A0A087XMD1_POEFO Loading...

SH3-domain binding protein 4a

AlphaFold DB , UniProt , Accession A0A087XMD1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 960 aa.

						>A0A087XMD1_POEFO|A0A087XMD1
MAAHRIIRVNNNHILPRCKSEGTLIELNEGPAGACLSDVKVPSPSALKLDSQDSLGAAQEVVAIKDYCPSSFTTLKFSKGDRLYVLDTSGGEWWYAHNNTEMGYIPAAYVQPVNFRNSSLSDSGMIDSLGEGYEDGGKEFGGLGEWMGMSLKPSTIYNNTPFSVNPFICPLNQNSNDVSMRNSADLIYLDSLASPSSCSNSCSIMSNGFSSCHINSLNSTSPNQEVTSNFQSENLFFKSKRSHSLSELSVLQAQSNPTLPSSGFFTGLTAPLPEQFQSREDFRTAWLNHRKLARSCHDLDSLGQSPGWGQTQPVETNIVCRLDCNGGVVQLPDTHISVHIPEGHVSHGDYQQISMKALLDPPLELNSNRCTTVSPVVEIKLSNMETKSFLTLEIKISVAVKKESCHAADVLCVRSDCKEGPYTPIPNAYIFKDTVQVQLDSLEPCMYVAVVVQAQYