.4	Very low	32.1	Very low	103 Å²	103	119.8 Å²	119.8	85%	0.851	82%	0.815	S	S	*	*			trans	-132.9	122	167.5	0	0	0	0	0	107.1
496	I	29.1	Very low	31.1	Very low	174 Å²	174	121 Å²	121	89%	0.892	83%	0.828	S	S	*	*			trans	-143.9	138.5	-177.9	-57.5	178.5	0	0	0	107
497	G	27.7	Very low	30.3	Very low	76 Å²	76	118.5 Å²	118.5	78%	0.784	84%	0.835	S	S	*	*			trans	129.9	80.7	168.2	0	0	0	0	0	114.9
498	S	30	Very low	29.7	Very low	134 Å²	134	115.9 Å²	115.9	94%	0.937	84%	0.837	S	S	*	*			trans	-82.5	161.9	172.8	-48	0	0	0	0	112.3
499	G	26.8	Very low	29.3	Very low	72 Å²	72	109.2 Å²	109.2	74%	0.742	84%	0.837	S	S	*	*			trans	-169.2	103.2	169.7	0	0	0	0	0	116.4
500	A	29	Very low	28.9	Very low	115 Å²	115	110.3 Å²	110.3	95%	0.95	84%	0.839	S	S	*	*			trans	58.7	146.6	162.9	0	0	0	0	0	119.9
501	G	27.2	Very low	28.6	Very low	70 Å²	70	109.5 Å²	109.5	72%	0.722	85%	0.845	S	S	*	*			cis	167.6	155.2	-10.1	0	0	0	0	0	113.8
502	S	27.6	Very low	28.3	Very low	120 Å²	120	108.3 Å²	108.3	84%	0.839	84%	0.842	S	S	*	*			trans	66.4	152	174.6	-74.3	0	0	0	0	117.3
503	L	27.9	Very low	28	Very low	169 Å²	169	105.5 Å²	105.5	89%	0.885	84%	0.841	S	S	*	*			cis	-143.2	-179.5	4.1	-122.9	158.9	0	0	0	110.3
504	A	29.2	Very low	28.1	Very low	100 Å²	100	106.7 Å²	106.7	83%	0.826	85%	0.845	S	S	*	*			trans	-126.9	163	-166	0	0	0	0	0	115.7
505	G	26.2	Very low	28.2	Very low	67 Å²	67	107 Å²	107	69%	0.691	84%	0.841	S	S	*	*			trans	155.7	112	171.9	0	0	0	0	0	110.3
506	S	28.4	Very low	28.3	Very low	136 Å²	136	111 Å²	111	95%	0.951	84%	0.839	S	S	*	*				82.7	114.9	56.3	-64.3	0	0	0	0	113.7
507	G	25	Very low	28.6	Very low	86 Å²	86	113.6 Å²	113.6	89%	0.887	84%	0.839	S	S	*	*			trans	151.1	128.5	171.3	0	0	0	0	0	114
508	S	25.6	Very low	28.5	Very low	128 Å²	128	113.2 Å²	113.2	90%	0.895	84%	0.835	S	S	*	*			trans	-116.3	143.9	-178.3	56.7	0	0	0	0	112.5
509	G	25.3	Very low	28.4	Very low	81 Å²	81	118.1 Å²	118.1	84%	0.835	83%	0.833	S	S	*	*			trans	-156.8	118.3	175.5	0	0	0	0	0	114.7
510	S	27.3	Very low	28.6	Very low	121 Å²	121	118.9 Å²	118.9	85%	0.846	83%	0.832	S	S	*	*			trans	-53.7	135.7	179.1	-50.9	0	0	0	0	114.6
511	A	29.7	Very low	28.6	Very low	107 Å²	107	118.7 Å²	118.7	88%	0.884	82%	0.82	S	S	*	*				80.4	149.5	92.9	0	0	0	0	0	115.7
512	G	26.8	Very low	28.6	Very low	78 Å²	78	121 Å²	121	80%	0.804	82%	0.82	S	S	*	*			cis	175	176.6	-9	0	0	0	0	0	114.2
513	G	29.8	Very low	28.5	Very low	82 Å²	82	126.3 Å²	126.3	85%	0.845	82%	0.823	S	S	*	*			trans	91.3	145.5	147.6	0	0	0	0	0	118.6
514	A	33.2	Very low	28.6	Very low	96 Å²	96	123.1 Å²	123.1	79%	0.793	82%	0.821	S	S	*	*			cis	-163.4	-170.7	-7.1	0	0	0	0	0	110.8
515	V	30.3	Very low	28.5	Very low	131 Å²	131	122.1 Å²	122.1	79%	0.794	82%	0.82	S	S	*	*			trans	80.4	129.5	173.8	176.3	0	0	0	0	114.4
516	K	32.7	Very low	28.5	Very low	187 Å²	187	127.9 Å²	127.9	81%	0.813	83%	0.829	S	S	*	*			cis	-148.2	-158.7	-5.5	-124.1	175.7	-167.8	176.6	0	112.8
517	Y	33.9	Very low	28.3	Very low	230 Å²	230	126.6 Å²	126.6	90%	0.902	82%	0.82	S	S	*	*			trans	-114.2	170.4	-166.3	-72.3	-101.5	0	0	0	113.6
518	G	27.5	Very low	28.9	Very low	68 Å²	68	128.7 Å²	128.7	70%	0.701	82%	0.818	S	S	*	*			cis	152.3	-175.7	-7.4	0	0	0	0	0	115.4
519	R	27.8	Very low	28.9	Very low	237 Å²	237	129.4 Å²	129.4	89%	0.894	82%	0.817	S	S	*	*			trans	67.8	107	164.9	-157.3	172.4	-174.8	161.2	1.2	118.1
520	A	30.2	Very low	28.9	Very low	87 Å²	87	132.8 Å²	132.8	72%	0.719	82%	0.816	S	S	*	*				76.5	151.6	78.5	0	0	0	0	0	115.1
521	T	28.8	Very low	29.8	Very low	112 Å²	112	131.5 Å²	131.5	69%	0.687	81%	0.805	S	S	*	*			cis	-161.8	159.9	27	-24.8	0	0	0	0	113.7
522	T	27.6	Very low	29.6	Very low	117 Å²	117	136 Å²	136	72%	0.718	81%	0.808	S	S	*	*			trans	54.9	129.3	153.1	41.9	0	0	0	0	123.3
523	Y	26.2	Very low	29.6	Very low	233 Å²	233	141.4 Å²	141.4	91%	0.914	81%	0.809	S	S	*	*				-162.4	161	109.8	-109.8	-72.4	0	0	0	111.6
524	A	29.5	Very low	29.3	Very low	101 Å²	101	143.6 Å²	143.6	84%	0.835	81%	0.806	S	S	*	*			trans	-151.1	152.4	175.9	0	0	0	0	0	111.4
525	G	26.7	Very low	29	Very low	79 Å²	79	146.9 Å²	146.9	81%	0.814	81%	0.809	S	S	*	*			trans	165.9	156.5	179.1	0	0	0	0	0	112.5
526	Q	27	Very low	28.7	Very low	189 Å²	189	150.2 Å²	150.2	88%	0.883	81%	0.813	S	S	*	*			trans	-118.6	164.7	-172.8	-68.5	-178.4	-11.5	0	0	113.7
527	S	23.1	Very low	28.9	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	81%	0.808	S	S	*	*			trans	98	140.3	163.4	-44.5	0	0	0	0	117.6
528	P	37.6	Very low	28.5	Very low	130 Å²	130	142.5 Å²	142.5	84%	0.844	81%	0.808	S	S	*	*			trans	-122.1	128.9	154.5	35	-22.5	0	0	0	112.4
529	T	26	Very low	28.5	Very low	143 Å²	143	147.2 Å²	147.2	88%	0.877	81%	0.811	S	S	*	*			trans	-124.6	157	168.7	49.5	0	0	0	0	112.1
530	N	24.6	Very low	28.7	Very low	151 Å²	151	142.9 Å²	142.9	81%	0.807	80%	0.804	S	S	*	*			trans	-70.3	-175.5	-177	-148.2	31.8	0	0	0	112.6
531	P	46.3	Very low	28.6	Very low	95 Å²	95	144.8 Å²	144.8	62%	0.617	81%	0.809	S	S	*	*				-121.7	175.1	-64.1	34.9	-21.5	0	0	0	113.4
532	Q	25.5	Very low	28.5	Very low	200 Å²	200	144.6 Å²	144.6	94%	0.935	81%	0.813	S	S	*	*			trans	-160.9	171.4	130.3	-114.2	-177.2	29.3	0	0	114.1
533	K	27	Very low	28.5	Very low	193 Å²	193	150.6 Å²	150.6	84%	0.839	82%	0.824	S	S	*	*			trans	-100.1	150	-170.7	-60.6	172.1	-179.6	171.1	0	112.4
534	T	23.8	Very low	28.6	Very low	128 Å²	128	148.1 Å²	148.1	79%	0.785	82%	0.82	S	S	*	*				177.6	145.3	114.4	-75.2	0	0	0	0	110.7
535	I	26.7	Very low	28.5	Very low	165 Å²	165	150.3 Å²	150.3	85%	0.846	81%	0.814	S	S	*	*			trans	146.3	125	154.4	-78.5	160.3	0	0	0	111.2
536	K	24.4	Very low	28.5	Very low	200 Å²	200	155.6 Å²	155.6	87%	0.87	82%	0.817	S	S	*	*			trans	-176.7	164.4	163.5	-104.4	-175.6	-174.5	-175.6	0	106.8
537	P	37	Very low	28.6	Very low	110 Å²	110	154.3 Å²	154.3	71%	0.714	81%	0.811	S	S	*	*			cis	-130.6	165.5	-7.7	39.8	-24.8	0	0	0	114.7
538	T	25	Very low	28.9	Very low	146 Å²	146	154.4 Å²	154.4	90%	0.896	81%	0.812	S	S	*	*			trans	-153.9	160.4	152.5	-33.1	0	0	0	0	109.9
539	Q	28.1	Very low	28.3	Very low	167 Å²	167	157.1 Å²	157.1	78%	0.78	81%	0.813	S	S	*	*			trans	-124.3	145	-173.9	-64	-173.7	5.7	0	0	114.1
540	I	31.8	Very low	28.4	Very low	145 Å²	145	159.7 Å²	159.7	74%	0.744	81%	0.813	S	S	*	*			trans	25	125.3	133.1	-45.9	169.9	0	0	0	117.8
541	P	28.8	Very low	28.4	Very low	128 Å²	128	160.4 Å²	160.4	83%	0.831	81%	0.809	S	S	*	*				-122	157.9	119.3	-1	21.2	0	0	0	113.8
542	S	26.6	Very low	27.3	Very low	108 Å²	108	164.9 Å²	164.9	76%	0.755	82%	0.824	S	S	*	*			trans	-101.2	148.4	178.9	54.5	0	0	0	0	113
543	Y	26.9	Very low	27.4	Very low	242 Å²	242	163.5 Å²	163.5	95%	0.949	82%	0.817	S	S	*	*			trans	-97.9	144.7	169.8	-102.4	-88.2	0	0	0	113.1
544	Q	27.3	Very low	27.3	Very low	181 Å²	181	160.3 Å²	160.3	85%	0.846	82%	0.819	S	S	*	*			trans	-126.9	149.9	179.4	-174.9	169.7	-15.2	0	0	112.2
545	Q	28.4	Very low	27.3	Very low	148 Å²	148	158.8 Å²	158.8	69%	0.692	82%	0.82	S	S	*	*			trans	-49.4	133.1	174.8	175.1	-174.8	19.4	0	0	115.2
546	Q	27.5	Very low	27.3	Very low	189 Å²	189	157.7 Å²	157.7	88%	0.883	82%	0.821	S	S	*	*			trans	-143.1	143.2	151.4	-160.2	164.7	1.8	0	0	111
547	Q	28	Very low	27.3	Very low	162 Å²	162	157 Å²	157	76%	0.757	82%	0.821	S	S	*	*			trans	-130.4	161.5	177.1	-105.8	-174.9	-11.2	0	0	109.4
548	S	29	Very low	26.7	Very low	111 Å²	111	159.9 Å²	159.9	78%	0.776	83%	0.829	S	S	*	*			trans	54.8	110.8	170	62.3	0	0	0	0	117.5
549	Q	25.9	Very low	27.2	Very low	187 Å²	187	158.2 Å²	158.2	87%	0.874	82%	0.821	S	S	*	*				-157.6	128.1	111	-78.4	-145.4	-0.9	0	0	110
550	F	27.3	Very low	26.9	Very low	198 Å²	198	158.7 Å²	158.7	87%	0.868	82%	0.823	S	S	*	*			trans	-164.3	143.7	144.2	-108.1	-64.5	0	0	0	110.6
551	F	26	Very low	26.5	Very low	165 Å²	165	157.3 Å²	157.3	72%	0.724	82%	0.821	S	S	*	*			trans	57.2	95.3	169.4	-89.4	-82.3	0	0	0	120.9
552	M	22.9	Very low	26.2	Very low	190 Å²	190	156.7 Å²	156.7	94%	0.936	82%	0.816	S	S	*	*				-143.4	94.4	121.7	-99.1	-162.7	73.1	0	0	110.3
553	Q	26.5	Very low	25.9	Very low	171 Å²	171	157.2 Å²	157.2	80%	0.799	82%	0.815	S	S	*	*			trans	-149.7	116.4	159.9	-78.3	-162	-3	0	0	110.4
554	S	25.9	Very low	25.7	Very low	125 Å²	125	150.7 Å²	150.7	87%	0.874	80%	0.8	S	S	*	*			trans	179.9	105.1	158.7	-83.6	0	0	0	0	110.1
555	A	24.1	Very low	25.5	Very low	97 Å²	97	148 Å²	148	80%	0.802	80%	0.796	S	S	*	*			trans	-173.6	73.5	161.5	0	0	0	0	0	113.2
556	T	26.4	Very low	26	Very low	142 Å²	142	146 Å²	146	87%	0.871	80%	0.796	S	S	*	*			trans	164.8	140.1	154.1	28.5	0	0	0	0	107.2
557	Q	24.9	Very low	25.9	Very low	185 Å²	185	143.6 Å²	143.6	86%	0.864	79%	0.794	S	S	*	*			cis	-129.4	-171.4	23.7	-59	176.2	24.2	0	0	113.3
558	L	23.7	Very low	25.9	Very low	171 Å²	171	139.2 Å²	139.2	90%	0.895	79%	0.785	S	S	*	*			trans	-98.2	172.5	-179.4	-84.7	163.2	0	0	0	112.4
559	P	34.8	Very low	25.8	Very low	110 Å²	110	140.2 Å²	140.2	71%	0.714	79%	0.787	S	S	*	*			trans	-112	166.3	-152.1	41.7	-37.1	0	0	0	116.9
560	Q	23.3	Very low	25.9	Very low	177 Å²	177	137.4 Å²	137.4	83%	0.827	78%	0.783	S	S	*	*			trans	-146.5	123.2	150.8	-67.6	-163.4	16.7	0	0	106.7
561	T	22	Very low	26.1	Very low	116 Å²	116	134.4 Å²	134.4	71%	0.712	78%	0.776	S	S	*	*				54.5	132.2	81	60.8	0	0	0	0	113.2
562	T	22.3	Very low	26.1	Very low	116 Å²	116	130.9 Å²	130.9	71%	0.712	77%	0.771	S	S	*	*			cis	-169.9	164.8	26.5	-11.3	0	0	0	0	112
563	T	21.3	Very low	26.3	Very low	119 Å²	119	131.3 Å²	131.3	73%	0.73	77%	0.768	S	S	*	*			trans	69.1	137.9	139.4	-66.4	0	0	0	0	120.2
564	T	22.9	Very low	26.2	Very low	104 Å²	104	126.7 Å²	126.7	64%	0.638	77%	0.766	S	S	*	*			cis	-171.5	141.5	-7.8	30.4	0	0	0	0	113.5
565	T	22.7	Very low	26.3	Very low	126 Å²	126	124.2 Å²	124.2	77%	0.773	76%	0.761	S	S	*	*			trans	56.2	-178.1	142.9	63.9	0	0	0	0	120.2
566	P	38	Very low	26.5	Very low	106 Å²	106	126.2 Å²	126.2	69%	0.688	77%	0.769	S	S	*	*			cis	-128.6	164.5	-11.8	11.9	14.9	0	0	0	117.7
567	T	25.8	Very low	26.6	Very low	138 Å²	138	123.1 Å²	123.1	85%	0.847	77%	0.765	S	S	*	*			trans	35.9	156.3	137	-10.5	0	0	0	0	121.3
568	A	28.2	Very low	26.7	Very low	69 Å²	69	121.8 Å²	121.8	57%	0.57	76%	0.764	S	S	*	*			cis	-166.6	157.3	25.3	0	0	0	0	0	116.8
569	T	26.5	Very low	27	Very low	132 Å²	132	117 Å²	117	81%	0.81	76%	0.755	S	S	*	*			trans	59.9	161.3	144.5	48.9	0	0	0	0	120.1
570	T	27.8	Very low	26.7	Very low	128 Å²	128	119.5 Å²	119.5	79%	0.785	76%	0.763	S	S	*	*			cis	-177.2	158	-14	-91.5	0	0	0	0	107.1
571	N	31.8	Very low	27	Very low	135 Å²	135	114.9 Å²	114.9	72%	0.722	76%	0.762	S	S	*	*			cis	-175.7	-177	-31.8	-169.1	20.6	0	0	0	107.7
572	C	27.1	Very low	27.5	Very low	92 Å²	92	121.9 Å²	121.9	62%	0.622	78%	0.776	S	S	*	*			trans	73	153.8	159.3	-55.8	0	0	0	0	118
573	F	25.6	Very low	27.9	Very low	198 Å²	198	120.2 Å²	120.2	87%	0.868	78%	0.782	S	S	*	*			cis	-162.2	151.1	-20.3	-127.6	-68.2	0	0	0	111.9
574	G	25.5	Very low	28.4	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	79%	0.791	S	S	*	*			trans	82.2	153.6	151.7	0	0	0	0	0	119
575	G	28.3	Very low	28.7	Very low	74 Å²	74	120.7 Å²	120.7	76%	0.763	79%	0.79	S	S	*	*			cis	137.5	120	-18.4	0	0	0	0	0	116.2
576	S	27.8	Very low	29.1	Very low	139 Å²	139	120.7 Å²	120.7	97%	0.972	80%	0.795	S	S	*	*			trans	-174.4	157.3	156.3	-87.9	0	0	0	0	113.5
577	G	28.2	Very low	28.8	Very low	76 Å²	76	119.9 Å²	119.9	78%	0.784	81%	0.806	S	S	*	*			trans	-164.1	176.1	171.8	0	0	0	0	0	109.8
578	N	27.8	Very low	29	Very low	158 Å²	158	117 Å²	117	85%	0.845	80%	0.804	S	S	*	*			trans	-154.7	155.4	179.5	-156.1	-6	0	0	0	111.9
579	G	28.9	Very low	29.1	Very low	69 Å²	69	119.8 Å²	119.8	71%	0.711	82%	0.819	S	S	*	*			trans	178.6	-19.9	-179	0	0	0	0	0	122.2
580	N	29.8	Very low	29.3	Very low	163 Å²	163	117 Å²	117	87%	0.872	82%	0.816	S	S	*	*			trans	47.4	130.5	168.6	-74	-23.1	0	0	0	122.3
581	G	29.4	Very low	29.4	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	83%	0.825	S	S	*	*			trans	-166.8	137	160.3	0	0	0	0	0	112.1
582	R	31.1	Very low	29.4	Very low	263 Å²	263	116 Å²	116	99%	0.992	82%	0.821	S	S	*	*			trans	-116.1	150.8	-172.5	-68.6	174.9	170.6	171	-5.3	112.8
583	G	30.8	Very low	29.6	Very low	81 Å²	81	117.8 Å²	117.8	84%	0.835	84%	0.835	S	S	*	*			trans	-176.1	149.7	168.2	0	0	0	0	0	110.7
584	N	32.1	Very low	29.7	Very low	175 Å²	175	112.1 Å²	112.1	94%	0.936	83%	0.832	S	S	*	*			trans	-148.6	149.2	-167	-167.2	26.8	0	0	0	115.1
585	G	30.6	Very low	29.8	Very low	59 Å²	59	114.2 Å²	114.2	61%	0.608	84%	0.835	S	S	*	*			trans	81.2	170.5	164.7	0	0	0	0	0	118.2
586	S	30.7	Very low	29.9	Very low	126 Å²	126	115.3 Å²	115.3	88%	0.881	83%	0.831	S	S	*	*			cis	179.3	130.1	-26.4	-101.7	0	0	0	0	111.5
587	G	30.3	Very low	30.1	Very low	88 Å²	88	113.8 Å²	113.8	91%	0.907	82%	0.821	S	S	*	*			trans	85.4	162.5	158.8	0	0	0	0	0	118.6
588	G	29.9	Very low	30.2	Very low	78 Å²	78	116.3 Å²	116.3	80%	0.804	83%	0.826	S	S	*	*			trans	146.8	27.8	166.2	0	0	0	0	0	121.8
589	S	31.6	Very low	30.3	Very low	127 Å²	127	113 Å²	113	89%	0.888	82%	0.821	S	S	*	*			trans	13.9	125.5	163	-56.2	0	0	0	0	121.9
590	G	30.2	Very low	30.3	Very low	74 Å²	74	115.4 Å²	115.4	76%	0.763	83%	0.827	S	S	*	*			trans	-89.4	-153.9	174.8	0	0	0	0	0	116.9
591	N	30.7	Very low	31.6	Very low	180 Å²	180	113.4 Å²	113.4	96%	0.963	82%	0.822	S	S	*	*			trans	-169.4	161.2	154.4	-119.5	-13.4	0	0	0	113
592	G	30.2	Very low	31.4	Very low	63 Å²	63	117.4 Å²	117.4	65%	0.649	82%	0.824	S	S	*	*			trans	98	65.3	171.6	0	0	0	0	0	115.5
593	S	31.3	Very low	31.5	Very low	128 Å²	128	109.8 Å²	109.8	90%	0.895	81%	0.811	S	S	*	*				93.8	116.3	75.9	66.6	0	0	0	0	114
594	G	27.6	Very low	32.9	Very low	79 Å²	79	111.6 Å²	111.6	81%	0.814	81%	0.808	S	S	*	*			trans	-175.6	148.1	171.5	0	0	0	0	0	113.4
595	S	29.3	Very low	34.2	Very low	118 Å²	118	108.9 Å²	108.9	83%	0.825	80%	0.8	S	S	*	*			trans	177.5	154.8	178.3	49.8	0	0	0	0	108.7
596	S	30.1	Very low	34.1	Very low	98 Å²	98	111.9 Å²	111.9	69%	0.685	81%	0.812	S	S	*	*			cis	-172.4	144.9	-19.7	48.4	0	0	0	0	109.1
597	S	32	Very low	34.1	Very low	107 Å²	107	110.7 Å²	110.7	75%	0.748	81%	0.81	S	S	*	*			trans	40.2	132.2	150.1	62.1	0	0	0	0	122.4
598	S	29.2	Very low	33.9	Very low	128 Å²	128	109.8 Å²	109.8	90%	0.895	80%	0.8	S	S	*	*				171.9	-171.3	121.5	50.6	0	0	0	0	111.4
599	A	30.5	Very low	33.7	Very low	90 Å²	90	114.8 Å²	114.8	74%	0.744	81%	0.807	S	S	*	*			trans	-144.1	168.5	-169.4	0	0	0	0	0	113.4
600	S	28.3	Very low	33.6	Very low	119 Å²	119	111.8 Å²	111.8	83%	0.832	80%	0.796	S	S	*	*			trans	84.8	155.2	163.8	-61.1	0	0	0	0	119.1
601	P	58.1	Low	33.5	Very low	120 Å²	120	115.7 Å²	115.7	78%	0.779	80%	0.799	S	S	*	*			trans	-133.6	178.4	-150.2	43.2	-26.5	0	0	0	116.6
602	L	25.8	Very low	33.4	Very low	165 Å²	165	113.8 Å²	113.8	86%	0.864	79%	0.788	S	S	*	*			trans	-145.2	102.8	165.2	-82.8	177.9	0	0	0	115.2
603	S	32.4	Very low	33.2	Very low	102 Å²	102	116.7 Å²	116.7	71%	0.713	79%	0.789	S	S	*	*				66.9	-176.7	127.4	-44.2	0	0	0	0	120.3
604	P	60.7	Low	33	Very low	119 Å²	119	120.4 Å²	120.4	77%	0.773	78%	0.783	S	S	*	*				-137	-144.4	-104.8	45	-22.6	0	0	0	111.8
605	P	58.8	Low	32.9	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	78%	0.777	S	S	*	*			cis	-129.5	177.2	-25.7	41.5	-26.7	0	0	0	114.4
606	S	29	Very low	32.7	Very low	123 Å²	123	125.4 Å²	125.4	86%	0.86	77%	0.77	S	S	*	*				179	155.5	118.7	-160	0	0	0	0	113.4
607	A	29.2	Very low	32.5	Very low	101 Å²	101	129.6 Å²	129.6	84%	0.835	77%	0.77	S	S	*	*			trans	-51.4	165.6	-166.5	0	0	0	0	0	119.9
608	G	26.1	Very low	32.3	Very low	68 Å²	68	133.1 Å²	133.1	70%	0.701	77%	0.772	S	S	*	*			cis	155.2	155	-9.9	0	0	0	0	0	115.9
609	I	26.6	Very low	32.4	Very low	184 Å²	184	132.4 Å²	132.4	94%	0.944	77%	0.767	S	S	*	*			trans	76.3	124.1	161.2	-55	170.5	0	0	0	119.8
610	G	28.8	Very low	33.4	Very low	64 Å²	64	134.5 Å²	134.5	66%	0.66	77%	0.773	S	S	*	*				117.2	62.8	118.9	0	0	0	0	0	123.9
611	D	29.3	Very low	33.5	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	77%	0.773	S	S	*	*			trans	43.2	153.9	135.1	-92.2	-51.6	0	0	0	127.3
612	L	27.5	Very low	32.3	Very low	140 Å²	140	137.9 Å²	137.9	73%	0.733	76%	0.764	S	S	*	*			trans	77.2	110.3	146.5	-77.4	163	0	0	0	124.6
613	N	26.4	Very low	32.5	Very low	124 Å²	124	137.8 Å²	137.8	66%	0.663	76%	0.76	S	S	*	*				75.6	119.7	126.9	-104.9	-24.1	0	0	0	124.6
614	R	26.9	Very low	32.6	Very low	206 Å²	206	141.9 Å²	141.9	78%	0.777	76%	0.759	S	S	*	*				71.6	127.4	128.5	-88.1	178.2	178.6	-131.1	0.8	124.1
615	L	25.5	Very low	31.1	Very low	129 Å²	129	144.8 Å²	144.8	68%	0.675	76%	0.76	S	S	*	*			trans	84.1	126.9	135	-64.1	165.1	0	0	0	122.9
616	Y	24.6	Very low	30	Very low	173 Å²	173	145.6 Å²	145.6	68%	0.678	76%	0.757	S	S	*	*			trans	92.6	116.4	133.4	-97.1	-130	0	0	0	124.6
617	R	26.3	Very low	30.1	Very low	185 Å²	185	144.3 Å²	144.3	70%	0.698	75%	0.748	S	S	*	*			trans	58.5	120.3	134	-71.8	-171	-178.9	-179.9	3.7	123.8
618	K	27.5	Very low	30.3	Very low	181 Å²	181	147.7 Å²	147.7	79%	0.787	75%	0.752	S	S	*	*				65.3	121	128.4	-63.9	-171.5	174.2	-169.9	0	122.1
619	S	31.6	Very low	30.4	Very low	113 Å²	113	148 Å²	148	79%	0.79	76%	0.755	S	S	*	*				26.4	142.5	128.9	-50.6	0	0	0	0	121.4
620	P	52.6	Low	30.4	Very low	134 Å²	134	145 Å²	145	87%	0.87	75%	0.75	S	S	*	*				-157.4	-160.6	73	45	-23.3	0	0	0	119.4
621	F	29.5	Very low	30.5	Very low	188 Å²	188	151 Å²	151	83%	0.825	76%	0.761	S	S	*	*			trans	-75.5	172.4	-172.6	-117.4	-157.5	0	0	0	115.9
622	M	32.8	Very low	30.6	Very low	122 Å²	122	152 Å²	152	60%	0.601	76%	0.76	S	S	*	*			cis	-169.2	-171.4	-2.5	-151.1	-140.8	-161.7	0	0	111.7
623	Q	29.8	Very low	31.9	Very low	164 Å²	164	149.2 Å²	149.2	77%	0.766	75%	0.751	S	S	*	*			trans	96.3	153.6	155.9	-50.3	-165.8	32.8	0	0	119.9
624	R	35.6	Very low	32	Very low	188 Å²	188	152.1 Å²	152.1	71%	0.709	76%	0.759	S	S	*	*			cis	-173.8	153.2	-38.9	-169.2	-179.8	-74.2	178.6	-1	111.7
625	K	30	Very low	32.1	Very low	180 Å²	180	151 Å²	151	78%	0.783	76%	0.757	S	S	*	*			trans	99.5	143.9	161.3	-63.9	-169.3	161.7	-173.6	0	116.6
626	L	35.2	Very low	32.3	Very low	135 Å²	135	152.3 Å²	152.3	71%	0.707	76%	0.757	S	S	*	*			cis	-161.9	143.8	-10.6	-116.3	175.1	0	0	0	113.6
627	S	30	Very low	32.5	Very low	96 Å²	96	153.1 Å²	153.1	67%	0.671	76%	0.76	S	S	*	*			trans	54.5	145.3	148.6	59	0	0	0	0	122.1
628	N	33.8	Very low	32.8	Very low	172 Å²	172	149.8 Å²	149.8	92%	0.92	76%	0.756	S	S	*	*			cis	-158.5	154.7	-2.2	-133.7	23	0	0	0	112.1
629	G	27.5	Very low	32.8	Very low	73 Å²	73	147.5 Å²	147.5	75%	0.753	75%	0.752	S	S	*	*			trans	162.9	109.6	169	0	0	0	0	0	116.1	H631	G629-H631 PolarHBondContact O-N 3.07Å
630	S	27.9	Very low	32.6	Very low	122 Å²	122	151.1 Å²	151.1	85%	0.853	76%	0.757	S	S	*	*			trans	-35.2	108.1	-171.1	-61.6	0	0	0	0	120.8
631	H	31.3	Very low	31.5	Very low	191 Å²	191	150 Å²	150	88%	0.884	75%	0.753	S	S	*	*			trans	37.2	139.6	138	-75.6	-79.1	0	0	0	124.9	G629	G629-H631 PolarHBondContact O-N 3.07Å
632	H	31.6	Very low	32.2	Very low	175 Å²	175	146.8 Å²	146.8	81%	0.81	75%	0.75	S	S	*	*			trans	-146.5	-162	-174.3	-137.9	0.7	0	0	0	105.7
633	P	53.7	Low	32	Very low	83 Å²	83	150.8 Å²	150.8	54%	0.539	76%	0.764	S	S	.	*			cis	-134.9	-168.5	-28.4	40.7	-24.1	0	0	0	112.4
634	H	28.1	Very low	32.4	Very low	184 Å²	184	153 Å²	153	85%	0.852	77%	0.772	S	S	*	*				-158.6	156.5	121.4	-126.9	-89.8	0	0	0	114.3
635	Y	29.5	Very low	32.2	Very low	183 Å²	183	153.2 Å²	153.2	72%	0.718	78%	0.78	S	S	*	*			trans	-101.3	151.9	-172.7	-96.3	-134.8	0	0	0	112.3
636	K	29.3	Very low	32.3	Very low	157 Å²	157	149.5 Å²	149.5	68%	0.683	78%	0.777	S	S	*	*				52.3	141.9	77.8	-76.9	-166.2	172.2	-174.8	0	113.9
637	Y	29.7	Very low	32.2	Very low	190 Å²	190	151 Å²	151	75%	0.745	78%	0.782	S	S	*	*			cis	-171.2	164.8	-3.2	-122.8	-151.9	0	0	0	107
638	N	31.3	Very low	32.5	Very low	114 Å²	114	153.6 Å²	153.6	61%	0.61	78%	0.782	S	S	*	*			cis	-145.1	-117.2	-15.6	-164.2	32.2	0	0	0	108.3
639	D	29.3	Very low	32.7	Very low	133 Å²	133	149.5 Å²	149.5	71%	0.711	77%	0.767	S	S	*	*			cis	-162.4	-175.8	-14	-139.5	-57.2	0	0	0	111.2
640	E	27.2	Very low	33.1	Very low	189 Å²	189	149.9 Å²	149.9	88%	0.883	76%	0.758	S	S	*	*			trans	65	163.5	175	-83.6	-146.4	102.6	0	0	120.3
641	S	29.6	Very low	33.9	Very low	112 Å²	112	148 Å²	148	78%	0.783	74%	0.737	S	S	*	*			trans	-132.9	165	-152.4	-99.9	0	0	0	0	116.6
642	P	43.9	Very low	34	Very low	119 Å²	119	140.9 Å²	140.9	77%	0.773	72%	0.716	S	S	*	*			trans	-96.7	157.5	-147	36.1	-37.9	0	0	0	117.3
643	K	27.4	Very low	34.3	Very low	207 Å²	207	138.2 Å²	138.2	90%	0.9	70%	0.704	S	S	*	*			trans	-109.1	157.1	156.9	-75.6	176	-179.6	170.8	0	110.3
644	K	39.1	Very low	33.4	Very low	211 Å²	211	137.7 Å²	137.7	92%	0.917	70%	0.702	S	S	*	*			trans	-76.1	131	-171.9	-57	175.5	-177.4	176.9	0	111.6
645	E	30	Very low	33.9	Very low	191 Å²	191	132.5 Å²	132.5	89%	0.893	68%	0.68	S	S	*	*			trans	-129.2	162.8	164.5	-73.8	-155.5	147.4	0	0	112.3
646	S	32	Very low	34	Very low	103 Å²	103	129.3 Å²	129.3	72%	0.72	68%	0.675	S	S	*	*			trans	-82.6	127.4	-167.8	-177.5	0	0	0	0	113.5	F648	S646-F648 PolarHBondContact O-N 3.03Å; S646-F648 VanDerWaalsContact O-N 3.08Å
647	M	33.8	Very low	34.4	Very low	165 Å²	165	130.4 Å²	130.4	81%	0.813	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-3.8	179.6	-75	-100.3	-77.3	0	0	115.3
648	F	36.7	Very low	34.5	Very low	152 Å²	152	127.5 Å²	127.5	67%	0.667	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	3.1	-165	-91.2	-85.3	0	0	0	117.4	S646 I651	S646-F648 PolarHBondContact O-N 3.03Å; S646-F648 VanDerWaalsContact O-N 3.08Å; F648-I651 HydrophobicContact CD1-CD1 4.19Å; F648-I651 HydrophobicContact CE1-CD1 3.88Å
649	S	37.2	Very low	34.5	Very low	86 Å²	86	127.2 Å²	127.2	60%	0.601	67%	0.67	S	S	*	*	H	α-helix	trans	-70.1	-30.3	177	-167.2	0	0	0	0	113.8
650	S	36.5	Very low	34.6	Very low	80 Å²	80	126.1 Å²	126.1	56%	0.559	67%	0.668	S	S	*	*	H	α-helix	trans	-77.1	-35	-172.5	62.9	0	0	0	0	114.6	Q653 S654	S650-Q653 PolarHBondContact O-N 3.34Å; S650-S654 PolarHBondContact O-N 3.02Å; S650-S654 VanDerWaalsContact O-N 3.11Å
651	I	44	Very low	34.8	Very low	82 Å²	82	122.4 Å²	122.4	42%	0.421	66%	0.658	S	S	.	*	H	α-helix	trans	-70.1	-43.3	-171.4	-64	176	0	0	0	111.1	F648 S654	F648-I651 HydrophobicContact CD1-CD1 4.19Å; F648-I651 HydrophobicContact CE1-CD1 3.88Å; I651-S654 PolarHBondContact O-N 2.9Å
652	G	33.8	Very low	34.6	Very low	42 Å²	42	122.6 Å²	122.6	43%	0.433	66%	0.66	S	S	.	*	H	α-helix	trans	-62	-43.5	176.1	0	0	0	0	0	112.7	S654 I655 L656	G652-S654 PolarHBondContact O-N 3.37Å; G652-I655 PolarHBondContact O-N 3.26Å; G652-L656 WeakPolarHBondContact O-CD1 3.48Å; G652-L656 PolarHBondContact O-N 2.97Å
653	Q	37.8	Very low	33.9	Very low	119 Å²	119	122.4 Å²	122.4	56%	0.556	66%	0.659	S	S	*	*	H	α-helix	trans	-70.5	-29.3	-179.3	-65.4	-157.4	21.7	0	0	113.8	S650 I655 L656 R657	S650-Q653 PolarHBondContact O-N 3.34Å; Q653-I655 PolarHBondContact O-N 3.17Å; Q653-L656 PolarHBondContact O-N 3.23Å; Q653-R657 PolarHBondContact O-N 2.93Å
654	S	34.8	Very low	33.8	Very low	73 Å²	73	122.4 Å²	122.4	51%	0.51	66%	0.659	S	S	.	*	H	α-helix	trans	-66.3	-22.8	174.7	-168.6	0	0	0	0	113.2	S650 I651 G652 N658	S650-S654 PolarHBondContact O-N 3.02Å; S650-S654 VanDerWaalsContact O-N 3.11Å; I651-S654 PolarHBondContact O-N 2.9Å; G652-S654 PolarHBondContact O-N 3.37Å; S654-N658 PolarHBondContact O-ND2 2.78Å
655	I	38.8	Very low	33.2	Very low	74 Å²	74	116.9 Å²	116.9	38%	0.379	65%	0.647	S	S	.	*	H	α-helix	trans	-82.5	-39.9	174.8	-63.7	175.8	0	0	0	110.3	F403 G652 Q653 R657 N658 L659	F403-I655 HydrophobicContact CE2-CG2 4.38Å; G652-I655 PolarHBondContact O-N 3.26Å; Q653-I655 PolarHBondContact O-N 3.17Å; I655-R657 VanDerWaalsContact C-N 3.34Å; I655-R657 PolarHBondContact O-N 3.4Å; I655-N658 PolarHBondContact O-N 2.88Å; I655-L659 HydrophobicContact CG2-CD1 3.78Å; I655-L659 HydrophobicContact CG2-CG 4.47Å; I655-L659 WeakPolarHBondContact O-CG 3.32Å; I655-L659 PolarHBondContact O-N 3.09Å
656	L	32.9	Very low	33	Very low	117 Å²	117	115.1 Å²	115.1	61%	0.613	64%	0.639	S	S	*	*	H	α-helix	trans	-58.5	-42	176.1	-92.7	82.7	0	0	0	112.7	G652 Q653 N658 L659 T660	G652-L656 WeakPolarHBondContact O-CD1 3.48Å; G652-L656 PolarHBondContact O-N 2.97Å; Q653-L656 PolarHBondContact O-N 3.23Å; L656-N658 VanDerWaalsContact C-N 3.3Å; L656-N658 PolarHBondContact O-N 3.24Å; L656-L659 PolarHBondContact O-N 2.91Å; L656-T660 PolarHBondContact O-OG1 3.39Å; L656-T660 VanDerWaalsContact O-OG1 3.09Å
657	R	36.6	Very low	32.8	Very low	179 Å²	179	118.5 Å²	118.5	68%	0.675	64%	0.64	S	S	*	*	H	α-helix	trans	-62.5	-32.5	-179.8	-78.1	-172	175.8	148.5	2	114	Q653 I655	Q653-R657 PolarHBondContact O-N 2.93Å; I655-R657 VanDerWaalsContact C-N 3.34Å; I655-R657 PolarHBondContact O-N 3.4Å
658	N	32.1	Very low	32.4	Very low	130 Å²	130	119 Å²	119	70%	0.695	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	0.7	-179.7	-71	-33.7	0	0	0	113.7	S654 I655 L656	S654-N658 PolarHBondContact O-ND2 2.78Å; I655-N658 PolarHBondContact O-N 2.88Å; L656-N658 VanDerWaalsContact C-N 3.3Å; L656-N658 PolarHBondContact O-N 3.24Å
659	L	32.1	Very low	32	Very low	107 Å²	107	119 Å²	119	56%	0.56	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-4.3	177.8	-72	176.1	0	0	0	113.8	I655 L656	I655-L659 HydrophobicContact CG2-CD1 3.78Å; I655-L659 HydrophobicContact CG2-CG 4.47Å; I655-L659 WeakPolarHBondContact O-CG 3.32Å; I655-L659 PolarHBondContact O-N 3.09Å; L656-L659 PolarHBondContact O-N 2.91Å
660	T	31	Very low	31.5	Very low	110 Å²	110	122.9 Å²	122.9	68%	0.675	65%	0.654	S	S	*	*	S	Bend	trans	-114.2	-2.1	-172.6	49.9	0	0	0	0	114.9	L656	L656-T660 PolarHBondContact O-OG1 3.39Å; L656-T660 VanDerWaalsContact O-OG1 3.09Å
661	T	31.6	Very low	30.9	Very low	111 Å²	111	123.1 Å²	123.1	68%	0.681	66%	0.655	S	S	*	*			trans	-100.9	96.1	-179	51.3	0	0	0	0	112.5
662	S	25.3	Very low	30.1	Very low	117 Å²	117	125.9 Å²	125.9	82%	0.818	68%	0.676	S	S	*	*			trans	-98.6	121.6	168.3	-175.8	0	0	0	0	110.6
663	P	29.2	Very low	29.6	Very low	115 Å²	115	128.2 Å²	128.2	75%	0.747	69%	0.692	S	S	*	*			trans	-97.6	113.4	-177.7	34.2	-30.6	0	0	0	113.1
664	F	23.6	Very low	29.1	Very low	206 Å²	206	127.6 Å²	127.6	90%	0.904	70%	0.696	S	S	*	*			trans	-160.3	135.3	167.5	-131.3	-94.8	0	0	0	109.6
665	S	28.4	Very low	28.5	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	69%	0.691	S	S	*	*			cis	-165.5	158.3	-21	177.3	0	0	0	0	107.7
666	Q	25.5	Very low	27.8	Very low	155 Å²	155	127.8 Å²	127.8	72%	0.724	69%	0.694	S	S	*	*			trans	-144.3	114.9	169.6	-79.1	-149.2	72.2	0	0	114.8
667	K	27.1	Very low	27.6	Very low	173 Å²	173	127.5 Å²	127.5	75%	0.752	70%	0.699	S	S	*	*			trans	64.7	150	131.9	-82.8	173.6	-168	155.5	0	120.2
668	K	26.5	Very low	27.2	Very low	176 Å²	176	126.1 Å²	126.1	77%	0.765	70%	0.704	S	S	*	*			cis	-157.8	152	-6.1	-158	178.5	175.7	-165.3	0	111.6
669	H	28.4	Very low	27.3	Very low	153 Å²	153	125.1 Å²	125.1	71%	0.708	71%	0.705	S	S	*	*			trans	2.8	147.1	161.3	-74.7	-88.1	0	0	0	123.2	S671	H669-S671 PolarHBondContact ND1-OG 2.9Å
670	N	25.2	Very low	26.9	Very low	167 Å²	167	128.1 Å²	128.1	89%	0.893	72%	0.716	S	S	*	*				-137.1	160.7	124.1	-149.4	3.6	0	0	0	109.9
671	S	25.3	Very low	26.7	Very low	84 Å²	84	129 Å²	129	59%	0.587	72%	0.716	S	S	*	*			trans	-152.3	145	-166.1	-55.2	0	0	0	0	116.6	H669	H669-S671 PolarHBondContact ND1-OG 2.9Å
672	T	25.3	Very low	26.4	Very low	140 Å²	140	128.8 Å²	128.8	86%	0.859	71%	0.711	S	S	*	*			trans	-169.6	122.5	155.2	28	0	0	0	0	108.2
673	A	24.6	Very low	26.3	Very low	92 Å²	92	130.5 Å²	130.5	76%	0.76	71%	0.706	S	S	*	*				82	145.5	79.6	0	0	0	0	0	113.2
674	T	26.3	Very low	26.1	Very low	105 Å²	105	130 Å²	130	64%	0.644	70%	0.701	S	S	*	*			cis	-159.3	157.9	25.2	-52.1	0	0	0	0	113.6	Q1153	T674-Q1153 WeakPolarHBondContact O-CB 3.5Å
675	T	23.5	Very low	26.2	Very low	66 Å²	66	127 Å²	127	41%	0.405	69%	0.693	S	S	.	*			trans	-36.4	135.7	-168.8	-41.3	0	0	0	0	125.5	I1151 D1152 Q1153	T675-I1151 HydrophobicContact CG2-CG2 3.74Å; T675-I1151 PolarHBondContact OG1-O 3.2Å; T675-D1152 VanDerWaalsContact CA-C 3.48Å; T675-D1152 VanDerWaalsContact CA-O 3.32Å; T675-D1152 WeakPolarHBondContact CA-O 3.38Å; T675-D1152 HydrophobicContact CG2-CB 4.46Å; T675-D1152 PolarHBondContact N-O 3.41Å; T675-D1152 PolarHBondContact OG1-O 3.15Å; T675-D1152 VanDerWaalsContact OG1-O 3.1Å; T675-Q1153 VanDerWaalsContact CA-N 3.32Å; T675-Q1153 PolarHBondContact O-NE2 3.16Å
676	I	23.8	Very low	26	Very low	85 Å²	85	128.6 Å²	128.6	44%	0.436	69%	0.693	S	S	.	*			trans	-12.1	153.5	156.9	-106.4	176.6	0	0	0	119.2	D1152 Q1153	I676-D1152 HydrophobicContact CB-CB 4.17Å; I676-D1152 HydrophobicContact CD1-CB 3.83Å; I676-D1152 HydrophobicContact CG1-CB 4.11Å; I676-Q1153 VanDerWaalsContact N-NE2 3.16Å
677	P	28.5	Very low	25.9	Very low	112 Å²	112	126 Å²	126	73%	0.727	69%	0.688	S	S	*	*				-148.3	172.1	51	43.3	-23.4	0	0	0	120.6
678	L	28.6	Very low	25.6	Very low	150 Å²	150	124.9 Å²	124.9	79%	0.785	69%	0.69	S	S	*	*			trans	-69.2	162.6	159.7	-93.4	164.4	0	0	0	111.6
679	P	33.2	Very low	25.5	Very low	108 Å²	108	121 Å²	121	70%	0.701	69%	0.691	S	S	*	*				-159.2	164	67.1	44.6	-23	0	0	0	121.6
680	H	25.4	Very low	25.2	Very low	171 Å²	171	118 Å²	118	79%	0.792	69%	0.693	S	S	*	*			trans	60.5	104.9	138.2	-73.3	-40.1	0	0	0	123.6
681	N	24.9	Very low	25.2	Very low	129 Å²	129	116.2 Å²	116.2	69%	0.69	69%	0.688	S	S	*	*				97.4	161.7	99.1	-164.1	35.2	0	0	0	118.6
682	N	25.8	Very low	25.3	Very low	105 Å²	105	115.2 Å²	115.2	56%	0.561	69%	0.685	S	S	*	*			trans	77.7	121.8	160.3	-85.1	-17.2	0	0	0	118.7
683	Q	23.4	Very low	25.3	Very low	154 Å²	154	113.4 Å²	113.4	72%	0.72	68%	0.684	S	S	*	*				81.6	131.1	124.5	-73.6	176.5	20.9	0	0	119.2
684	T	25.6	Very low	25.5	Very low	105 Å²	105	114.1 Å²	114.1	64%	0.644	69%	0.69	S	S	*	*			cis	-172.6	173.1	-14.7	0.3	0	0	0	0	110.8
685	L	24.3	Very low	25.5	Very low	141 Å²	141	113.7 Å²	113.7	74%	0.738	70%	0.697	S	S	*	*			trans	75.9	144.3	137.7	-79.2	162.3	0	0	0	121.7
686	I	24.3	Very low	25.7	Very low	130 Å²	130	115.4 Å²	115.4	67%	0.667	72%	0.718	S	S	*	*			trans	92.5	88.7	138.7	-77.5	163.7	0	0	0	119.2
687	T	23.6	Very low	25.9	Very low	100 Å²	100	115.5 Å²	115.5	61%	0.613	73%	0.732	S	S	*	*				68.2	124.7	128.1	63.6	0	0	0	0	121.7
688	D	22.4	Very low	25.7	Very low	149 Å²	149	116.8 Å²	116.8	80%	0.797	74%	0.738	S	S	*	*				47.8	118.5	118.6	-40.1	-27.5	0	0	0	119.6
689	A	23.1	Very low	25.6	Very low	94 Å²	94	114.2 Å²	114.2	78%	0.777	74%	0.738	S	S	*	*				-174.8	152.5	99.8	0	0	0	0	0	113
690	A	23.5	Very low	25.3	Very low	92 Å²	92	115.9 Å²	115.9	76%	0.76	75%	0.747	S	S	*	*			trans	64.5	166.8	157.7	0	0	0	0	0	116.6
691	T	24.7	Very low	25.4	Very low	128 Å²	128	113.9 Å²	113.9	79%	0.785	75%	0.746	S	S	*	*			cis	-149.9	165.3	16.5	-37.5	0	0	0	0	113.2
692	A	26.3	Very low	26.3	Very low	64 Å²	64	113.4 Å²	113.4	53%	0.529	75%	0.751	S	S	.	*			trans	76.4	96.7	151.1	0	0	0	0	0	119.4	K198	K198-A692 PolarHBondContact NZ-O 2.83Å
693	A	25.5	Very low	27	Very low	101 Å²	101	114.5 Å²	114.5	84%	0.835	76%	0.763	S	S	*	*			trans	-119.2	119.9	143.7	0	0	0	0	0	109.7
694	A	29.3	Very low	27.2	Very low	107 Å²	107	114.3 Å²	114.3	88%	0.884	77%	0.767	S	S	*	*			trans	31.7	141.5	157.7	0	0	0	0	0	122.4
695	A	26.9	Very low	27.4	Very low	96 Å²	96	117.3 Å²	117.3	79%	0.793	78%	0.778	S	S	*	*			trans	-111.9	144.9	166.4	0	0	0	0	0	111.7
696	A	27.5	Very low	27.6	Very low	102 Å²	102	114.6 Å²	114.6	84%	0.843	78%	0.776	S	S	*	*			trans	60	149.4	155.6	0	0	0	0	0	120.2
697	A	27.9	Very low	27.8	Very low	88 Å²	88	112.5 Å²	112.5	73%	0.727	78%	0.778	S	S	*	*			cis	-174.2	152.7	-22.9	0	0	0	0	0	108.7
698	T	24	Very low	28	Very low	139 Å²	139	114 Å²	114	85%	0.853	79%	0.787	S	S	*	*			trans	-169.3	137.2	143.2	26.1	0	0	0	0	112.7
699	A	26.1	Very low	28.4	Very low	96 Å²	96	112.7 Å²	112.7	79%	0.793	78%	0.784	S	S	*	*			trans	43.8	118.7	148.5	0	0	0	0	0	121.1
700	T	27.8	Very low	28.7	Very low	143 Å²	143	115.5 Å²	115.5	88%	0.877	79%	0.785	S	S	*	*			trans	-153.3	142.3	149.9	-29.1	0	0	0	0	111
701	T	27.2	Very low	28.9	Very low	128 Å²	128	116.5 Å²	116.5	79%	0.785	78%	0.782	S	S	*	*			trans	-151.5	163.4	177.8	49.2	0	0	0	0	108.7
702	P	44	Very low	29.1	Very low	120 Å²	120	115.9 Å²	115.9	78%	0.779	78%	0.778	S	S	*	*			cis	-109.6	-138.9	-24.7	34.8	-14.7	0	0	0	108.3
703	P	39.8	Very low	29.3	Very low	127 Å²	127	119.1 Å²	119.1	83%	0.825	79%	0.792	S	S	*	*			cis	-125.2	-170.7	38.9	36.6	-17	0	0	0	114.4
704	N	27.7	Very low	30.1	Very low	151 Å²	151	118.2 Å²	118.2	81%	0.807	78%	0.777	S	S	*	*			trans	-130.2	156.4	-173.5	-168.2	0.8	0	0	0	110.2
705	I	28.6	Very low	30.1	Very low	168 Å²	168	116.4 Å²	116.4	86%	0.862	76%	0.755	S	S	*	*			trans	160.3	133.5	166	-92.5	153.8	0	0	0	107.7
706	A	28.5	Very low	30.3	Very low	84 Å²	84	116.1 Å²	116.1	69%	0.694	74%	0.744	S	S	*	*			cis	-165.3	-173.5	-14.9	0	0	0	0	0	110.3
707	A	29.6	Very low	30.6	Very low	86 Å²	86	116.3 Å²	116.3	71%	0.711	74%	0.735	S	S	*	*			trans	89.6	89.2	153.3	0	0	0	0	0	120.9
708	T	28.6	Very low	31.2	Very low	132 Å²	132	117.3 Å²	117.3	81%	0.81	73%	0.733	S	S	*	*				60.4	126.1	118.6	-32.3	0	0	0	0	121.2
709	V	29.5	Very low	31.5	Very low	121 Å²	121	117 Å²	117	73%	0.733	73%	0.731	S	S	*	*				170.8	130.5	112.6	156.8	0	0	0	0	112.8
710	L	29.4	Very low	31.5	Very low	152 Å²	152	123.6 Å²	123.6	80%	0.796	74%	0.736	S	S	*	*			trans	78.9	130.7	161.4	-75.8	162.8	0	0	0	124.8
711	T	28.5	Very low	31.4	Very low	114 Å²	114	128.4 Å²	128.4	70%	0.699	74%	0.738	S	S	*	*			trans	81.7	106.1	143.1	39.9	0	0	0	0	125.9
712	T	28.6	Very low	31.6	Very low	115 Å²	115	129.7 Å²	129.7	71%	0.706	74%	0.739	S	S	*	*				71.3	94.3	127.9	56.1	0	0	0	0	126.8
713	T	30.2	Very low	31.3	Very low	132 Å²	132	130 Å²	130	81%	0.81	74%	0.741	S	S	*	*				65.1	167.1	106.1	59.7	0	0	0	0	122.6
714	P	42	Very low	30.7	Very low	81 Å²	81	130 Å²	130	53%	0.526	74%	0.739	S	S	.	*				-143.2	-161.9	-115.9	37.3	-9.4	0	0	0	119.7	D734	P714-D734 VanDerWaalsContact C-OD1 3.27Å; P714-D734 VanDerWaalsContact CA-OD1 3.29Å; P714-D734 WeakPolarHBondContact CA-OD1 3.33Å
715	T	29.4	Very low	30.6	Very low	69 Å²	69	130.8 Å²	130.8	42%	0.423	74%	0.738	S	S	.	*			trans	99.4	131.3	153.2	-30.8	0	0	0	0	118.5	D734 S735	T715-D734 VanDerWaalsContact C-C 3.45Å; T715-D734 PolarHBondContact N-OD1 3.04Å; T715-D734 PolarHBondContact O-N 3.49Å; T715-S735 WeakPolarHBondContact CA-O 3.46Å
716	T	31.4	Very low	30.7	Very low	91 Å²	91	129.1 Å²	129.1	56%	0.558	73%	0.731	S	S	*	*			cis	-152.8	175.7	-1.8	6.5	0	0	0	0	115.6	D734 S735	T716-D734 CarbonylContact C-O 3.47Å; T716-D734 VanDerWaalsContact CA-C 3.47Å; T716-D734 WeakPolarHBondContact CA-O 3.42Å; T716-D734 CarbonylContact O-C 3.58Å; T716-S735 WeakPolarHBondContact CA-O 3.5Å; T716-S735 WeakPolarHBondContact CG2-O 3.4Å
717	T	33.5	Very low	30.7	Very low	106 Å²	106	130.3 Å²	130.3	65%	0.65	73%	0.734	S	S	*	*			trans	-132.5	-159	178.1	64.5	0	0	0	0	113.3	D734	T717-D734 WeakPolarHBondContact CG2-O 3.31Å
718	P	41.4	Very low	30.7	Very low	108 Å²	108	135.4 Å²	135.4	70%	0.701	74%	0.743	S	S	*	*			cis	-144.4	-174.2	-11.7	37.1	-13.8	0	0	0	119.5
719	T	29	Very low	30.7	Very low	132 Å²	132	133.5 Å²	133.5	81%	0.81	74%	0.74	S	S	*	*			trans	102.9	155.6	153	-30	0	0	0	0	121.8
720	W	27.1	Very low	30.5	Very low	236 Å²	236	138 Å²	138	89%	0.894	75%	0.746	S	S	*	*			trans	-64.3	138.6	-165.3	-68.1	87.5	0	0	0	122.1
721	R	25.6	Very low	30.5	Very low	244 Å²	244	137.1 Å²	137.1	92%	0.921	74%	0.742	S	S	*	*				177.9	169.7	119.7	-100	-171.1	-173.4	-158	5.2	113.7
722	L	31.8	Very low	30.5	Very low	155 Å²	155	136.5 Å²	136.5	81%	0.812	74%	0.742	S	S	*	*			trans	-77.2	154.1	-179.1	-73.6	91.7	0	0	0	113.6
723	P	36.2	Very low	30.5	Very low	126 Å²	126	136.6 Å²	136.6	82%	0.818	75%	0.746	S	S	*	*				-146.7	-157.3	83.1	42.3	-23.3	0	0	0	115.3
724	T	27.5	Very low	30.5	Very low	127 Å²	127	133.4 Å²	133.4	78%	0.779	72%	0.724	S	S	*	*			trans	-106.6	165.4	-171.8	44.8	0	0	0	0	115.2
725	E	27.1	Very low	30.2	Very low	168 Å²	168	132.2 Å²	132.2	79%	0.785	72%	0.718	S	S	*	*			trans	93.3	127	164.1	-58.8	-153.4	116.8	0	0	120.6
726	N	28.9	Very low	30.6	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	73%	0.725	S	S	*	*			trans	63.3	124.2	146.7	-60.8	-27.1	0	0	0	124
727	S	28.7	Very low	30.9	Very low	108 Å²	108	132.8 Å²	132.8	76%	0.755	73%	0.728	S	S	*	*			trans	72.6	103.1	139.7	-60.8	0	0	0	0	122.8
728	Q	29.8	Very low	31	Very low	194 Å²	194	135.1 Å²	135.1	91%	0.907	74%	0.737	S	S	*	*			trans	58.6	130.6	136	-63.2	-172	-23.6	0	0	123.1
729	A	28.3	Very low	30.7	Very low	91 Å²	91	133.5 Å²	133.5	75%	0.752	73%	0.733	S	S	*	*			trans	94.5	108.7	144.2	0	0	0	0	0	122.8
730	Y	26.9	Very low	30.8	Very low	216 Å²	216	133.8 Å²	133.8	85%	0.847	74%	0.735	S	S	*	*			trans	72.9	136.2	138.1	-80.7	-94.9	0	0	0	125.8
731	D	28.2	Very low	31	Very low	134 Å²	134	128.4 Å²	128.4	72%	0.717	73%	0.728	S	S	*	*			trans	79.5	106.8	149.1	-63.8	-37.7	0	0	0	128.2
732	S	28.7	Very low	31.1	Very low	100 Å²	100	122.9 Å²	122.9	70%	0.699	72%	0.721	S	S	*	*				76.5	124.9	120.4	-64.9	0	0	0	0	129.4
733	C	28.8	Very low	31.1	Very low	117 Å²	117	121.1 Å²	121.1	79%	0.791	72%	0.717	S	S	*	*			trans	52	150.5	143.4	64.2	0	0	0	0	125.6
734	D	30.6	Very low	30.9	Very low	65 Å²	65	122.3 Å²	122.3	35%	0.348	72%	0.716	S	S	.	*			cis	-158	-116	-6.5	170.1	-112.2	0	0	0	115.3	P714 T715 T716 T717	P714-D734 VanDerWaalsContact C-OD1 3.27Å; P714-D734 VanDerWaalsContact CA-OD1 3.29Å; P714-D734 WeakPolarHBondContact CA-OD1 3.33Å; T715-D734 VanDerWaalsContact C-C 3.45Å; T715-D734 PolarHBondContact N-OD1 3.04Å; T715-D734 PolarHBondContact O-N 3.49Å; T716-D734 CarbonylContact C-O 3.47Å; T716-D734 VanDerWaalsContact CA-C 3.47Å; T716-D734 WeakPolarHBondContact CA-O 3.42Å; T716-D734 CarbonylContact O-C 3.58Å; T717-D734 WeakPolarHBondContact CG2-O 3.31Å
735	S	36.2	Very low	31.1	Very low	56 Å²	56	122.7 Å²	122.7	39%	0.392	71%	0.713	S	S	.	*			trans	-146.3	-145.3	-151.7	-58.6	0	0	0	0	119	T715 T716	T715-S735 WeakPolarHBondContact CA-O 3.46Å; T716-S735 WeakPolarHBondContact CA-O 3.5Å; T716-S735 WeakPolarHBondContact CG2-O 3.4Å
736	S	36.7	Very low	31.5	Very low	82 Å²	82	122.7 Å²	122.7	57%	0.573	72%	0.718	S	S	*	*			trans	88.3	152.9	175.8	91.9	0	0	0	0	119.1
737	S	38.5	Very low	31.4	Very low	91 Å²	91	119.3 Å²	119.3	64%	0.636	72%	0.715	S	S	*	*			cis	-158.4	164.4	6	63.1	0	0	0	0	116.8
738	N	35.3	Very low	31.6	Very low	154 Å²	154	123 Å²	123	82%	0.824	73%	0.725	S	S	*	*			trans	72.6	153.7	151.9	-65.1	-14.7	0	0	0	124.4
739	A	35.9	Very low	31.4	Very low	75 Å²	75	119.6 Å²	119.6	62%	0.62	72%	0.722	S	S	*	*			cis	-174.8	169.7	-25	0	0	0	0	0	115.5
740	T	30	Very low	31.4	Very low	138 Å²	138	120.3 Å²	120.3	85%	0.847	72%	0.722	S	S	*	*			trans	85.5	162.7	160	68.2	0	0	0	0	123.2
741	T	31.6	Very low	32.4	Very low	122 Å²	122	115.7 Å²	115.7	75%	0.748	72%	0.718	S	S	*	*				-167.1	165.5	-66	-73.9	0	0	0	0	112.5
742	T	27.6	Very low	32.3	Very low	128 Å²	128	114.6 Å²	114.6	79%	0.785	72%	0.721	S	S	*	*			trans	115.4	156.2	156	-43.2	0	0	0	0	117.4
743	T	31.5	Very low	33.3	Very low	119 Å²	119	115.3 Å²	115.3	73%	0.73	72%	0.723	S	S	*	*				-153.4	173.6	-87.1	29.8	0	0	0	0	114.8
744	L	31.3	Very low	33.2	Very low	150 Å²	150	114.4 Å²	114.4	79%	0.785	72%	0.718	S	S	*	*			trans	99.3	171.4	172.9	-58.5	177.6	0	0	0	117.6
745	N	32.2	Very low	33	Very low	135 Å²	135	119.2 Å²	119.2	72%	0.722	74%	0.743	S	S	*	*			cis	162.9	155.6	-46	-82.1	3.4	0	0	0	108.7
746	L	35.6	Very low	33.6	Very low	168 Å²	168	121.8 Å²	121.8	88%	0.88	76%	0.759	S	S	*	*			cis	-164.5	177.5	-8.4	-92.6	163.4	0	0	0	106.9
747	G	26.1	Very low	33.1	Very low	63 Å²	63	128.7 Å²	128.7	65%	0.649	77%	0.772	S	S	*	*			cis	169.5	166.8	-4.4	0	0	0	0	0	113.4
748	L	32.8	Very low	32.7	Very low	186 Å²	186	131.8 Å²	131.8	97%	0.974	77%	0.774	S	S	*	*			trans	73.5	169.9	173.9	-46.7	179.1	0	0	0	117.9
749	S	26	Very low	32.1	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	77%	0.765	S	S	*	*			cis	-148.4	-143.8	5.8	68.6	0	0	0	0	115.3
750	S	29.1	Very low	31.5	Very low	106 Å²	106	136.1 Å²	136.1	74%	0.741	77%	0.774	S	S	*	*			trans	-159.9	-172.1	-173.3	72.2	0	0	0	0	113.2
751	P	48.3	Very low	32	Very low	119 Å²	119	134.7 Å²	134.7	77%	0.773	77%	0.767	S	S	*	*			cis	-138.2	-103	14.8	39.7	-14.2	0	0	0	120
752	S	25.6	Very low	31.7	Very low	111 Å²	111	134.6 Å²	134.6	78%	0.776	77%	0.767	S	S	*	*			trans	-166.7	-163.4	-163.4	-69.9	0	0	0	0	112.5
753	P	49.2	Very low	31.5	Very low	115 Å²	115	136.6 Å²	136.6	75%	0.747	77%	0.767	S	S	*	*			cis	-150.3	-177.7	2.8	44.1	-21.1	0	0	0	121.4
754	S	27.4	Very low	31.1	Very low	99 Å²	99	136.4 Å²	136.4	69%	0.692	77%	0.771	S	S	*	*			trans	76.9	124.2	139.5	63.7	0	0	0	0	130.1
755	L	26.8	Very low	32.1	Very low	165 Å²	165	134.9 Å²	134.9	86%	0.864	77%	0.77	S	S	*	*			trans	76.9	167.5	135.1	-66.8	171.1	0	0	0	123.9
756	P	47.3	Very low	31.7	Very low	111 Å²	111	135.3 Å²	135.3	72%	0.721	78%	0.777	S	S	*	*			cis	-149.3	169.2	-41.7	43.1	-24.4	0	0	0	121.7
757	R	26.6	Very low	31.2	Very low	226 Å²	226	134.8 Å²	134.8	85%	0.853	78%	0.775	S	S	*	*			trans	96.7	126	134.9	-131.7	-173.7	-171.6	-173.7	4.4	128.4
758	K	30	Very low	31.2	Very low	157 Å²	157	140.6 Å²	140.6	68%	0.683	79%	0.785	S	S	*	*			trans	73.5	167	148	-108.3	-172.9	166.2	-163	0	120.7
759	Q	23.4	Very low	30.7	Very low	135 Å²	135	138.3 Å²	138.3	63%	0.631	77%	0.773	S	S	*	*			cis	-144.2	-133.4	4.1	-158.7	168	-109.6	0	0	116.5
760	F	23.5	Very low	30.6	Very low	184 Å²	184	138.6 Å²	138.6	81%	0.807	77%	0.77	S	S	*	*			trans	-164.3	-176.6	-159.6	-68.3	-63.7	0	0	0	110.2
761	P	40.1	Very low	30.5	Very low	109 Å²	109	139.4 Å²	139.4	71%	0.708	78%	0.776	S	S	*	*			cis	-148.3	-173.4	14.5	46.3	-24.4	0	0	0	120.2
762	T	25.1	Very low	29.6	Very low	119 Å²	119	142.2 Å²	142.2	73%	0.73	78%	0.778	S	S	*	*			trans	48.5	-179.4	153.3	54.5	0	0	0	0	122.6
763	E	23.5	Very low	29.7	Very low	170 Å²	170	145 Å²	145	79%	0.794	78%	0.779	S	S	*	*			cis	-152.1	-158.8	9.2	-146	138.5	-66.6	0	0	115.1
764	S	22.5	Very low	28.8	Very low	116 Å²	116	148.2 Å²	148.2	81%	0.811	78%	0.784	S	S	*	*			trans	-147.3	-140.7	-173.9	-64.8	0	0	0	0	119.6
765	P	52.5	Low	28.8	Very low	118 Å²	118	152.7 Å²	152.7	77%	0.766	79%	0.794	S	S	*	*				-122.2	-179.3	-120.3	42	-24.6	0	0	0	117.9
766	T	24.7	Very low	28.8	Very low	143 Å²	143	153.6 Å²	153.6	88%	0.877	79%	0.794	S	S	*	*			trans	-174.1	165.1	157	-85.4	0	0	0	0	114.8
767	L	25	Very low	28	Very low	158 Å²	158	154.6 Å²	154.6	83%	0.827	80%	0.8	S	S	*	*			trans	-114.3	161.3	-179.3	-63	160.2	0	0	0	112.7
768	Q	24.9	Very low	28.1	Very low	184 Å²	184	150 Å²	150	86%	0.86	79%	0.788	S	S	*	*				176.1	152.1	129	-97.3	-170.2	15.3	0	0	118.1
769	L	23.8	Very low	28	Very low	139 Å²	139	152.8 Å²	152.8	73%	0.728	80%	0.795	S	S	*	*			trans	21.7	120.8	157.4	-83.9	70.1	0	0	0	125.9
770	T	24.1	Very low	28.4	Very low	127 Å²	127	149.3 Å²	149.3	78%	0.779	78%	0.78	S	S	*	*				53.7	118.5	113.2	-44	0	0	0	0	123.5
771	S	26.7	Very low	28.7	Very low	123 Å²	123	148.1 Å²	148.1	86%	0.86	78%	0.777	S	S	*	*			trans	-161.8	168.6	134.4	45.5	0	0	0	0	111.3
772	Q	29.6	Very low	28.5	Very low	177 Å²	177	146.9 Å²	146.9	83%	0.827	77%	0.769	S	S	*	*			trans	-102.8	142.7	-168.3	-55.4	175.1	7.2	0	0	113.3
773	Q	27.4	Very low	29.1	Very low	170 Å²	170	142.7 Å²	142.7	79%	0.794	75%	0.749	S	S	*	*				174.5	150.9	110.9	-93.5	179.6	11.6	0	0	114.4
774	Q	29.8	Very low	30.2	Very low	183 Å²	183	139.6 Å²	139.6	86%	0.855	74%	0.738	S	S	*	*			trans	23.6	124.7	158.8	-60.3	-176.7	0.4	0	0	121.1
775	Q	27.5	Very low	31.1	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	72%	0.718	S	S	*	*			trans	-98.9	140.6	174	-64	175.2	-7.9	0	0	112.7
776	Q	26	Very low	30.8	Very low	185 Å²	185	135.6 Å²	135.6	86%	0.864	70%	0.704	S	S	*	*			trans	-129.2	133	150	-76.7	-168.9	1.5	0	0	109.2
777	P	30.6	Very low	32.2	Very low	131 Å²	131	132.8 Å²	132.8	85%	0.851	69%	0.688	S	S	*	*			trans	-81.8	138.2	-179.8	32	-33.9	0	0	0	112.4
778	Q	28.6	Very low	33.7	Very low	129 Å²	129	130.8 Å²	130.8	60%	0.603	68%	0.677	S	S	*	*			trans	-95.5	-180	173.8	-77.8	174.2	-22	0	0	111.1	G1037 T1038	Q778-G1037 CarbonylContact C-O 3.56Å; Q778-G1037 VanDerWaalsContact CB-O 3.32Å; Q778-G1037 WeakPolarHBondContact CB-O 3.48Å; Q778-T1038 CarbonylContact C-O 3.54Å; Q778-T1038 VanDerWaalsContact CA-O 3.28Å; Q778-T1038 WeakPolarHBondContact CA-O 3.32Å; Q778-T1038 WeakPolarHBondContact CB-O 3.49Å; Q778-T1038 VanDerWaalsContact O-O 3.11Å; Q778-T1038 PolarHBondContact OE1-OG1 3.42Å
779	R	28.8	Very low	35.4	Very low	216 Å²	216	125.4 Å²	125.4	82%	0.815	66%	0.657	S	S	*	*			trans	-144.1	98.5	-168.4	173.3	-135.5	-71	168.4	-5.1	112.6	G1037 T1038	R779-G1037 CarbonylContact C-O 3.51Å; R779-G1037 WeakPolarHBondContact CA-O 3.04Å; R779-G1037 PolarHBondContact N-O 2.89Å; R779-G1037 CarbonylContact O-C 3.53Å; R779-T1038 VanDerWaalsContact C-C 3.49Å; R779-T1038 PolarHBondContact N-O 3.18Å; R779-T1038 VanDerWaalsContact N-O 3.08Å; R779-T1038 PolarHBondContact O-N 3.22Å; R779-T1038 VanDerWaalsContact O-N 3.11Å
780	L	31.1	Very low	36.8	Very low	63 Å²	63	122.3 Å²	122.3	33%	0.33	64%	0.641	S	S	.	*			trans	-80.4	161.4	-171.6	-107.6	123.5	0	0	0	109.8	P782 T1038 S1039	L780-P782 WeakPolarHBondContact O-CD 3.46Å; L780-T1038 HydrophobicContact CD1-CG2 3.62Å; L780-T1038 HydrophobicContact CG-CG2 3.92Å; L780-S1039 VanDerWaalsContact CA-N 3.26Å; L780-S1039 WeakPolarHBondContact CA-O 3.4Å; L780-S1039 WeakPolarHBondContact CB-O 3.47Å; L780-S1039 VanDerWaalsContact CG-N 3.31Å; L780-S1039 PolarHBondContact N-O 2.91Å
781	Q	30.5	Very low	38.5	Very low	158 Å²	158	123 Å²	123	74%	0.738	64%	0.635	S	S	*	*			trans	-43.3	119.8	155.2	-52.3	-63.5	-3.6	0	0	112.3	G783	Q781-G783 PolarHBondContact O-N 3.22Å
782	P	35.1	Very low	40.1	Very low	84 Å²	84	126.1 Å²	126.1	55%	0.545	63%	0.628	S	S	.	*			trans	-66.4	129.7	164.5	-19	33.1	0	0	0	109.9	L780 N784	L780-P782 WeakPolarHBondContact O-CD 3.46Å; P782-N784 PolarHBondContact O-N 3.04Å
783	G	37.7	Very low	41.8	Very low	30 Å²	30	122.1 Å²	122.1	31%	0.309	61%	0.608	S	S	.	*			trans	-70.4	103.9	-177.7	0	0	0	0	0	112.6	Q781	Q781-G783 PolarHBondContact O-N 3.22Å
784	N	48.4	Very low	43.7	Very low	106 Å²	106	120.6 Å²	120.6	57%	0.567	60%	0.596	S	S	*	*			trans	54	78.2	146.1	-149.9	-11.1	0	0	0	113.9	P782 R1043	P782-N784 PolarHBondContact O-N 3.04Å; N784-R1043 VanDerWaalsContact C-NH2 3.29Å; N784-R1043 HydrophobicContact CB-CB 4.12Å; N784-R1043 PolarHBondContact O-NE 3.1Å; N784-R1043 PolarHBondContact O-NH2 2.98Å; N784-R1043 PolarHBondContact OD1-NH1 3.47Å; N784-R1043 PolarHBondContact OD1-NH2 3.48Å
785	Q	40.6	Very low	45.8	Very low	80 Å²	80	117.6 Å²	117.6	37%	0.374	58%	0.582	S	S	.	*			trans	-95.4	161.7	177.8	-67.3	-177.9	-6.6	0	0	112.5	V789 L790 R1043	Q785-V789 HydrophobicContact CB-CB 4.31Å; Q785-V789 HydrophobicContact CB-CG1 4.36Å; Q785-L790 HydrophobicContact CB-CD1 4.5Å; Q785-R1043 PolarHBondContact O-NH2 3.36Å
786	S	47.1	Very low	48	Very low	70 Å²	70	114.1 Å²	114.1	49%	0.49	57%	0.566	S	S	.	*			trans	-68.3	146.9	173.9	-52	0	0	0	0	110.6	I788 V789 L790	S786-I788 VanDerWaalsContact C-N 3.26Å; S786-I788 PolarHBondContact O-N 2.93Å; S786-I788 VanDerWaalsContact O-N 3.09Å; S786-V789 WeakPolarHBondContact O-CA 3.4Å; S786-V789 WeakPolarHBondContact O-CB 3.36Å; S786-V789 PolarHBondContact O-N 3.04Å; S786-L790 PolarHBondContact O-N 3.33Å
787	P	53.9	Low	49.8	Very low	83 Å²	83	108.9 Å²	108.9	54%	0.539	54%	0.541	S	S	.	.	H	α-helix	trans	-53.9	-37.1	-174.6	-29.5	35.8	0	0	0	114.8	L790 Q791	P787-L790 PolarHBondContact O-N 3.35Å; P787-Q791 VanDerWaalsContact O-CB 3.32Å; P787-Q791 WeakPolarHBondContact O-CB 3.49Å; P787-Q791 PolarHBondContact O-N 2.96Å
788	I	56.9	Low	51.6	Low	116 Å²	116	106.3 Å²	106.3	60%	0.595	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-36.1	176.3	-69	171.4	0	0	0	112.4	S786 R792	S786-I788 VanDerWaalsContact C-N 3.26Å; S786-I788 PolarHBondContact O-N 2.93Å; S786-I788 VanDerWaalsContact O-N 3.09Å; I788-R792 WeakPolarHBondContact O-CB 3.38Å; I788-R792 WeakPolarHBondContact O-CG 3.25Å; I788-R792 PolarHBondContact O-N 3.37Å
789	V	59.2	Low	53.8	Low	72 Å²	72	105.2 Å²	105.2	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-71.8	-42.4	176.1	-175.4	0	0	0	0	109.3	Q785 S786 Q791 R792 F793	Q785-V789 HydrophobicContact CB-CB 4.31Å; Q785-V789 HydrophobicContact CB-CG1 4.36Å; S786-V789 WeakPolarHBondContact O-CA 3.4Å; S786-V789 WeakPolarHBondContact O-CB 3.36Å; S786-V789 PolarHBondContact O-N 3.04Å; V789-Q791 VanDerWaalsContact C-N 3.35Å; V789-Q791 PolarHBondContact O-N 3.41Å; V789-R792 PolarHBondContact O-N 2.91Å; V789-F793 WeakPolarHBondContact O-CB 3.4Å; V789-F793 PolarHBondContact O-N 2.84Å
790	L	52.6	Low	55.7	Low	73 Å²	73	99.3 Å²	99.3	38%	0.382	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-40.7	175.6	-155.5	75.9	0	0	0	111.8	Q785 S786 P787 F793 Y794	Q785-L790 HydrophobicContact CB-CD1 4.5Å; S786-L790 PolarHBondContact O-N 3.33Å; P787-L790 PolarHBondContact O-N 3.35Å; L790-F793 PolarHBondContact O-N 3.3Å; L790-Y794 HydrophobicContact CD1-CE2 4.47Å; L790-Y794 HydrophobicContact CD2-CD2 4.49Å; L790-Y794 HydrophobicContact CD2-CE2 3.97Å; L790-Y794 HydrophobicContact CG-CD2 4Å; L790-Y794 HydrophobicContact CG-CE2 3.81Å; L790-Y794 VanDerWaalsContact O-CD2 3.25Å; L790-Y794 WeakPolarHBondContact O-CD2 3.43Å; L790-Y794 PolarHBondContact O-N 2.83Å
791	Q	61.1	Low	57.4	Low	143 Å²	143	102.8 Å²	102.8	67%	0.668	51%	0.508	S	S	*	.	H	α-helix	trans	-68.2	-38.1	176.9	-169.6	173.5	8.8	0	0	112.3	P787 V789 H795	P787-Q791 VanDerWaalsContact O-CB 3.32Å; P787-Q791 WeakPolarHBondContact O-CB 3.49Å; P787-Q791 PolarHBondContact O-N 2.96Å; V789-Q791 VanDerWaalsContact C-N 3.35Å; V789-Q791 PolarHBondContact O-N 3.41Å; Q791-H795 WeakPolarHBondContact O-CB 3.36Å; Q791-H795 PolarHBondContact O-N 3.14Å
792	R	59	Low	59.3	Low	188 Å²	188	101.9 Å²	101.9	71%	0.709	50%	0.504	S	S	*	.	H	α-helix	trans	-64.9	-41.7	170.5	-74.5	174.9	-179.6	-118	-0.2	111.6	I788 V789 H795 Q796	I788-R792 WeakPolarHBondContact O-CB 3.38Å; I788-R792 WeakPolarHBondContact O-CG 3.25Å; I788-R792 PolarHBondContact O-N 3.37Å; V789-R792 PolarHBondContact O-N 2.91Å; R792-H795 PolarHBondContact O-N 3.2Å; R792-Q796 WeakPolarHBondContact O-CB 3.35Å; R792-Q796 PolarHBondContact O-N 3.37Å
793	F	67	Low	61.2	Low	93 Å²	93	103.7 Å²	103.7	41%	0.408	50%	0.503	S	S	.	.	H	α-helix	trans	-63.4	-44.3	176.2	-175	-97.5	0	0	0	112	V789 L790 Q796 Q797	V789-F793 WeakPolarHBondContact O-CB 3.4Å; V789-F793 PolarHBondContact O-N 2.84Å; L790-F793 PolarHBondContact O-N 3.3Å; F793-Q796 PolarHBondContact O-N 2.91Å; F793-Q797 HydrophobicContact CD1-CG 4.24Å; F793-Q797 HydrophobicContact CE1-CG 3.92Å; F793-Q797 HydrophobicContact CZ-CG 4.3Å; F793-Q797 VanDerWaalsContact O-CB 3.3Å; F793-Q797 WeakPolarHBondContact O-CB 3.3Å; F793-Q797 PolarHBondContact O-N 3.48Å
794	Y	66.3	Low	62.9	Low	137 Å²	137	108.1 Å²	108.1	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-64.8	-39.1	173.9	-85.8	-64	0	0	0	112.9	L790 Q797 N798	L790-Y794 HydrophobicContact CD1-CE2 4.47Å; L790-Y794 HydrophobicContact CD2-CD2 4.49Å; L790-Y794 HydrophobicContact CD2-CE2 3.97Å; L790-Y794 HydrophobicContact CG-CD2 4Å; L790-Y794 HydrophobicContact CG-CE2 3.81Å; L790-Y794 VanDerWaalsContact O-CD2 3.25Å; L790-Y794 WeakPolarHBondContact O-CD2 3.43Å; L790-Y794 PolarHBondContact O-N 2.83Å; Y794-Q797 WeakPolarHBondContact O-CB 3.47Å; Y794-Q797 PolarHBondContact O-N 3.04Å; Y794-N798 PolarHBondContact O-N 3.37Å
795	H	74.1	Confident	64	Low	121 Å²	121	105.9 Å²	105.9	56%	0.56	51%	0.512	S	S	*	.	H	α-helix	trans	-63.6	-43.4	174.9	-171.5	68.6	0	0	0	111.6	Q791 R792 N798 Q799	Q791-H795 WeakPolarHBondContact O-CB 3.36Å; Q791-H795 PolarHBondContact O-N 3.14Å; R792-H795 PolarHBondContact O-N 3.2Å; H795-N798 PolarHBondContact O-N 3.4Å; H795-Q799 PolarHBondContact CD2-NE2 3.3Å; H795-Q799 PolarHBondContact NE2-NE2 2.97Å; H795-Q799 WeakPolarHBondContact O-CG 3.33Å; H795-Q799 PolarHBondContact O-N 2.99Å
796	Q	73.7	Confident	65.5	Low	119 Å²	119	104.3 Å²	104.3	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-67.8	-37.5	176.1	-168.3	172.7	4	0	0	112.5	R792 F793 Q799 L800	R792-Q796 WeakPolarHBondContact O-CB 3.35Å; R792-Q796 PolarHBondContact O-N 3.37Å; F793-Q796 PolarHBondContact O-N 2.91Å; Q796-Q799 PolarHBondContact O-N 2.81Å; Q796-L800 WeakPolarHBondContact O-CB 3.34Å; Q796-L800 WeakPolarHBondContact O-CG 3.47Å; Q796-L800 PolarHBondContact O-N 3.31Å
797	Q	64.2	Low	66.7	Low	74 Å²	74	104.7 Å²	104.7	35%	0.346	51%	0.507	S	S	.	.	H	α-helix	trans	-60.2	-43.3	170.5	-94.1	-84.8	-39.9	0	0	112.3	F793 Y794 L800 R801	F793-Q797 HydrophobicContact CD1-CG 4.24Å; F793-Q797 HydrophobicContact CE1-CG 3.92Å; F793-Q797 HydrophobicContact CZ-CG 4.3Å; F793-Q797 VanDerWaalsContact O-CB 3.3Å; F793-Q797 WeakPolarHBondContact O-CB 3.3Å; F793-Q797 PolarHBondContact O-N 3.48Å; Y794-Q797 WeakPolarHBondContact O-CB 3.47Å; Y794-Q797 PolarHBondContact O-N 3.04Å; Q797-L800 PolarHBondContact O-N 2.86Å; Q797-R801 WeakPolarHBondContact O-CB 3.36Å; Q797-R801 PolarHBondContact O-N 3.11Å
798	N	67.7	Low	67.1	Low	78 Å²	78	109.2 Å²	109.2	42%	0.417	51%	0.513	S	S	.	.	H	α-helix	trans	-67.4	-43.9	177.9	-77.5	3.3	0	0	0	111.4	Y794 H795 L800 R801 E802	Y794-N798 PolarHBondContact O-N 3.37Å; H795-N798 PolarHBondContact O-N 3.4Å; N798-L800 VanDerWaalsContact C-N 3.3Å; N798-L800 PolarHBondContact O-N 3.39Å; N798-R801 PolarHBondContact O-N 3.49Å; N798-R801 VanDerWaalsContact O-N 3.11Å; N798-E802 WeakPolarHBondContact O-CG 3.46Å; N798-E802 PolarHBondContact O-N 2.83Å
799	Q	74.6	Confident	67.3	Low	105 Å²	105	110.4 Å²	110.4	49%	0.491	51%	0.511	S	S	.	.	H	α-helix	trans	-59	-40.4	173.7	-70	-177.7	14.2	0	0	112.3	H795 Q796 K803	H795-Q799 PolarHBondContact CD2-NE2 3.3Å; H795-Q799 PolarHBondContact NE2-NE2 2.97Å; H795-Q799 WeakPolarHBondContact O-CG 3.33Å; H795-Q799 PolarHBondContact O-N 2.99Å; Q796-Q799 PolarHBondContact O-N 2.81Å; Q799-K803 WeakPolarHBondContact O-CB 3.27Å; Q799-K803 PolarHBondContact O-N 3.38Å
800	L	68.3	Low	67.5	Low	93 Å²	93	112.4 Å²	112.4	49%	0.487	52%	0.516	S	S	.	.	H	α-helix	trans	-65.4	-39.3	174.5	-75.7	167.1	0	0	0	112.1	Q796 Q797 N798 K803 E804	Q796-L800 WeakPolarHBondContact O-CB 3.34Å; Q796-L800 WeakPolarHBondContact O-CG 3.47Å; Q796-L800 PolarHBondContact O-N 3.31Å; Q797-L800 PolarHBondContact O-N 2.86Å; N798-L800 VanDerWaalsContact C-N 3.3Å; N798-L800 PolarHBondContact O-N 3.39Å; L800-K803 WeakPolarHBondContact O-CB 3.32Å; L800-K803 PolarHBondContact O-N 3.28Å; L800-E804 PolarHBondContact O-N 3.38Å
801	R	67.3	Low	68	Low	136 Å²	136	114.7 Å²	114.7	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-71.4	-36.6	178.7	-164.2	179.2	-56.6	159.5	9.2	112.8	Q797 N798 K803 E804 A805	Q797-R801 WeakPolarHBondContact O-CB 3.36Å; Q797-R801 PolarHBondContact O-N 3.11Å; N798-R801 PolarHBondContact O-N 3.49Å; N798-R801 VanDerWaalsContact O-N 3.11Å; R801-K803 VanDerWaalsContact C-N 3.33Å; R801-E804 PolarHBondContact O-N 2.87Å; R801-A805 VanDerWaalsContact O-CB 3.27Å; R801-A805 WeakPolarHBondContact O-CB 3.41Å; R801-A805 PolarHBondContact O-N 2.67Å
802	E	71	Confident	67.9	Low	139 Å²	139	114.9 Å²	114.9	65%	0.65	53%	0.525	S	S	*	.	H	α-helix	trans	-65.3	-38.5	170.4	-73	176.9	153.4	0	0	111	N798 A805 A806	N798-E802 WeakPolarHBondContact O-CG 3.46Å; N798-E802 PolarHBondContact O-N 2.83Å; E802-A805 PolarHBondContact O-N 2.91Å; E802-A806 WeakPolarHBondContact O-CB 3.34Å; E802-A806 PolarHBondContact O-N 3.11Å
803	K	75.7	Confident	67.6	Low	121 Å²	121	115 Å²	115	53%	0.526	53%	0.526	S	S	.	.	H	α-helix	trans	-64.8	-46	172.9	-171	174.5	-175.9	-74.7	0	112.1	Q799 L800 R801 A805 A806 E807	Q799-K803 WeakPolarHBondContact O-CB 3.27Å; Q799-K803 PolarHBondContact O-N 3.38Å; L800-K803 WeakPolarHBondContact O-CB 3.32Å; L800-K803 PolarHBondContact O-N 3.28Å; R801-K803 VanDerWaalsContact C-N 3.33Å; K803-A805 VanDerWaalsContact C-N 3.34Å; K803-A805 PolarHBondContact O-N 3.41Å; K803-A806 PolarHBondContact O-N 3.47Å; K803-E807 IonicContact NZ-OE1 2.67Å; K803-E807 PolarHBondContact NZ-OE1 2.88Å; K803-E807 WeakPolarHBondContact O-CB 3.35Å; K803-E807 WeakPolarHBondContact O-CG 3.39Å; K803-E807 PolarHBondContact O-N 3.48Å
804	E	72.7	Confident	66.9	Low	124 Å²	124	115 Å²	115	58%	0.579	53%	0.527	S	S	*	.	H	α-helix	trans	-62.8	-37.7	173.3	-76.9	-169.3	122.6	0	0	112.5	L800 R801 E807 R808	L800-E804 PolarHBondContact O-N 3.38Å; R801-E804 PolarHBondContact O-N 2.87Å; E804-E807 PolarHBondContact O-N 2.84Å; E804-R808 WeakPolarHBondContact O-CB 3.49Å; E804-R808 WeakPolarHBondContact O-CG 3.3Å; E804-R808 PolarHBondContact O-N 3.4Å
805	A	71.8	Confident	65.9	Low	59 Å²	59	116.4 Å²	116.4	49%	0.488	54%	0.538	S	S	.	.	H	α-helix	trans	-66.5	-42.8	175.6	0	0	0	0	0	111.5	R801 E802 K803 R808 Y809	R801-A805 VanDerWaalsContact O-CB 3.27Å; R801-A805 WeakPolarHBondContact O-CB 3.41Å; R801-A805 PolarHBondContact O-N 2.67Å; E802-A805 PolarHBondContact O-N 2.91Å; K803-A805 VanDerWaalsContact C-N 3.34Å; K803-A805 PolarHBondContact O-N 3.41Å; A805-R808 PolarHBondContact O-N 2.83Å; A805-Y809 WeakPolarHBondContact O-CB 3.44Å; A805-Y809 PolarHBondContact O-N 3.33Å
806	A	71.7	Confident	64.5	Low	47 Å²	47	112.4 Å²	112.4	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-64	-40.2	173.2	0	0	0	0	0	111.9	E802 K803 Y809 Q810	E802-A806 WeakPolarHBondContact O-CB 3.34Å; E802-A806 PolarHBondContact O-N 3.11Å; K803-A806 PolarHBondContact O-N 3.47Å; A806-Y809 PolarHBondContact O-N 2.86Å; A806-Q810 WeakPolarHBondContact O-CB 3.36Å; A806-Q810 VanDerWaalsContact O-CG 3.3Å; A806-Q810 WeakPolarHBondContact O-CG 3.28Å; A806-Q810 PolarHBondContact O-N 2.81Å
807	E	72.8	Confident	63	Low	78 Å²	78	112.3 Å²	112.3	36%	0.364	53%	0.533	S	S	.	.	H	α-helix	trans	-67.6	-39.3	175.4	-75.6	175.5	-160.5	0	0	112	K803 E804 Q810 Q811	K803-E807 IonicContact NZ-OE1 2.67Å; K803-E807 PolarHBondContact NZ-OE1 2.88Å; K803-E807 WeakPolarHBondContact O-CB 3.35Å; K803-E807 WeakPolarHBondContact O-CG 3.39Å; K803-E807 PolarHBondContact O-N 3.48Å; E804-E807 PolarHBondContact O-N 2.84Å; E807-Q810 CarbonylContact O-C 3.57Å; E807-Q810 PolarHBondContact O-N 3.4Å; E807-Q811 WeakPolarHBondContact O-CB 3.42Å; E807-Q811 VanDerWaalsContact O-CG 3.26Å; E807-Q811 WeakPolarHBondContact O-CG 3.32Å; E807-Q811 PolarHBondContact O-N 2.59Å
808	R	61.8	Low	61.7	Low	178 Å²	178	115.2 Å²	115.2	67%	0.672	56%	0.555	S	S	*	*	H	α-helix	trans	-65	-41.1	171.2	-78.8	-171.6	178.3	-157.5	0.7	112.6	E804 A805 Q810 Q811 Q812	E804-R808 WeakPolarHBondContact O-CB 3.49Å; E804-R808 WeakPolarHBondContact O-CG 3.3Å; E804-R808 PolarHBondContact O-N 3.4Å; A805-R808 PolarHBondContact O-N 2.83Å; R808-Q810 VanDerWaalsContact C-N 3.31Å; R808-Q810 PolarHBondContact O-N 3.08Å; R808-Q811 PolarHBondContact O-N 2.89Å; R808-Q811 VanDerWaalsContact O-N 3.16Å; R808-Q812 PolarHBondContact O-N 2.9Å
809	Y	60.8	Low	60.1	Low	140 Å²	140	114.6 Å²	114.6	55%	0.549	57%	0.568	S	S	.	*	H	α-helix	trans	-64	-38.1	175	-168.8	-98.9	0	0	0	111.3	A805 A806 R813	A805-Y809 WeakPolarHBondContact O-CB 3.44Å; A805-Y809 PolarHBondContact O-N 3.33Å; A806-Y809 PolarHBondContact O-N 2.86Å; Y809-R813 HydrophobicContact CD1-CG 4.49Å; Y809-R813 HydrophobicContact CE1-CG 4.32Å; Y809-R813 WeakPolarHBondContact O-CB 3.36Å; Y809-R813 WeakPolarHBondContact O-CG 3.46Å; Y809-R813 PolarHBondContact O-N 3.36Å
810	Q	63.8	Low	58.4	Low	115 Å²	115	116.1 Å²	116.1	54%	0.537	58%	0.584	S	S	.	*	H	α-helix	trans	-68.4	-35.2	170.9	-73.1	-180	32.1	0	0	112.8	A806 E807 R808 R813 Q814	A806-Q810 WeakPolarHBondContact O-CB 3.36Å; A806-Q810 VanDerWaalsContact O-CG 3.3Å; A806-Q810 WeakPolarHBondContact O-CG 3.28Å; A806-Q810 PolarHBondContact O-N 2.81Å; E807-Q810 CarbonylContact O-C 3.57Å; E807-Q810 PolarHBondContact O-N 3.4Å; R808-Q810 VanDerWaalsContact C-N 3.31Å; R808-Q810 PolarHBondContact O-N 3.08Å; Q810-R813 CarbonylContact O-C 3.44Å; Q810-R813 PolarHBondContact O-N 2.8Å; Q810-Q814 WeakPolarHBondContact O-CB 3.43Å; Q810-Q814 WeakPolarHBondContact O-CG 2.96Å; Q810-Q814 PolarHBondContact O-N 2.67Å; Q810-Q814 VanDerWaalsContact O-N 3.16Å
811	Q	62.4	Low	56.5	Low	120 Å²	120	118 Å²	118	56%	0.561	60%	0.599	S	S	*	*	H	α-helix	trans	-67.2	-39.3	174.2	-74.6	169.5	19.8	0	0	112	E807 R808 Q814 Q815	E807-Q811 WeakPolarHBondContact O-CB 3.42Å; E807-Q811 VanDerWaalsContact O-CG 3.26Å; E807-Q811 WeakPolarHBondContact O-CG 3.32Å; E807-Q811 PolarHBondContact O-N 2.59Å; R808-Q811 PolarHBondContact O-N 2.89Å; R808-Q811 VanDerWaalsContact O-N 3.16Å; Q811-Q814 WeakPolarHBondContact O-CA 3.2Å; Q811-Q814 WeakPolarHBondContact O-CB 3.32Å; Q811-Q814 PolarHBondContact O-N 3.16Å; Q811-Q815 PolarHBondContact O-N 3.16Å
812	Q	58.8	Low	54.7	Low	147 Å²	147	116.4 Å²	116.4	69%	0.687	61%	0.609	S	S	*	*	H	α-helix	trans	-64.4	-41.4	172.1	-73.1	178.2	-15	0	0	111.6	R808 Q814 Q815	R808-Q812 PolarHBondContact O-N 2.9Å; Q812-Q814 PolarHBondContact O-N 3.38Å; Q812-Q814 VanDerWaalsContact O-N 3.09Å; Q812-Q815 PolarHBondContact O-N 3.48Å
813	R	53.2	Low	52.7	Low	191 Å²	191	115.8 Å²	115.8	72%	0.721	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-3	169	-74.9	-75.6	-171.2	157.9	1.8	114.5	Y809 Q810	Y809-R813 HydrophobicContact CD1-CG 4.49Å; Y809-R813 HydrophobicContact CE1-CG 4.32Å; Y809-R813 WeakPolarHBondContact O-CB 3.36Å; Y809-R813 WeakPolarHBondContact O-CG 3.46Å; Y809-R813 PolarHBondContact O-N 3.36Å; Q810-R813 CarbonylContact O-C 3.44Å; Q810-R813 PolarHBondContact O-N 2.8Å
814	Q	51.9	Low	50.8	Low	92 Å²	92	117.1 Å²	117.1	43%	0.43	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.1	6.7	-177	-81.6	-161.9	69.7	0	0	114.6	Q810 Q811 Q812 P816 R1145	Q810-Q814 WeakPolarHBondContact O-CB 3.43Å; Q810-Q814 WeakPolarHBondContact O-CG 2.96Å; Q810-Q814 PolarHBondContact O-N 2.67Å; Q810-Q814 VanDerWaalsContact O-N 3.16Å; Q811-Q814 WeakPolarHBondContact O-CA 3.2Å; Q811-Q814 WeakPolarHBondContact O-CB 3.32Å; Q811-Q814 PolarHBondContact O-N 3.16Å; Q812-Q814 PolarHBondContact O-N 3.38Å; Q812-Q814 VanDerWaalsContact O-N 3.09Å; Q814-P816 WeakPolarHBondContact O-CD 3.26Å; Q814-R1145 PolarHBondContact O-NE 3.09Å; Q814-R1145 VanDerWaalsContact O-NE 3.15Å; Q814-R1145 PolarHBondContact O-NH1 3Å; Q814-R1145 VanDerWaalsContact O-NH1 3.17Å; Q814-R1145 PolarHBondContact O-NH2 3.02Å
815	Q	45.5	Very low	49.7	Very low	167 Å²	167	116.3 Å²	116.3	78%	0.78	63%	0.633	S	S	*	*			trans	-92.2	112.6	164.2	-63	-150.6	35.5	0	0	109.9	Q811 Q812	Q811-Q815 PolarHBondContact O-N 3.16Å; Q812-Q815 PolarHBondContact O-N 3.48Å
816	P	45.9	Very low	47.8	Very low	38 Å²	38	122 Å²	122	25%	0.247	65%	0.647	C	S	.	*			trans	-78.5	154.1	171.1	35	-34.4	0	0	0	110	Q814 Q1144	Q814-P816 WeakPolarHBondContact O-CD 3.26Å; P816-Q1144 HydrophobicContact CB-CG 3.82Å; P816-Q1144 VanDerWaalsContact CG-CD 3.49Å; P816-Q1144 HydrophobicContact CG-CG 3.65Å
817	P	41.8	Very low	46.3	Very low	117 Å²	117	127.4 Å²	127.4	76%	0.76	66%	0.664	S	S	*	*			trans	-68.5	138.7	178.5	28.8	-34.5	0	0	0	111.6
818	V	36.7	Very low	44.5	Very low	134 Å²	134	127.3 Å²	127.3	81%	0.812	67%	0.672	S	S	*	*			trans	-116.1	125.7	160.3	179.6	0	0	0	0	106.9
819	G	32.9	Very low	43.3	Very low	66 Å²	66	124.9 Å²	124.9	68%	0.68	67%	0.672	S	S	*	*			trans	-84.2	130.2	-177.3	0	0	0	0	0	113.2
820	V	40	Very low	41.8	Very low	137 Å²	137	127.9 Å²	127.9	83%	0.83	68%	0.684	S	S	*	*			trans	20.9	111	138.9	-169.2	0	0	0	0	118.5
821	T	27.4	Very low	40.3	Very low	131 Å²	131	127.8 Å²	127.8	80%	0.804	69%	0.692	S	S	*	*				-156.6	133.3	114.9	28.7	0	0	0	0	107.1
822	S	29.3	Very low	40.3	Very low	103 Å²	103	127.2 Å²	127.2	72%	0.72	70%	0.698	S	S	*	*				62.8	126.9	68.9	-149.4	0	0	0	0	111.5
823	T	28.9	Very low	39.7	Very low	127 Å²	127	125.9 Å²	125.9	78%	0.779	70%	0.702	S	S	*	*			cis	-140	163.5	38.1	54.8	0	0	0	0	116.2
824	N	37.7	Very low	40.2	Very low	149 Å²	149	122.2 Å²	122.2	80%	0.797	70%	0.703	S	S	*	*			trans	-65.4	178.1	157.1	-52.7	-28.3	0	0	0	110.8
825	P	47.9	Very low	40.3	Very low	107 Å²	107	123 Å²	123	70%	0.695	72%	0.716	S	S	*	*				-152.6	-168.5	81.8	38.9	-17.5	0	0	0	116.5
826	F	32.2	Very low	39.5	Very low	177 Å²	177	120 Å²	120	78%	0.776	71%	0.714	S	S	*	*			trans	76.8	122.5	-176.6	-59.8	-79.7	0	0	0	115
827	H	39.6	Very low	38.8	Very low	161 Å²	161	123.5 Å²	123.5	75%	0.745	73%	0.734	S	S	*	*			cis	-168.5	174.8	-3.9	-137	24.9	0	0	0	107.2
828	S	37	Very low	38.2	Very low	76 Å²	76	126 Å²	126	53%	0.531	74%	0.735	S	S	.	*			cis	-171.8	175.5	-9.1	-134.5	0	0	0	0	106.9
829	N	35	Very low	37.8	Very low	127 Å²	127	123.7 Å²	123.7	68%	0.679	73%	0.726	S	S	*	*			cis	-163.2	172.2	-8.9	-151.4	-10.4	0	0	0	109.9
830	Y	30.9	Very low	37.5	Very low	203 Å²	203	126.5 Å²	126.5	80%	0.796	73%	0.73	S	S	*	*			trans	63.3	145.9	163.7	-90.1	-129.8	0	0	0	118.8
831	V	32.3	Very low	37	Very low	114 Å²	114	124.7 Å²	124.7	69%	0.691	72%	0.723	S	S	*	*			cis	-157.7	159.2	-15.7	111.7	0	0	0	0	109.6
832	P	60.5	Low	37.1	Very low	108 Å²	108	123.2 Å²	123.2	70%	0.701	72%	0.718	S	S	*	*			trans	-107.3	-169.9	-164.1	45	-38.1	0	0	0	114.3
833	P	48	Very low	36.9	Very low	119 Å²	119	127.1 Å²	127.1	77%	0.773	73%	0.725	S	S	*	*			cis	-137.7	-141.9	14.6	47.3	-23.8	0	0	0	116.2
834	P	63.6	Low	36.9	Very low	114 Å²	114	126.6 Å²	126.6	74%	0.74	73%	0.726	S	S	*	*				-127.9	-157.9	-128.8	40.9	-15.6	0	0	0	114.3
835	P	52.7	Low	36.4	Very low	108 Å²	108	124 Å²	124	70%	0.701	72%	0.72	S	S	*	*			cis	-141.3	-178.2	0.5	45	-26.1	0	0	0	119.3
836	S	29.2	Very low	35.4	Very low	105 Å²	105	124.7 Å²	124.7	73%	0.734	72%	0.722	S	S	*	*			trans	78.2	151.4	154.5	83.1	0	0	0	0	119.7
837	T	31.9	Very low	35	Very low	110 Å²	110	124.6 Å²	124.6	68%	0.675	72%	0.724	S	S	*	*			cis	-167.2	146.8	-21.9	20.9	0	0	0	0	111.3
838	H	27.9	Very low	34.7	Very low	169 Å²	169	121.8 Å²	121.8	78%	0.782	72%	0.723	S	S	*	*			trans	60.2	162	156.8	-63.7	-51.8	0	0	0	119.4
839	S	28	Very low	34.2	Very low	87 Å²	87	124.7 Å²	124.7	61%	0.608	74%	0.737	S	S	*	*			cis	-164.6	147.3	-29	-94.2	0	0	0	0	111.6
840	T	28.7	Very low	33.8	Very low	125 Å²	125	124 Å²	124	77%	0.767	74%	0.741	S	S	*	*			trans	56.7	125.3	147.4	56.1	0	0	0	0	124.5
841	S	28.8	Very low	33.7	Very low	98 Å²	98	118.6 Å²	118.6	69%	0.685	73%	0.733	S	S	*	*				80	105.6	124.1	71.4	0	0	0	0	124.4
842	S	28.4	Very low	33.5	Very low	100 Å²	100	120.9 Å²	120.9	70%	0.699	74%	0.736	S	S	*	*				81.2	151	115.5	78.8	0	0	0	0	122.7
843	Q	25.6	Very low	31.8	Very low	185 Å²	185	123.1 Å²	123.1	86%	0.864	74%	0.741	S	S	*	*			trans	76.1	117.4	165.7	-55.3	-171.5	53.3	0	0	118.4
844	S	28.3	Very low	30.7	Very low	116 Å²	116	121.6 Å²	121.6	81%	0.811	74%	0.738	S	S	*	*			trans	-141.7	137.5	151.1	57.1	0	0	0	0	107.3
845	S	28	Very low	28.9	Very low	94 Å²	94	124.1 Å²	124.1	66%	0.657	74%	0.744	S	S	*	*			cis	72.5	98.2	10.5	89.7	0	0	0	0	117.5
846	T	26.6	Very low	27.6	Very low	122 Å²	122	126.3 Å²	126.3	75%	0.748	75%	0.749	S	S	*	*			trans	60.4	122.6	138.3	53.5	0	0	0	0	121.8
847	Q	25.1	Very low	28.3	Very low	175 Å²	175	126.7 Å²	126.7	82%	0.818	75%	0.75	S	S	*	*			trans	78.3	120.4	140.1	-69.7	-169.1	30.9	0	0	121.7
848	S	32.2	Very low	27.9	Very low	103 Å²	103	125.7 Å²	125.7	72%	0.72	75%	0.752	S	S	*	*				62.5	118.6	118.9	-47.8	0	0	0	0	122.9
849	T	26.6	Very low	27.8	Very low	136 Å²	136	122.2 Å²	122.2	83%	0.834	75%	0.747	S	S	*	*			trans	-146.2	133.9	147.8	-8.1	0	0	0	0	106.7
850	C	25.7	Very low	27.7	Very low	113 Å²	113	125.8 Å²	125.8	76%	0.764	76%	0.758	S	S	*	*			cis	69.6	142.1	35.6	-127.7	0	0	0	0	113
851	S	28.9	Very low	27.5	Very low	89 Å²	89	124.8 Å²	124.8	62%	0.622	76%	0.756	S	S	*	*			cis	-124	-150.7	3.6	-57.3	0	0	0	0	110.1
852	Q	28.3	Very low	28.5	Very low	162 Å²	162	126.1 Å²	126.1	76%	0.757	76%	0.762	S	S	*	*			cis	-159.1	131.2	-3.7	-143.5	140.8	-83.2	0	0	106.7
853	I	24.6	Very low	28.4	Very low	156 Å²	156	125.8 Å²	125.8	80%	0.8	76%	0.76	S	S	*	*				54.5	108.3	80.2	-50.5	171.5	0	0	0	116
854	A	25.1	Very low	28.6	Very low	86 Å²	86	123 Å²	123	71%	0.711	76%	0.76	S	S	*	*			trans	178.2	114.2	144	0	0	0	0	0	109.4
855	I	26.4	Very low	28.6	Very low	167 Å²	167	120.8 Å²	120.8	86%	0.856	76%	0.756	S	S	*	*				100.2	130.8	80.1	-78.9	164.7	0	0	0	113.6
856	N	24.4	Very low	28.7	Very low	154 Å²	154	122 Å²	122	82%	0.824	77%	0.765	S	S	*	*			trans	-76.9	168.3	170.3	-93.2	-29.3	0	0	0	111.3
857	P	44.2	Very low	28.8	Very low	114 Å²	114	119.5 Å²	119.5	74%	0.74	76%	0.764	S	S	*	*			cis	-142.2	-171	22.5	42.4	-22.2	0	0	0	116.3
858	A	25	Very low	29	Very low	88 Å²	88	118.4 Å²	118.4	73%	0.727	77%	0.769	S	S	*	*			trans	26.4	143.7	145.5	0	0	0	0	0	121.2
859	S	24.5	Very low	28.8	Very low	97 Å²	97	117.1 Å²	117.1	68%	0.678	77%	0.772	S	S	*	*				171.5	176.2	62.2	54.2	0	0	0	0	113.5
860	I	25.6	Very low	29	Very low	162 Å²	162	118.2 Å²	118.2	83%	0.831	77%	0.773	S	S	*	*			trans	79.6	138.6	152.4	-71.9	160.9	0	0	0	120.1
861	S	24.9	Very low	29.1	Very low	104 Å²	104	120.9 Å²	120.9	73%	0.727	78%	0.776	S	S	*	*			trans	-107.2	-155.3	175.5	-32.9	0	0	0	0	109.7
862	P	49.8	Very low	29	Very low	126 Å²	126	121.5 Å²	121.5	82%	0.818	79%	0.787	S	S	*	*			cis	-113.8	-121.4	-17	20.1	7.3	0	0	0	109.9
863	S	27.2	Very low	29	Very low	92 Å²	92	117.6 Å²	117.6	64%	0.643	79%	0.79	S	S	*	*			cis	-162.3	170.1	-3.6	68.9	0	0	0	0	112.1
864	S	29.1	Very low	29.1	Very low	126 Å²	126	119 Å²	119	88%	0.881	80%	0.798	S	S	*	*			trans	63.8	155.5	173.8	71.6	0	0	0	0	116.7
865	G	27.9	Very low	29.2	Very low	70 Å²	70	118.7 Å²	118.7	72%	0.722	80%	0.803	S	S	*	*			cis	152.6	159.1	-1.5	0	0	0	0	0	109.4
866	S	30.6	Very low	29.3	Very low	119 Å²	119	119.1 Å²	119.1	83%	0.832	81%	0.805	S	S	*	*			cis	-175.3	131	-12.7	48.6	0	0	0	0	110.7
867	G	29.1	Very low	29.4	Very low	71 Å²	71	115.5 Å²	115.5	73%	0.732	80%	0.804	S	S	*	*			trans	69.1	177.1	167.5	0	0	0	0	0	117.2
868	T	29.4	Very low	28.6	Very low	151 Å²	151	115.4 Å²	115.4	93%	0.926	81%	0.806	S	S	*	*			cis	-171.3	143.8	-18.6	17.1	0	0	0	0	108.1
869	G	27.2	Very low	28.9	Very low	77 Å²	77	115.5 Å²	115.5	79%	0.794	81%	0.807	S	S	*	*			trans	174.8	111.6	172.6	0	0	0	0	0	117.2
870	N	31	Very low	30	Very low	158 Å²	158	116.5 Å²	116.5	85%	0.845	81%	0.811	S	S	*	*			trans	-78	178.2	168.1	-66.9	-25.1	0	0	0	110.9
871	M	27.2	Very low	30.2	Very low	170 Å²	170	112.8 Å²	112.8	84%	0.837	81%	0.805	S	S	*	*			cis	-164.3	163.1	12.9	-146.9	165.3	-172.5	0	0	112.8
872	A	28.4	Very low	30.5	Very low	102 Å²	102	113.6 Å²	113.6	84%	0.843	81%	0.811	S	S	*	*			trans	63.2	148.1	146.9	0	0	0	0	0	121.8
873	G	26.7	Very low	29.5	Very low	79 Å²	79	110.9 Å²	110.9	81%	0.814	81%	0.805	S	S	*	*			trans	161.7	83.4	172.4	0	0	0	0	0	114.3
874	L	27.2	Very low	29.7	Very low	187 Å²	187	115.4 Å²	115.4	98%	0.979	82%	0.821	S	S	*	*			trans	-79.1	152.5	174.7	-66.4	159.7	0	0	0	111.3
875	G	27.4	Very low	29.8	Very low	79 Å²	79	112.9 Å²	112.9	81%	0.814	82%	0.815	S	S	*	*			trans	-175.1	71.4	-179.8	0	0	0	0	0	117.9
876	I	27.9	Very low	29.8	Very low	175 Å²	175	114.4 Å²	114.4	90%	0.897	82%	0.821	S	S	*	*			trans	-41.2	145.3	169	-61.7	151.8	0	0	0	114.7
877	G	27.1	Very low	29.8	Very low	78 Å²	78	114 Å²	114	80%	0.804	83%	0.825	S	S	*	*			trans	178.1	94.1	165.7	0	0	0	0	0	115.3
878	S	28	Very low	29.7	Very low	112 Å²	112	114.3 Å²	114.3	78%	0.783	83%	0.828	S	S	*	*			trans	-113.6	162.3	-172	-53.9	0	0	0	0	114.2
879	A	30.9	Very low	29.7	Very low	91 Å²	91	115.5 Å²	115.5	75%	0.752	82%	0.823	S	S	*	*			trans	78	167.9	145.7	0	0	0	0	0	118.5
880	P	46.4	Very low	29.6	Very low	117 Å²	117	121.5 Å²	121.5	76%	0.76	83%	0.827	S	S	*	*				-144.5	165.4	-51.4	41.1	-26.4	0	0	0	117.3
881	A	30.4	Very low	29.3	Very low	85 Å²	85	117.6 Å²	117.6	70%	0.702	82%	0.824	S	S	*	*			trans	59.7	153	132.2	0	0	0	0	0	125.5
882	S	31.3	Very low	29.3	Very low	121 Å²	121	114.9 Å²	114.9	85%	0.846	83%	0.829	S	S	*	*			trans	71.2	146.6	146.1	57.1	0	0	0	0	120.9
883	G	29.4	Very low	29.2	Very low	68 Å²	68	113.9 Å²	113.9	70%	0.701	83%	0.829	S	S	*	*			cis	152.4	173.5	-11.6	0	0	0	0	0	115.6
884	L	31.7	Very low	29.2	Very low	188 Å²	188	113.7 Å²	113.7	98%	0.984	83%	0.826	S	S	*	*			trans	70.5	163.2	165.6	-56.9	166.9	0	0	0	117.6
885	G	29.7	Very low	29.3	Very low	73 Å²	73	112 Å²	112	75%	0.753	82%	0.824	S	S	*	*			trans	-176	-65.6	-177.4	0	0	0	0	0	115.4
886	A	29.7	Very low	29.4	Very low	102 Å²	102	111.3 Å²	111.3	84%	0.843	82%	0.817	S	S	*	*			trans	65.9	162.4	163.6	0	0	0	0	0	122
887	A	28.8	Very low	29.5	Very low	111 Å²	111	111 Å²	111	92%	0.917	81%	0.812	S	S	*	*			trans	76.1	150.4	153.2	0	0	0	0	0	121.7
888	G	27.2	Very low	29.4	Very low	77 Å²	77	113.6 Å²	113.6	79%	0.794	80%	0.803	S	S	*	*			trans	143.6	98.5	172.3	0	0	0	0	0	114
889	H	29.2	Very low	29.4	Very low	176 Å²	176	113.9 Å²	113.9	82%	0.815	80%	0.795	S	S	*	*			trans	-138.5	169.1	176.5	-141.7	66.6	0	0	0	110.1
890	F	26.4	Very low	29.1	Very low	203 Å²	203	116.1 Å²	116.1	89%	0.89	79%	0.79	S	S	*	*			trans	80.7	154	179.3	-74.1	-90.5	0	0	0	119.2
891	G	25.2	Very low	28.2	Very low	75 Å²	75	120.2 Å²	120.2	77%	0.773	79%	0.791	S	S	*	*			trans	141.5	80.1	137.6	0	0	0	0	0	116.5
892	A	26.8	Very low	28	Very low	113 Å²	113	124.4 Å²	124.4	93%	0.934	80%	0.797	S	S	*	*			trans	-65.9	165.4	165.2	0	0	0	0	0	112.6
893	G	26.2	Very low	28.3	Very low	82 Å²	82	124.3 Å²	124.3	85%	0.845	79%	0.793	S	S	*	*			trans	148.8	116.2	162	0	0	0	0	0	113.9
894	G	25.5	Very low	28.3	Very low	74 Å²	74	128.5 Å²	128.5	76%	0.763	80%	0.799	S	S	*	*			trans	-135	131.8	170.4	0	0	0	0	0	111
895	T	31.1	Very low	28.9	Very low	152 Å²	152	124.8 Å²	124.8	93%	0.933	79%	0.786	S	S	*	*			trans	-166.9	140.1	169.8	39.8	0	0	0	0	106.2
896	G	28.8	Very low	28.7	Very low	64 Å²	64	129.1 Å²	129.1	66%	0.66	79%	0.79	S	S	*	*			cis	169.5	159	-6.6	0	0	0	0	0	110
897	E	29.3	Very low	28.5	Very low	170 Å²	170	128.4 Å²	128.4	79%	0.794	78%	0.784	S	S	*	*			trans	67.1	141.6	139.9	-70.5	-164.1	139	0	0	121.3
898	Q	26.4	Very low	28.5	Very low	131 Å²	131	127.4 Å²	127.4	61%	0.612	78%	0.776	S	S	*	*			cis	-172.4	164.8	-17.4	-141.8	-176.8	48.7	0	0	111.6
899	L	27.8	Very low	28.6	Very low	119 Å²	119	132.4 Å²	132.4	62%	0.623	78%	0.778	S	S	*	*			trans	66.6	154.5	156.1	-54.6	-175.2	0	0	0	118.3
900	Q	24.5	Very low	28.7	Very low	137 Å²	137	127.9 Å²	127.9	64%	0.64	77%	0.771	S	S	*	*			cis	-157.7	160.1	-9.4	-121.2	168.2	-2.2	0	0	115.2
901	Y	27.3	Very low	28.8	Very low	203 Å²	203	125.4 Å²	125.4	80%	0.796	77%	0.773	S	S	*	*			trans	55.3	127.4	146.6	-82.3	-57.8	0	0	0	124.8
902	Q	26.3	Very low	28.9	Very low	174 Å²	174	125.1 Å²	125.1	81%	0.813	77%	0.77	S	S	*	*			trans	-54	161	144.6	-99.6	-176.4	2.3	0	0	112.5
903	P	36.6	Very low	28.9	Very low	119 Å²	119	126.7 Å²	126.7	77%	0.773	77%	0.768	S	S	*	*				-150.3	-176	51.4	40.4	-18.3	0	0	0	118.3
904	L	29.9	Very low	29	Very low	156 Å²	156	128 Å²	128	82%	0.817	77%	0.765	S	S	*	*			trans	-63.2	170.6	157.4	-69.4	166	0	0	0	110.8
905	P	44.6	Very low	30	Very low	109 Å²	109	129.2 Å²	129.2	71%	0.708	76%	0.759	S	S	*	*			cis	-146.7	-153	25	32.3	-4.7	0	0	0	115.5
906	I	25.4	Very low	29.8	Very low	165 Å²	165	127.6 Å²	127.6	85%	0.846	75%	0.749	S	S	*	*			trans	96.3	155.1	159.2	-61.6	164	0	0	0	116.9
907	A	26	Very low	29.6	Very low	87 Å²	87	131.4 Å²	131.4	72%	0.719	75%	0.753	S	S	*	*			trans	-136.9	-165.1	-164.8	0	0	0	0	0	111.9
908	A	28.7	Very low	29.3	Very low	90 Å²	90	131 Å²	131	74%	0.744	75%	0.751	S	S	*	*			trans	71.7	152.7	-177.8	0	0	0	0	0	114.8
909	E	28.3	Very low	29.2	Very low	182 Å²	182	129.8 Å²	129.8	85%	0.85	76%	0.757	S	S	*	*			cis	-156.1	138.4	-12.1	-112.4	175.6	-173	0	0	106.5
910	A	31.9	Very low	29	Very low	80 Å²	80	135.7 Å²	135.7	66%	0.661	77%	0.771	S	S	*	*				88.2	172.5	74.2	0	0	0	0	0	115.7
911	T	27.3	Very low	29	Very low	152 Å²	152	134.3 Å²	134.3	93%	0.933	78%	0.777	S	S	*	*			trans	68.4	143.2	-166	77.2	0	0	0	0	114.7
912	G	28.8	Very low	30	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	77%	0.772	S	S	*	*			cis	-177.3	157	-8.9	0	0	0	0	0	108
913	T	26.2	Very low	30	Very low	146 Å²	146	129 Å²	129	90%	0.896	77%	0.769	S	S	*	*			cis	-152	161.3	19.4	38.3	0	0	0	0	111.9
914	S	28.7	Very low	29.4	Very low	111 Å²	111	129.6 Å²	129.6	78%	0.776	76%	0.761	S	S	*	*			trans	-112.9	-173.4	160.7	-150.8	0	0	0	0	107.3
915	P	46.9	Very low	29.2	Very low	99 Å²	99	129.5 Å²	129.5	64%	0.643	76%	0.757	S	S	*	*				-163.5	-161.9	61.4	43.2	-18.3	0	0	0	117.5
916	T	26	Very low	28.4	Very low	117 Å²	117	129.6 Å²	129.6	72%	0.718	76%	0.759	S	S	*	*			trans	72.9	136.1	150.7	49.5	0	0	0	0	120.4
917	L	24.1	Very low	28.4	Very low	144 Å²	144	129 Å²	129	75%	0.754	76%	0.758	S	S	*	*			cis	-156.2	-170.3	-16.2	-128.4	174.6	0	0	0	111.1
918	Q	24	Very low	28.5	Very low	162 Å²	162	136.1 Å²	136.1	76%	0.757	77%	0.768	S	S	*	*			trans	-119.7	173	-158.6	-57.9	155.6	-42.9	0	0	114.6
919	S	24.6	Very low	28.3	Very low	105 Å²	105	135.5 Å²	135.5	73%	0.734	77%	0.771	S	S	*	*			trans	85	127.4	136.9	76.9	0	0	0	0	121
920	R	23.9	Very low	28.4	Very low	244 Å²	244	130.4 Å²	130.4	92%	0.921	77%	0.767	S	S	*	*				-168	166.5	106.7	-104	179.4	176.5	-171.5	-2.3	112.4
921	S	22.7	Very low	28.2	Very low	108 Å²	108	135 Å²	135	76%	0.755	78%	0.781	S	S	*	*			trans	-142.5	-169.7	175.9	-34	0	0	0	0	106.9
922	P	50	Low	28.2	Very low	108 Å²	108	131.4 Å²	131.4	70%	0.701	77%	0.773	S	S	*	*			cis	-125.6	-144.1	-29.6	25.7	-1.1	0	0	0	110
923	E	24.5	Very low	28.2	Very low	157 Å²	157	135.2 Å²	135.2	73%	0.734	78%	0.778	S	S	*	*			trans	79.7	147.9	160.2	-58.5	-161.1	109.6	0	0	118
924	Q	25.4	Very low	28.2	Very low	131 Å²	131	135.6 Å²	135.6	61%	0.612	77%	0.771	S	S	*	*			cis	-156.3	165.6	-0.3	-127.7	178.1	42.6	0	0	113.5
925	Q	24.9	Very low	28.2	Very low	155 Å²	155	136.6 Å²	136.6	72%	0.724	77%	0.772	S	S	*	*			trans	73.8	120.1	148.6	-73.1	174.9	8.6	0	0	124.3
926	S	27.4	Very low	27.1	Very low	110 Å²	110	136.2 Å²	136.2	77%	0.769	78%	0.778	S	S	*	*			trans	56.8	144.2	142.6	52.2	0	0	0	0	121.9
927	D	25	Very low	27.2	Very low	154 Å²	154	135.4 Å²	135.4	82%	0.824	78%	0.777	S	S	*	*			cis	-137.7	170	19	-148.1	-11.5	0	0	0	115
928	Y	29.2	Very low	27.3	Very low	235 Å²	235	137.2 Å²	137.2	92%	0.922	78%	0.779	S	S	*	*			trans	-81.7	141.4	-169	-104.6	-108.8	0	0	0	114.9
929	G	25.5	Very low	27.5	Very low	78 Å²	78	137.3 Å²	137.3	80%	0.804	78%	0.783	S	S	*	*			trans	179.9	45.4	177.6	0	0	0	0	0	117
930	G	28.4	Very low	27.5	Very low	75 Å²	75	137.5 Å²	137.5	77%	0.773	79%	0.785	S	S	*	*			trans	-78.1	-172.6	170.9	0	0	0	0	0	113
931	N	27.8	Very low	27.7	Very low	176 Å²	176	135.2 Å²	135.2	94%	0.941	78%	0.781	S	S	*	*			cis	-164.6	148.1	-6.1	-160.8	0	0	0	0	107.1
932	G	27.2	Very low	27.9	Very low	76 Å²	76	136.7 Å²	136.7	78%	0.784	78%	0.78	S	S	*	*			trans	174.5	127.1	178.2	0	0	0	0	0	116.1
933	N	29.9	Very low	26.7	Very low	149 Å²	149	141.5 Å²	141.5	80%	0.797	79%	0.786	S	S	*	*			trans	-133	164.7	-176.4	-162.6	-2.7	0	0	0	110.7
934	M	25.8	Very low	26.9	Very low	154 Å²	154	138.2 Å²	138.2	76%	0.759	79%	0.785	S	S	*	*			trans	78.7	120.4	165.2	-65.7	-173.6	-81.7	0	0	121.6
935	V	28.3	Very low	27	Very low	131 Å²	131	141.5 Å²	141.5	79%	0.794	79%	0.792	S	S	*	*				67.6	107.7	123.5	-175.6	0	0	0	0	121.2
936	A	24.1	Very low	27.2	Very low	91 Å²	91	142.1 Å²	142.1	75%	0.752	79%	0.788	S	S	*	*			trans	79.1	155.3	138.1	0	0	0	0	0	123.9
937	S	28.2	Very low	27.3	Very low	100 Å²	100	143.6 Å²	143.6	70%	0.699	78%	0.783	S	S	*	*			trans	85.7	113.9	153.6	-82.7	0	0	0	0	122.9
938	K	26.4	Very low	27.6	Very low	183 Å²	183	142.8 Å²	142.8	80%	0.796	78%	0.778	S	S	*	*				66.9	113.1	121.9	-68.4	179	179.7	176.7	0	122
939	L	29.1	Very low	27.6	Very low	163 Å²	163	139.1 Å²	139.1	85%	0.853	77%	0.773	S	S	*	*				57.4	127.6	111.2	-105.1	165.5	0	0	0	121.6
940	S	24.2	Very low	27.7	Very low	109 Å²	109	138 Å²	138	76%	0.762	76%	0.761	S	S	*	*			trans	-158.7	154.3	151.3	-77.8	0	0	0	0	107.3
941	K	27.7	Very low	27.8	Very low	196 Å²	196	138.4 Å²	138.4	85%	0.852	74%	0.743	S	S	*	*			cis	-133.5	139.6	19.5	-61.6	166.6	-177.1	174.8	0	108.7
942	L	27.1	Very low	27.7	Very low	139 Å²	139	133.1 Å²	133.1	73%	0.728	72%	0.72	S	S	*	*				80.3	105.4	66.2	-137.8	-171.8	0	0	0	114
943	Y	24.6	Very low	27.7	Very low	209 Å²	209	133 Å²	133	82%	0.82	71%	0.707	S	S	*	*				177.1	131.2	123.1	-112.3	-87	0	0	0	115.8
944	A	28.6	Very low	27.6	Very low	88 Å²	88	130.7 Å²	130.7	73%	0.727	70%	0.703	S	S	*	*			trans	50.6	159.7	147.6	0	0	0	0	0	124.7
945	R	27.7	Very low	27.7	Very low	201 Å²	201	128.7 Å²	128.7	76%	0.758	70%	0.704	S	S	*	*			cis	-172.8	147.5	-36	-158.4	-174.4	-178.8	165.7	2.9	111.5
946	R	27.9	Very low	27.6	Very low	168 Å²	168	126 Å²	126	63%	0.634	70%	0.702	S	S	*	*			trans	89.3	110.8	141.5	-111.7	-178.3	167.8	142.1	6.9	123.8
947	Q	30.8	Very low	27.6	Very low	140 Å²	140	126.5 Å²	126.5	65%	0.654	71%	0.706	S	S	*	*				67	154.4	122.3	-77.2	-174.9	-30.6	0	0	122.2
948	L	30.3	Very low	27.5	Very low	138 Å²	138	126.4 Å²	126.4	72%	0.723	71%	0.706	S	S	*	*			cis	-168.1	-177.3	-22	-124.6	177.3	0	0	0	111
949	L	29.3	Very low	27.5	Very low	158 Å²	158	124.5 Å²	124.5	83%	0.827	70%	0.704	S	S	*	*			trans	73.8	151.5	171.8	-52.4	169.9	0	0	0	116.1
950	G	28.9	Very low	27.4	Very low	54 Å²	54	122.3 Å²	122.3	56%	0.557	70%	0.703	S	S	*	*			cis	-177.5	116.3	-8.2	0	0	0	0	0	115.3
951	Q	28.8	Very low	27.5	Very low	83 Å²	83	122.2 Å²	122.2	39%	0.388	70%	0.702	S	S	.	*				61	110.5	128.6	-65.4	152.1	7.4	0	0	125.6	A91 T92 P93 F94	A91-Q951 PolarHBondContact O-NE2 2.96Å; A91-Q951 VanDerWaalsContact O-NE2 3.09Å; T92-Q951 VanDerWaalsContact CA-CD 3.43Å; T92-Q951 HydrophobicContact CG2-CG 4.06Å; P93-Q951 VanDerWaalsContact CA-OE1 3.31Å; F94-Q951 CarbonylContact C-O 3.54Å; F94-Q951 VanDerWaalsContact CA-O 3.26Å; F94-Q951 WeakPolarHBondContact CA-O 3.27Å; F94-Q951 PolarHBondContact N-O 3.29Å; F94-Q951 VanDerWaalsContact N-O 3.08Å
952	S	27.6	Very low	27.5	Very low	66 Å²	66	119.6 Å²	119.6	46%	0.462	70%	0.697	S	S	.	*				48.3	131.6	121.1	71.5	0	0	0	0	124.9	F94	F94-S952 PolarHBondContact N-O 3.07Å
953	S	27.2	Very low	27.4	Very low	73 Å²	73	120.3 Å²	120.3	51%	0.51	70%	0.701	S	S	.	*				77.1	116.2	128.5	64	0	0	0	0	122.5	F94	F94-S953 WeakPolarHBondContact CD1-O 3.16Å; F94-S953 WeakPolarHBondContact CE1-O 3.48Å
954	S	27.1	Very low	27.5	Very low	101 Å²	101	113.8 Å²	113.8	71%	0.706	70%	0.697	S	S	*	*				41.6	149.6	125.6	73.3	0	0	0	0	121.1
955	S	27.8	Very low	27.4	Very low	112 Å²	112	115.7 Å²	115.7	78%	0.783	70%	0.704	S	S	*	*			cis	-174.6	157.2	33	50.1	0	0	0	0	113.6
956	G	25.7	Very low	27.5	Very low	73 Å²	73	110.4 Å²	110.4	75%	0.753	70%	0.698	S	S	*	*				100.8	148.1	128.9	0	0	0	0	0	120.7
957	A	24.3	Very low	27.7	Very low	102 Å²	102	112 Å²	112	84%	0.843	70%	0.704	S	S	*	*			trans	67.8	142.5	163.1	0	0	0	0	0	118.6
958	S	25.8	Very low	27.7	Very low	98 Å²	98	110.6 Å²	110.6	69%	0.685	70%	0.698	S	S	*	*			cis	-168.3	160.6	-8.6	43.6	0	0	0	0	113.9
959	N	26.2	Very low	27.6	Very low	143 Å²	143	109.9 Å²	109.9	77%	0.765	69%	0.691	S	S	*	*			trans	88.4	132.6	153.3	-64.2	-11.6	0	0	0	122.4
960	S	28.1	Very low	27.7	Very low	118 Å²	118	108.9 Å²	108.9	83%	0.825	68%	0.681	S	S	*	*			trans	64.4	136.9	151.1	52.3	0	0	0	0	120.4
961	S	25.3	Very low	27.5	Very low	107 Å²	107	112.8 Å²	112.8	75%	0.748	69%	0.689	S	S	*	*			cis	-165.4	173.4	-15.2	-158.9	0	0	0	0	111.2
962	L	27.9	Very low	27.4	Very low	141 Å²	141	112.6 Å²	112.6	74%	0.738	70%	0.702	S	S	*	*			trans	73.5	97	166.1	-55.1	177.8	0	0	0	118.7
963	D	25.8	Very low	27.3	Very low	153 Å²	153	113.7 Å²	113.7	82%	0.818	72%	0.715	S	S	*	*				46.1	129.5	117	-48.2	-35.4	0	0	0	121
964	G	26.1	Very low	27.3	Very low	72 Å²	72	117 Å²	117	74%	0.742	73%	0.732	S	S	*	*			cis	174.3	-176.3	-1.7	0	0	0	0	0	114.5
965	C	26	Very low	27.3	Very low	128 Å²	128	117.5 Å²	117.5	87%	0.865	74%	0.736	S	S	*	*			trans	17.1	137.3	159.9	-92	0	0	0	0	120.4
966	S	31.4	Very low	28.6	Very low	90 Å²	90	117.9 Å²	117.9	63%	0.629	74%	0.736	S	S	*	*			cis	-168.4	141.9	40.8	-119.6	0	0	0	0	111.1
967	R	31.3	Very low	28.6	Very low	201 Å²	201	121 Å²	121	76%	0.758	74%	0.74	S	S	*	*				87.8	127.2	95	-164.3	101.6	-172.2	179.9	29.2	111.4
968	E	30	Very low	28.7	Very low	112 Å²	112	120 Å²	120	52%	0.523	73%	0.732	S	S	.	*			cis	-169.4	167.2	5.5	-108.2	179.9	162.7	0	0	107.8
969	Q	30.2	Very low	28.8	Very low	123 Å²	123	121 Å²	121	58%	0.575	74%	0.739	S	S	*	*			cis	-171.5	168.8	-16.5	-129.5	166.7	14.3	0	0	110.1
970	H	30.8	Very low	28.9	Very low	137 Å²	137	118.7 Å²	118.7	63%	0.634	73%	0.734	S	S	*	*			trans	53	143.3	146.4	-65.3	-44.2	0	0	0	122.2
971	D	24.8	Very low	28.8	Very low	135 Å²	135	122 Å²	122	72%	0.722	74%	0.738	S	S	*	*			cis	-156.9	174	-7.9	-124.2	-4.7	0	0	0	117.1
972	A	26.5	Very low	28.9	Very low	79 Å²	79	123.1 Å²	123.1	65%	0.653	74%	0.736	S	S	*	*			trans	-29.8	140.6	166.3	0	0	0	0	0	116.6
973	A	25.8	Very low	29	Very low	89 Å²	89	125.7 Å²	125.7	74%	0.736	74%	0.736	S	S	*	*			cis	76.3	121.4	47.1	0	0	0	0	0	114.9
974	T	26	Very low	29.1	Very low	142 Å²	142	124.3 Å²	124.3	87%	0.871	73%	0.729	S	S	*	*			trans	-167.2	153.6	155.3	9.3	0	0	0	0	113.2
975	S	27.1	Very low	29.1	Very low	113 Å²	113	130 Å²	130	79%	0.79	74%	0.736	S	S	*	*			trans	-158.6	180	160.3	-57.7	0	0	0	0	104.9
976	P	55.8	Low	29.2	Very low	119 Å²	119	132.4 Å²	132.4	77%	0.773	73%	0.734	S	S	*	*			cis	-129.3	-134.4	-9.6	41.7	-24.1	0	0	0	111.4
977	V	25.2	Very low	29.9	Very low	140 Å²	140	132.8 Å²	132.8	85%	0.848	74%	0.735	S	S	*	*			trans	96.7	151.6	166.8	-169.9	0	0	0	0	116.2
978	A	27	Very low	29.7	Very low	81 Å²	81	129.5 Å²	129.5	67%	0.669	74%	0.737	S	S	*	*			trans	-143.3	-169	-167.8	0	0	0	0	0	111.2
979	S	27.7	Very low	29.8	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	75%	0.747	S	S	*	*			trans	88.6	146.4	-175	-38.3	0	0	0	0	113.3
980	S	27.9	Very low	30.3	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	76%	0.756	S	S	*	*			cis	-176.8	155.7	-13.4	45.4	0	0	0	0	110
981	M	27	Very low	30.1	Very low	187 Å²	187	133 Å²	133	92%	0.921	76%	0.763	S	S	*	*			trans	66.6	157.2	161.9	-73.5	160.2	178.2	0	0	115.7
982	D	27.8	Very low	31.6	Very low	131 Å²	131	131.7 Å²	131.7	70%	0.701	76%	0.762	S	S	*	*			cis	-159.4	168	-16.9	179.9	30.6	0	0	0	108.1
983	R	28.8	Very low	32.3	Very low	195 Å²	195	134 Å²	134	74%	0.736	77%	0.77	S	S	*	*			trans	75.4	123.2	162.5	-54.7	-151.8	173.3	-158	-2.9	123.6
984	D	27.9	Very low	32.4	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	77%	0.769	S	S	*	*				60.6	145.4	121.1	-56.1	-36.2	0	0	0	124.9
985	Q	26.6	Very low	32.5	Very low	192 Å²	192	137.3 Å²	137.3	90%	0.897	77%	0.768	S	S	*	*			trans	85.2	128.3	155	-74.3	165.9	29.7	0	0	121.6
986	E	26.8	Very low	32.5	Very low	178 Å²	178	142.6 Å²	142.6	83%	0.832	77%	0.77	S	S	*	*			trans	-82.2	178.7	161.5	-110.6	-156.5	164.6	0	0	110.8
987	P	46.7	Very low	31.1	Very low	98 Å²	98	141.6 Å²	141.6	64%	0.636	77%	0.766	S	S	*	*			cis	-134.1	-147.4	-18.5	29.4	-6.3	0	0	0	112
988	V	26.6	Very low	31.2	Very low	132 Å²	132	141.9 Å²	141.9	80%	0.8	77%	0.768	S	S	*	*			trans	106.3	132.6	154.7	-179	0	0	0	0	118.9
989	H	31.9	Very low	31.2	Very low	161 Å²	161	143.4 Å²	143.4	75%	0.745	77%	0.768	S	S	*	*			trans	-89.1	148.8	170.6	-121.5	-50.7	0	0	0	110.4
990	P	41.8	Very low	31.3	Very low	118 Å²	118	145.4 Å²	145.4	77%	0.766	77%	0.77	S	S	*	*				-154.9	-163.9	89.4	40.7	-20.5	0	0	0	115.6
991	Q	26.7	Very low	31.2	Very low	167 Å²	167	148.5 Å²	148.5	78%	0.78	78%	0.779	S	S	*	*			trans	-120.8	-178	171.4	-76.7	-140.2	5	0	0	110.1
992	P	56.5	Low	31.2	Very low	106 Å²	106	142.9 Å²	142.9	69%	0.688	77%	0.769	S	S	*	*			cis	-120.1	-164.6	-35.8	36.1	-18.2	0	0	0	110.3
993	P	41.2	Very low	31.2	Very low	127 Å²	127	142.9 Å²	142.9	83%	0.825	78%	0.779	S	S	*	*				-151.6	-166.6	86.5	39.5	-18.4	0	0	0	114.6
994	A	27.8	Very low	31.1	Very low	86 Å²	86	137.7 Å²	137.7	71%	0.711	79%	0.786	S	S	*	*			trans	-122.5	170.5	-177.3	0	0	0	0	0	113.1
995	Y	27.3	Very low	31.1	Very low	216 Å²	216	135.2 Å²	135.2	85%	0.847	79%	0.79	S	S	*	*			trans	176.7	149.4	132.8	-115.3	-90.2	0	0	0	114.7
996	R	27.2	Very low	31.2	Very low	223 Å²	223	136.3 Å²	136.3	84%	0.842	79%	0.792	S	S	*	*			trans	54.9	135.4	164.5	-83.4	155.1	179	-167.7	-1.1	118.8
997	S	26.3	Very low	31.2	Very low	99 Å²	99	132.3 Å²	132.3	69%	0.692	78%	0.784	S	S	*	*			cis	99.2	110	23	-175.3	0	0	0	0	115.2
998	V	27.1	Very low	30.2	Very low	145 Å²	145	137 Å²	137	88%	0.879	79%	0.79	S	S	*	*			trans	-137.5	137.9	149.8	-179.7	0	0	0	0	107.7
999	V	28	Very low	30.2	Very low	113 Å²	113	140.1 Å²	140.1	69%	0.685	79%	0.789	S	S	*	*			trans	-134.2	140.8	174.7	174	0	0	0	0	107.3
1000	N	28.7	Very low	29.9	Very low	161 Å²	161	141.6 Å²	141.6	86%	0.861	79%	0.789	S	S	*	*			trans	-156.1	148.7	146	-120.3	-20	0	0	0	113.8
1001	N	27.1	Very low	29.3	Very low	160 Å²	160	146.1 Å²	146.1	86%	0.856	79%	0.791	S	S	*	*			trans	-122.1	158.6	177	-91.5	-36.9	0	0	0	109.3
1002	G	27.1	Very low	29.4	Very low	69 Å²	69	143.3 Å²	143.3	71%	0.711	79%	0.785	S	S	*	*			trans	158.7	110.2	164.6	0	0	0	0	0	111.3
1003	S	27.9	Very low	28.1	Very low	130 Å²	130	146 Å²	146	91%	0.909	79%	0.793	S	S	*	*			cis	106.4	114	31.3	70.2	0	0	0	0	111.4
1004	G	27.2	Very low	27.4	Very low	86 Å²	86	144.9 Å²	144.9	89%	0.887	79%	0.788	S	S	*	*			trans	179	102.9	174.1	0	0	0	0	0	110.8
1005	G	27.6	Very low	27.3	Very low	72 Å²	72	144.9 Å²	144.9	74%	0.742	79%	0.788	S	S	*	*			trans	-131	-174.8	-176.8	0	0	0	0	0	113.1
1006	K	27.5	Very low	27.3	Very low	215 Å²	215	139.3 Å²	139.3	94%	0.935	79%	0.787	S	S	*	*			trans	-155.9	150.1	166.9	-104.3	154.8	-171.7	177.1	0	110.6
1007	S	26.8	Very low	27.2	Very low	94 Å²	94	133.5 Å²	133.5	66%	0.657	78%	0.78	S	S	*	*			trans	-73.5	172.5	-168	-48.3	0	0	0	0	113.9
1008	Y	26.7	Very low	27.2	Very low	198 Å²	198	133.5 Å²	133.5	78%	0.776	78%	0.781	S	S	*	*			cis	-145	-165.4	27.9	-60.9	-93.1	0	0	0	110.7
1009	Y	26.6	Very low	27.3	Very low	197 Å²	197	131.9 Å²	131.9	77%	0.773	78%	0.775	S	S	*	*			cis	-150.5	-115.3	13.7	-135.4	-46.7	0	0	0	114.7
1010	Y	26	Very low	27.3	Very low	192 Å²	192	131.1 Å²	131.1	75%	0.753	78%	0.775	S	S	*	*			trans	-156.3	172.3	-166.1	-95.7	-92.8	0	0	0	109
1011	R	27.2	Very low	27.2	Very low	212 Å²	212	130 Å²	130	80%	0.8	77%	0.769	S	S	*	*			cis	-148.2	-175	12.9	-167.3	158.8	-86.7	-148.8	-4.7	111.8
1012	T	29.3	Very low	27.3	Very low	108 Å²	108	128.3 Å²	128.3	66%	0.663	77%	0.765	S	S	*	*			trans	-123.4	151.8	-162.2	49.3	0	0	0	0	116.3
1013	L	28.6	Very low	27.3	Very low	164 Å²	164	129.2 Å²	129.2	86%	0.859	76%	0.76	S	S	*	*			trans	61.7	163.6	144.2	-62	167.1	0	0	0	118.8
1014	S	27.3	Very low	27.3	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	76%	0.756	S	S	*	*			cis	-158.7	172.5	0.1	-143.9	0	0	0	0	113
1015	A	26.8	Very low	27.2	Very low	86 Å²	86	131.9 Å²	131.9	71%	0.711	75%	0.746	S	S	*	*			trans	44.8	123.5	146.8	0	0	0	0	0	122
1016	A	26.2	Very low	27.2	Very low	98 Å²	98	134.7 Å²	134.7	81%	0.81	75%	0.749	S	S	*	*				81.5	147.6	88.2	0	0	0	0	0	114.9
1017	S	25.9	Very low	27	Very low	101 Å²	101	129.5 Å²	129.5	71%	0.706	74%	0.74	S	S	*	*			cis	-167.6	178.4	-4	45.4	0	0	0	0	111.6
1018	S	26.1	Very low	27.9	Very low	100 Å²	100	130.3 Å²	130.3	70%	0.699	74%	0.743	S	S	*	*			trans	67.5	115.5	160.3	25.3	0	0	0	0	118.4
1019	S	27.8	Very low	27.9	Very low	110 Å²	110	126.9 Å²	126.9	77%	0.769	74%	0.742	S	S	*	*				76.6	140.4	75.5	72.4	0	0	0	0	114.5
1020	S	29.6	Very low	28	Very low	97 Å²	97	123.1 Å²	123.1	68%	0.678	74%	0.74	S	S	*	*			cis	-171.2	-178.5	11.1	35.6	0	0	0	0	113
1021	N	26.6	Very low	28	Very low	139 Å²	139	120.6 Å²	120.6	74%	0.743	74%	0.735	S	S	*	*			trans	90	111.8	161.1	-59.9	-13.3	0	0	0	119.8
1022	T	27.9	Very low	28.8	Very low	124 Å²	124	115.7 Å²	115.7	76%	0.761	73%	0.731	S	S	*	*				80.8	144.8	88.7	-25.3	0	0	0	0	112.4
1023	S	28.2	Very low	28.8	Very low	87 Å²	87	117.4 Å²	117.4	61%	0.608	74%	0.735	S	S	*	*			cis	-166.2	168.4	35.6	-41.9	0	0	0	0	115
1024	Q	27.3	Very low	29.6	Very low	175 Å²	175	115.5 Å²	115.5	82%	0.818	73%	0.733	S	S	*	*			trans	67.7	125.1	150.7	-75.6	175	70.3	0	0	118.9
1025	S	25.8	Very low	29.6	Very low	98 Å²	98	114.4 Å²	114.4	69%	0.685	74%	0.738	S	S	*	*				62.9	140.8	85	79.7	0	0	0	0	115.2
1026	T	27.3	Very low	29.7	Very low	130 Å²	130	114.2 Å²	114.2	80%	0.798	74%	0.744	S	S	*	*			cis	-145.1	176.5	26.6	54.9	0	0	0	0	114.5
1027	S	24.1	Very low	29.9	Very low	107 Å²	107	111.3 Å²	111.3	75%	0.748	72%	0.723	S	S	*	*			trans	-79.4	-171.9	162.6	-30.7	0	0	0	0	111.3
1028	P	43.9	Very low	30	Very low	111 Å²	111	109.3 Å²	109.3	72%	0.721	71%	0.707	S	S	*	*			cis	-150.2	-168.5	28	44.9	-22.4	0	0	0	118.6
1029	T	27.2	Very low	30.2	Very low	125 Å²	125	109 Å²	109	77%	0.767	70%	0.704	S	S	*	*			trans	73.4	141.3	145.6	-62.6	0	0	0	0	120.2
1030	T	28.4	Very low	30.2	Very low	118 Å²	118	106.2 Å²	106.2	72%	0.724	69%	0.685	S	S	*	*			cis	-168.8	156.3	-19.5	-85.9	0	0	0	0	110.8
1031	E	25.8	Very low	30.1	Very low	140 Å²	140	109.6 Å²	109.6	65%	0.654	69%	0.688	S	S	*	*			trans	-13.6	163.8	156	-74.6	-68.7	130.6	0	0	120.3	L1033	E1031-L1033 PolarHBondContact OE2-N 3.34Å
1032	P	44.7	Very low	30.2	Very low	108 Å²	108	109.1 Å²	109.1	70%	0.701	69%	0.685	S	S	*	*			cis	-153.1	145.9	40.2	40.9	-17.9	0	0	0	123.5
1033	L	30.3	Very low	30.2	Very low	145 Å²	145	109.3 Å²	109.3	76%	0.759	67%	0.671	S	S	*	*				54.9	178.8	129.5	-59.5	177.4	0	0	0	121.9	E1031	E1031-L1033 PolarHBondContact OE2-N 3.34Å
1034	P	43.9	Very low	30.1	Very low	124 Å²	124	114.6 Å²	114.6	81%	0.805	68%	0.678	S	S	*	*			cis	-124.6	-177.2	-13.2	32.2	-12.3	0	0	0	114.9
1035	G	28.2	Very low	30.1	Very low	80 Å²	80	116.4 Å²	116.4	83%	0.825	68%	0.679	S	S	*	*			trans	170.7	5.4	162.1	0	0	0	0	0	127.6
1036	G	29.4	Very low	30.1	Very low	81 Å²	81	115.9 Å²	115.9	84%	0.835	68%	0.68	S	S	*	*			trans	61.6	116.4	150.5	0	0	0	0	0	125.6
1037	G	30	Very low	30.1	Very low	37 Å²	37	115.1 Å²	115.1	38%	0.381	68%	0.68	S	S	.	*				98.5	123.8	106.4	0	0	0	0	0	124	Q778 R779	Q778-G1037 CarbonylContact C-O 3.56Å; Q778-G1037 VanDerWaalsContact CB-O 3.32Å; Q778-G1037 WeakPolarHBondContact CB-O 3.48Å; R779-G1037 CarbonylContact C-O 3.51Å; R779-G1037 WeakPolarHBondContact CA-O 3.04Å; R779-G1037 PolarHBondContact N-O 2.89Å; R779-G1037 CarbonylContact O-C 3.53Å
1038	T	28.5	Very low	30.3	Very low	59 Å²	59	115.4 Å²	115.4	36%	0.362	68%	0.682	S	S	.	*				79.1	92	113.1	16.8	0	0	0	0	131.4	Q778 R779 L780	Q778-T1038 CarbonylContact C-O 3.54Å; Q778-T1038 VanDerWaalsContact CA-O 3.28Å; Q778-T1038 WeakPolarHBondContact CA-O 3.32Å; Q778-T1038 WeakPolarHBondContact CB-O 3.49Å; Q778-T1038 VanDerWaalsContact O-O 3.11Å; Q778-T1038 PolarHBondContact OE1-OG1 3.42Å; R779-T1038 VanDerWaalsContact C-C 3.49Å; R779-T1038 PolarHBondContact N-O 3.18Å; R779-T1038 VanDerWaalsContact N-O 3.08Å; R779-T1038 PolarHBondContact O-N 3.22Å; R779-T1038 VanDerWaalsContact O-N 3.11Å; L780-T1038 HydrophobicContact CD1-CG2 3.62Å; L780-T1038 HydrophobicContact CG-CG2 3.92Å
1039	S	29.3	Very low	29.4	Very low	93 Å²	93	113.3 Å²	113.3	65%	0.65	68%	0.681	S	S	*	*			trans	158.4	109.1	173.2	60.9	0	0	0	0	114.8	L780	L780-S1039 VanDerWaalsContact CA-N 3.26Å; L780-S1039 WeakPolarHBondContact CA-O 3.4Å; L780-S1039 WeakPolarHBondContact CB-O 3.47Å; L780-S1039 VanDerWaalsContact CG-N 3.31Å; L780-S1039 PolarHBondContact N-O 2.91Å
1040	S	28.2	Very low	29.9	Very low	52 Å²	52	113.8 Å²	113.8	36%	0.364	69%	0.686	S	S	.	*			trans	-133.6	-167.3	-144.6	55.4	0	0	0	0	122
1041	F	27.6	Very low	29.8	Very low	168 Å²	168	112.2 Å²	112.2	74%	0.737	69%	0.693	S	S	*	*			trans	102.1	151.7	163.2	-61.9	-67.1	0	0	0	117.1
1042	L	28	Very low	29.8	Very low	129 Å²	129	108.5 Å²	108.5	68%	0.675	69%	0.693	S	S	*	*			cis	-151.5	136.9	1.6	-134.3	168.7	0	0	0	111.2
1043	R	27.1	Very low	29	Very low	128 Å²	128	109.1 Å²	109.1	48%	0.483	70%	0.7	S	S	.	*			trans	-124.5	140.1	153.8	-178.7	-164	-79.6	-172	7.1	108.1	N784 Q785	N784-R1043 VanDerWaalsContact C-NH2 3.29Å; N784-R1043 HydrophobicContact CB-CB 4.12Å; N784-R1043 PolarHBondContact O-NE 3.1Å; N784-R1043 PolarHBondContact O-NH2 2.98Å; N784-R1043 PolarHBondContact OD1-NH1 3.47Å; N784-R1043 PolarHBondContact OD1-NH2 3.48Å; Q785-R1043 PolarHBondContact O-NH2 3.36Å
1044	R	27.3	Very low	28.8	Very low	198 Å²	198	109.2 Å²	109.2	75%	0.747	70%	0.7	S	S	*	*			trans	-141.3	125.6	156.9	-173.1	177.2	-65.8	-153.3	1.8	109.9
1045	Y	26.8	Very low	28	Very low	214 Å²	214	108.5 Å²	108.5	84%	0.839	70%	0.697	S	S	*	*				172.3	119.4	124.3	-98	-64.8	0	0	0	112
1046	A	26.1	Very low	28.1	Very low	86 Å²	86	111.1 Å²	111.1	71%	0.711	70%	0.698	S	S	*	*			trans	-171.5	146.5	151.3	0	0	0	0	0	108.2
1047	S	27	Very low	28.9	Very low	114 Å²	114	112.6 Å²	112.6	80%	0.797	69%	0.692	S	S	*	*			trans	33.1	139.6	152	52.4	0	0	0	0	121.2
1048	S	27.9	Very low	29.2	Very low	113 Å²	113	116.8 Å²	116.8	79%	0.79	71%	0.713	S	S	*	*			cis	-169.4	168.6	4.5	42.9	0	0	0	0	110.3
1049	G	25	Very low	29.1	Very low	67 Å²	67	119.3 Å²	119.3	69%	0.691	73%	0.733	S	S	*	*			trans	-76.2	-159.4	172.2	0	0	0	0	0	114.2
1050	P	38.6	Very low	29.4	Very low	136 Å²	136	120.6 Å²	120.6	88%	0.883	74%	0.739	S	S	*	*			cis	-140.9	171.3	24.7	42.7	-25.3	0	0	0	118.3
1051	G	25.7	Very low	29.5	Very low	84 Å²	84	126.2 Å²	126.2	87%	0.866	76%	0.759	S	S	*	*			trans	90.6	139.6	152.8	0	0	0	0	0	117.7
1052	G	26.7	Very low	29.7	Very low	63 Å²	63	124.7 Å²	124.7	65%	0.649	76%	0.757	S	S	*	*			cis	160.7	154.1	-12.6	0	0	0	0	0	115
1053	S	26.9	Very low	29.6	Very low	120 Å²	120	126.5 Å²	126.5	84%	0.839	77%	0.767	S	S	*	*			trans	69.9	156.9	169.9	77.8	0	0	0	0	116.3
1054	I	27	Very low	29.7	Very low	148 Å²	148	124.5 Å²	124.5	76%	0.759	78%	0.778	S	S	*	*			cis	-138.5	162.9	16.4	-72.7	178	0	0	0	112.2
1055	S	27.1	Very low	29.6	Very low	109 Å²	109	118 Å²	118	76%	0.762	77%	0.773	S	S	*	*			trans	85.5	142.8	156.5	53.7	0	0	0	0	122.1
1056	T	29.1	Very low	29.6	Very low	135 Å²	135	116.1 Å²	116.1	83%	0.828	78%	0.776	S	S	*	*			trans	-130.7	-154.3	-175.9	50.1	0	0	0	0	109.7
1057	P	46.6	Very low	29.7	Very low	112 Å²	112	117.8 Å²	117.8	73%	0.727	77%	0.773	S	S	*	*				-106.6	-166.7	-117	41	-22.3	0	0	0	113.4
1058	P	35.8	Very low	29.8	Very low	125 Å²	125	122.1 Å²	122.1	81%	0.812	77%	0.772	S	S	*	*				-146.1	-171.3	83.7	38.7	-19.2	0	0	0	115.5
1059	S	27.4	Very low	29.9	Very low	111 Å²	111	127 Å²	127	78%	0.776	77%	0.773	S	S	*	*			trans	-80.5	163.4	-168.6	-47.8	0	0	0	0	116.4
1060	P	36.6	Very low	30.1	Very low	121 Å²	121	131.9 Å²	131.9	79%	0.786	78%	0.777	S	S	*	*			trans	-93.3	159.6	173.2	37.1	-35.4	0	0	0	114.7
1061	H	29.2	Very low	29.7	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.787	78%	0.778	S	S	*	*			trans	-127.4	121.6	163.1	-96.6	-81.2	0	0	0	106.9
1062	I	30.8	Very low	29.9	Very low	135 Å²	135	137.7 Å²	137.7	69%	0.692	77%	0.771	S	S	*	*				89.8	144.8	88.6	-86.6	-165.9	0	0	0	113.4
1063	L	27.8	Very low	30.8	Very low	167 Å²	167	139.5 Å²	139.5	87%	0.874	77%	0.772	S	S	*	*			trans	67.6	158.6	-179	-63.1	160.7	0	0	0	116
1064	A	27.6	Very low	30.8	Very low	86 Å²	86	140.9 Å²	140.9	71%	0.711	77%	0.77	S	S	*	*			cis	-172.3	168.6	-32.5	0	0	0	0	0	110.6
1065	G	25.3	Very low	31.7	Very low	63 Å²	63	139.5 Å²	139.5	65%	0.649	77%	0.771	S	S	*	*			trans	75.8	120.5	131.8	0	0	0	0	0	121.2
1066	L	27.4	Very low	32.7	Very low	174 Å²	174	139.5 Å²	139.5	91%	0.911	77%	0.768	S	S	*	*				33.5	130	120.3	-54	167.4	0	0	0	117.6
1067	D	28.1	Very low	33.5	Very low	120 Å²	120	138.2 Å²	138.2	64%	0.642	76%	0.762	S	S	*	*				171.2	-179.1	63.7	-165.7	6.4	0	0	0	110.7
1068	R	30.1	Very low	32.7	Very low	205 Å²	205	144 Å²	144	77%	0.774	77%	0.77	S	S	*	*			trans	69.2	92.5	152.3	-77.1	153.1	-161.3	-114.3	-3.4	122.4
1069	R	28.2	Very low	32.4	Very low	217 Å²	217	148.4 Å²	148.4	82%	0.819	77%	0.771	S	S	*	*				18.1	150.6	117.3	-49.1	-177.6	-169.9	-170.5	2.8	121.3
1070	H	31.1	Very low	32.5	Very low	168 Å²	168	150.6 Å²	150.6	78%	0.778	77%	0.774	S	S	*	*			trans	76.4	150.4	170	-59.3	-76.9	0	0	0	115.1
1071	R	30.1	Very low	32.3	Very low	238 Å²	238	155.7 Å²	155.7	90%	0.898	78%	0.778	S	S	*	*			cis	-149.4	165.2	7.1	-138.6	177.7	-161.6	-177.7	4.7	110.4
1072	S	29.7	Very low	32.2	Very low	104 Å²	104	151.2 Å²	151.2	73%	0.727	78%	0.777	S	S	*	*			trans	-114.8	176	166.8	-145.2	0	0	0	0	108.6
1073	P	44	Very low	32.2	Very low	102 Å²	102	154.1 Å²	154.1	66%	0.662	79%	0.788	S	S	*	*			cis	-133.8	-179	-8.1	43	-26.5	0	0	0	114.8
1074	D	28.2	Very low	32.2	Very low	149 Å²	149	151.1 Å²	151.1	80%	0.797	78%	0.781	S	S	*	*			trans	34.4	169.7	137.2	-64.2	-0.3	0	0	0	124.2
1075	P	45.4	Very low	33	Very low	119 Å²	119	152 Å²	152	77%	0.773	78%	0.78	S	S	*	*			cis	-124.2	-103.1	-24.4	21.2	2.5	0	0	0	117.5
1076	P	49	Very low	33.4	Very low	108 Å²	108	155.7 Å²	155.7	70%	0.701	78%	0.784	S	S	*	*				-115.7	-160.6	-126.8	42.1	-23	0	0	0	112.5
1077	P	44.2	Very low	33.8	Very low	109 Å²	109	154 Å²	154	71%	0.708	78%	0.775	S	S	*	*			cis	-124.5	-156.6	1.4	26.5	1.7	0	0	0	112.3
1078	R	30.6	Very low	34	Very low	234 Å²	234	154.1 Å²	154.1	88%	0.883	78%	0.775	S	S	*	*			cis	-151.1	-176.3	28.9	-65.6	179.3	178.2	-163.6	-1.1	112.8
1079	Y	30.3	Very low	34.1	Very low	216 Å²	216	154.6 Å²	154.6	85%	0.847	78%	0.777	S	S	*	*			trans	-117.8	158.4	-179.3	-98.6	-97.4	0	0	0	113.2
1080	N	29.1	Very low	34.3	Very low	158 Å²	158	151.2 Å²	151.2	85%	0.845	77%	0.768	S	S	*	*			trans	-158.3	142	133.2	-104.1	-19.6	0	0	0	109.3
1081	R	31.2	Very low	34.1	Very low	228 Å²	228	150.2 Å²	150.2	86%	0.86	77%	0.768	S	S	*	*			cis	165	103.7	-40.5	176.4	179.2	-160.3	-166.8	5.9	104.6
1082	G	27.5	Very low	34	Very low	75 Å²	75	145.9 Å²	145.9	77%	0.773	76%	0.762	S	S	*	*			trans	-146.7	25.2	-165.6	0	0	0	0	0	116.6
1083	Q	30.6	Very low	33.9	Very low	196 Å²	196	148.3 Å²	148.3	92%	0.916	77%	0.766	S	S	*	*			trans	65.2	155.5	174.8	-59	-167.3	-1.4	0	0	118.3
1084	S	28.8	Very low	33.1	Very low	105 Å²	105	152.6 Å²	152.6	73%	0.734	78%	0.777	S	S	*	*			trans	-134.7	-166.5	-177.7	62.8	0	0	0	0	106.1
1085	P	45.1	Very low	33.1	Very low	105 Å²	105	153.8 Å²	153.8	68%	0.682	78%	0.783	S	S	*	*			cis	-130.1	-160.8	5	25.2	4	0	0	0	111.2
1086	L	32.5	Very low	32.4	Very low	140 Å²	140	153.6 Å²	153.6	73%	0.733	79%	0.785	S	S	*	*			cis	-155.1	148.3	31.8	-71.3	158.4	0	0	0	112.9
1087	L	35.8	Very low	31.5	Very low	138 Å²	138	152 Å²	152	72%	0.723	79%	0.787	S	S	*	*			trans	41.5	148.8	142.7	-77.5	95.1	0	0	0	123.2
1088	L	32.6	Very low	30.8	Very low	122 Å²	122	156.3 Å²	156.3	64%	0.639	80%	0.798	S	S	*	*			cis	-176.3	153.7	-24.5	-156.8	74.2	0	0	0	109.8
1089	R	33	Very low	31.7	Very low	216 Å²	216	150.4 Å²	150.4	82%	0.815	79%	0.79	S	S	*	*			trans	65.1	159.6	150.3	-97.6	-176.4	-174.2	165.8	0.4	116.9
1090	K	30.9	Very low	32	Very low	145 Å²	145	146.2 Å²	146.2	63%	0.63	79%	0.789	S	S	*	*			cis	-147.2	150.7	-16.1	-164.2	-173.2	172.5	-159.9	0	107.2
1091	N	28	Very low	31.9	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	79%	0.787	S	S	*	*			trans	-131.2	167.8	159.5	-141.1	-23.6	0	0	0	110
1092	L	28.3	Very low	31.8	Very low	146 Å²	146	137.2 Å²	137.2	76%	0.764	79%	0.786	S	S	*	*			trans	63.6	115.9	-169	-73.7	80.1	0	0	0	116.3
1093	L	27	Very low	32.5	Very low	156 Å²	156	139.1 Å²	139.1	82%	0.817	79%	0.785	S	S	*	*				-168.8	107.5	114.2	-110.5	168.9	0	0	0	109.8
1094	E	27.6	Very low	32.4	Very low	191 Å²	191	137 Å²	137	89%	0.893	78%	0.779	S	S	*	*			trans	-160.2	117.2	155.5	-139.1	164.9	-145.7	0	0	110.6
1095	L	28.7	Very low	32.6	Very low	175 Å²	175	138.7 Å²	138.7	92%	0.916	78%	0.779	S	S	*	*			trans	-161.9	69.5	175.7	-140.2	179.6	0	0	0	110.7
1096	S	29.8	Very low	31.8	Very low	115 Å²	115	142.6 Å²	142.6	80%	0.804	79%	0.788	S	S	*	*			trans	-158.1	149.6	174.5	50.7	0	0	0	0	109.1
1097	G	29.5	Very low	32.1	Very low	74 Å²	74	141 Å²	141	76%	0.763	77%	0.772	S	S	*	*			trans	-124.6	162.1	-159.5	0	0	0	0	0	117.8
1098	Q	30.2	Very low	31.8	Very low	200 Å²	200	145.4 Å²	145.4	94%	0.935	78%	0.779	S	S	*	*			trans	72.9	156.5	161.7	-72.7	-137.4	-31.8	0	0	119.5
1099	P	48.5	Very low	32.1	Very low	109 Å²	109	146.8 Å²	146.8	71%	0.708	78%	0.777	S	S	*	*			trans	-112.8	173.4	-152.3	46	-36.7	0	0	0	112.9
1100	P	37.3	Very low	32.2	Very low	128 Å²	128	142 Å²	142	83%	0.831	77%	0.772	S	S	*	*				-150.6	172.3	84.9	39.9	-22.2	0	0	0	116.1
1101	G	26.8	Very low	32.3	Very low	78 Å²	78	140.3 Å²	140.3	80%	0.804	78%	0.778	S	S	*	*			trans	100.4	132.9	147.5	0	0	0	0	0	118.7
1102	S	29.8	Very low	32.5	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	78%	0.775	S	S	*	*			trans	-105.6	152	155.7	-47.9	0	0	0	0	107.8
1103	P	41.1	Very low	32.6	Very low	115 Å²	115	136.1 Å²	136.1	75%	0.747	78%	0.778	S	S	*	*				-154.6	153	83.9	39	-19.5	0	0	0	118.6
1104	L	29.6	Very low	33.7	Very low	151 Å²	151	134.5 Å²	134.5	79%	0.791	78%	0.777	S	S	*	*			trans	38.9	115.1	137.1	-57.1	174.9	0	0	0	123
1105	L	32.6	Very low	35.1	Very low	142 Å²	142	130.9 Å²	130.9	74%	0.743	77%	0.769	S	S	*	*				64.1	132.3	127.6	-58.6	175.1	0	0	0	122
1106	H	28.8	Very low	35.4	Very low	186 Å²	186	130.3 Å²	130.3	86%	0.861	77%	0.767	S	S	*	*				-157.5	174.2	113	-110.4	77.7	0	0	0	113.8
1107	R	37.8	Very low	36	Very low	108 Å²	108	130.2 Å²	130.2	41%	0.408	76%	0.763	S	S	.	*			trans	-147.5	150.8	-158.2	171.8	-114.3	-79.7	146	1.4	113	R152	R152-R1107 PolarHBondContact O-NH2 3.22Å
1108	R	30.8	Very low	37.2	Very low	230 Å²	230	131.6 Å²	131.6	87%	0.868	76%	0.759	S	S	*	*			trans	-131.5	115.5	160.5	-72.6	-166.3	177.1	-163.8	-0.2	114.2
1109	Y	38	Very low	37.7	Very low	150 Å²	150	127.7 Å²	127.7	59%	0.588	75%	0.751	S	S	*	*			trans	51.3	-175.6	147.4	-58.4	-70.1	0	0	0	119	R152	R152-Y1109 PolarHBondContact NH2-O 3.47Å
1110	V	35.7	Very low	37	Very low	117 Å²	117	133.3 Å²	133.3	71%	0.709	76%	0.758	S	S	*	*			cis	-121	-127.7	-5.4	-152.9	0	0	0	0	112.6	R152	R152-V1110 VanDerWaalsContact NH2-N 3.18Å; R152-V1110 PolarHBondContact NH2-O 3.17Å
1111	S	32.9	Very low	36.9	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	76%	0.76	S	S	*	*			trans	-130.7	-178.1	-165.8	58.1	0	0	0	0	112
1112	A	31.7	Very low	37.1	Very low	90 Å²	90	137.9 Å²	137.9	74%	0.744	76%	0.755	S	S	*	*			cis	-149.6	-167.1	8.5	0	0	0	0	0	112.7
1113	S	30	Very low	37.1	Very low	117 Å²	117	137.4 Å²	137.4	82%	0.818	75%	0.752	S	S	*	*			trans	-154.9	-174.7	-179.2	-47.2	0	0	0	0	109.5
1114	P	49.9	Very low	36.5	Very low	122 Å²	122	140.4 Å²	140.4	79%	0.792	76%	0.756	S	S	*	*			cis	-136.2	-168.6	-0.5	42.5	-21.7	0	0	0	115
1115	P	58.6	Low	36.5	Very low	114 Å²	114	138.2 Å²	138.2	74%	0.74	75%	0.753	S	S	*	*			trans	-115.2	-175.2	-176.6	42	-32.8	0	0	0	116.1
1116	L	33.7	Very low	36.9	Very low	164 Å²	164	138.5 Å²	138.5	86%	0.859	76%	0.76	S	S	*	*			trans	136.3	170.9	160.6	-76.9	168	0	0	0	114
1117	P	43.8	Very low	37	Very low	112 Å²	112	135.1 Å²	135.1	73%	0.727	76%	0.755	S	S	*	*			cis	-139.1	-131.2	-46.5	47.8	-28.1	0	0	0	114.9
1118	P	54.7	Low	36.4	Very low	104 Å²	104	133.7 Å²	133.7	68%	0.675	77%	0.774	S	S	*	*			trans	-139	-165.4	-143.5	43.7	-18.4	0	0	0	118.3
1119	P	39.5	Very low	36.3	Very low	117 Å²	117	128.2 Å²	128.2	76%	0.76	77%	0.771	S	S	*	*			trans	-117.2	141.2	143	35.2	-25.7	0	0	0	111.6
1120	R	34.6	Very low	37	Very low	228 Å²	228	125.6 Å²	125.6	86%	0.86	77%	0.773	S	S	*	*			cis	79	134.4	48.4	-73.5	-166.6	179.8	-151.1	3.7	114.5
1121	R	35	Very low	36.7	Very low	234 Å²	234	128.5 Å²	128.5	88%	0.883	78%	0.778	S	S	*	*			cis	-172.2	144.3	-12.3	-171.5	-172.9	-164.6	-155.4	6	111.9
1122	G	30.1	Very low	36.6	Very low	68 Å²	68	130.9 Å²	130.9	70%	0.701	78%	0.777	S	S	*	*			trans	93.2	159.6	155.1	0	0	0	0	0	117.3
1123	S	29.9	Very low	36.5	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	78%	0.776	S	S	*	*			cis	-169.2	158.9	-11.9	39.5	0	0	0	0	112.9
1124	E	28.4	Very low	36.5	Very low	177 Å²	177	138.4 Å²	138.4	83%	0.827	77%	0.773	S	S	*	*			trans	76.2	141.9	152.4	-80.8	172.7	-167	0	0	123.7
1125	S	29.5	Very low	35.7	Very low	105 Å²	105	138.1 Å²	138.1	73%	0.734	77%	0.769	S	S	*	*			trans	64.7	126	143.1	-59.8	0	0	0	0	122.9
1126	V	40.7	Very low	34.4	Very low	148 Å²	148	142.9 Å²	142.9	90%	0.897	77%	0.772	S	S	*	*			trans	-99	124.5	162.4	173.3	0	0	0	0	109.3
1127	P	32.4	Very low	34.2	Very low	116 Å²	116	141.5 Å²	141.5	75%	0.753	77%	0.765	S	S	*	*			trans	-150	168.4	136.3	38.5	-23.2	0	0	0	115.2
1128	G	25.6	Very low	33.7	Very low	78 Å²	78	144.2 Å²	144.2	80%	0.804	77%	0.767	S	S	*	*			trans	97.8	95.7	132.9	0	0	0	0	0	119.7
1129	S	26.8	Very low	32.3	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	78%	0.778	S	S	*	*			trans	-79.2	164.1	142.7	166.3	0	0	0	0	109.4
1130	P	54	Low	32.1	Very low	96 Å²	96	149.9 Å²	149.9	62%	0.623	77%	0.774	S	S	*	*			cis	-130.4	171.7	-27.7	35.4	-20.7	0	0	0	113.2
1131	Q	28.7	Very low	32.4	Very low	177 Å²	177	144.8 Å²	144.8	83%	0.827	77%	0.771	S	S	*	*			trans	-175.9	126.7	138.6	-102.4	152.4	87	0	0	111.8
1132	H	31.8	Very low	32.1	Very low	159 Å²	159	141.4 Å²	141.4	74%	0.736	77%	0.765	S	S	*	*				62.5	106.4	96.1	-84.7	74.6	0	0	0	116.5
1133	F	29.3	Very low	33.3	Very low	165 Å²	165	142.8 Å²	142.8	72%	0.724	76%	0.762	S	S	*	*				161.2	104.6	115	-95.7	-89.3	0	0	0	106.8
1134	R	30.1	Very low	33.5	Very low	200 Å²	200	142.8 Å²	142.8	76%	0.755	75%	0.75	S	S	*	*				76.6	124.3	76.5	-171.6	-170.8	-160.8	-173.6	9	112.2
1135	T	32.3	Very low	33.7	Very low	116 Å²	116	140.5 Å²	140.5	71%	0.712	73%	0.734	S	S	*	*			trans	65.3	149.5	167.2	44.2	0	0	0	0	116.4
1136	R	31.1	Very low	33.8	Very low	213 Å²	213	145.8 Å²	145.8	80%	0.804	74%	0.737	S	S	*	*			cis	-164.4	159.8	14.3	-130.4	166.9	177	-154.4	1.7	111.4
1137	I	30.3	Very low	33.3	Very low	136 Å²	136	144.2 Å²	144.2	70%	0.697	72%	0.723	S	S	*	*			trans	72.8	138.2	146.2	-75.3	156.7	0	0	0	120.6
1138	H	32.4	Very low	33.1	Very low	169 Å²	169	147.1 Å²	147.1	78%	0.782	72%	0.72	S	S	*	*			trans	-66.3	155.4	172.2	-50.3	-118.4	0	0	0	113
1139	Y	26.8	Very low	33.2	Very low	227 Å²	227	153 Å²	153	89%	0.89	72%	0.718	S	S	*	*				-161.5	141.7	114.3	-127.9	-117.8	0	0	0	113.1
1140	T	34.4	Very low	33.2	Very low	113 Å²	113	152.8 Å²	152.8	69%	0.693	71%	0.712	S	S	*	*			trans	-81.1	164.4	161	39	0	0	0	0	109.5
1141	P	40.6	Very low	31.9	Very low	121 Å²	121	153.2 Å²	153.2	79%	0.786	71%	0.708	S	S	*	*			cis	-153.5	-176.6	43.7	41.1	-17.4	0	0	0	119.6
1142	E	28.4	Very low	31.8	Very low	162 Å²	162	149.5 Å²	149.5	76%	0.757	69%	0.694	S	S	*	*			trans	-45.1	179.1	151.4	-100	-163	133.3	0	0	115.9
1143	P	56.8	Low	31.9	Very low	98 Å²	98	150.6 Å²	150.6	64%	0.636	70%	0.699	S	S	*	*			cis	-124.2	-146.5	-3	28.6	-3.4	0	0	0	110.1
1144	Q	32.6	Very low	32	Very low	109 Å²	109	149.9 Å²	149.9	51%	0.509	70%	0.698	S	S	.	*			cis	-147.1	-115.6	0.1	-156.1	-168.4	105.7	0	0	113.8	P816	P816-Q1144 HydrophobicContact CB-CG 3.82Å; P816-Q1144 VanDerWaalsContact CG-CD 3.49Å; P816-Q1144 HydrophobicContact CG-CG 3.65Å
1145	R	33.6	Very low	32.1	Very low	129 Å²	129	147.3 Å²	147.3	49%	0.487	70%	0.695	S	S	.	*			trans	-157.9	158.5	-162.5	-64.7	164.9	173.9	-93.2	-34.5	111.4	Q814	Q814-R1145 PolarHBondContact O-NE 3.09Å; Q814-R1145 VanDerWaalsContact O-NE 3.15Å; Q814-R1145 PolarHBondContact O-NH1 3Å; Q814-R1145 VanDerWaalsContact O-NH1 3.17Å; Q814-R1145 PolarHBondContact O-NH2 3.02Å
1146	R	31.4	Very low	32.1	Very low	215 Å²	215	149 Å²	149	81%	0.811	69%	0.694	S	S	*	*				179.1	122.1	114	-98.7	-175.6	168.6	-155.8	-1.7	116
1147	I	29.1	Very low	32.1	Very low	115 Å²	115	145.2 Å²	145.2	59%	0.59	69%	0.688	S	S	*	*				88	137	123.8	-74.2	175.2	0	0	0	124
1148	Y	28.8	Very low	32.3	Very low	178 Å²	178	145.8 Å²	145.8	70%	0.698	69%	0.687	S	S	*	*			trans	71.8	118.7	157.4	-73.9	-30.6	0	0	0	125.2
1149	R	27.5	Very low	32.2	Very low	200 Å²	200	144.3 Å²	144.3	76%	0.755	68%	0.681	S	S	*	*				42.8	144.4	109.4	-73.3	-177	-174.7	170	-0.2	118.6
1150	T	26.3	Very low	32.6	Very low	111 Å²	111	138.4 Å²	138.4	68%	0.681	67%	0.666	S	S	*	*			cis	-164.9	169.2	16.5	-4.1	0	0	0	0	113.2
1151	I	27.8	Very low	32.5	Very low	104 Å²	104	140.3 Å²	140.3	53%	0.533	66%	0.664	S	S	.	*			trans	72.1	95.7	150	-65.6	155.5	0	0	0	118.8	T675	T675-I1151 HydrophobicContact CG2-CG2 3.74Å; T675-I1151 PolarHBondContact OG1-O 3.2Å
1152	D	27.5	Very low	31.8	Very low	100 Å²	100	141.9 Å²	141.9	54%	0.535	65%	0.654	S	S	.	*			trans	54.9	171	137.3	-46	-39.7	0	0	0	118.9	T675 I676	T675-D1152 VanDerWaalsContact CA-C 3.48Å; T675-D1152 VanDerWaalsContact CA-O 3.32Å; T675-D1152 WeakPolarHBondContact CA-O 3.38Å; T675-D1152 HydrophobicContact CG2-CB 4.46Å; T675-D1152 PolarHBondContact N-O 3.41Å; T675-D1152 PolarHBondContact OG1-O 3.15Å; T675-D1152 VanDerWaalsContact OG1-O 3.1Å; I676-D1152 HydrophobicContact CB-CB 4.17Å; I676-D1152 HydrophobicContact CD1-CB 3.83Å; I676-D1152 HydrophobicContact CG1-CB 4.11Å
1153	Q	32	Very low	32.1	Very low	182 Å²	182	140.1 Å²	140.1	85%	0.85	64%	0.644	S	S	*	*			cis	-96.4	0	19.3	-160.3	167.4	88.6	0	0	113.1	T674 T675 I676	T674-Q1153 WeakPolarHBondContact O-CB 3.5Å; T675-Q1153 VanDerWaalsContact CA-N 3.32Å; T675-Q1153 PolarHBondContact O-NE2 3.16Å; I676-Q1153 VanDerWaalsContact N-NE2 3.16Å

Retrieved 1,153 of 1,153 residues in 678 ms (Link to these results)

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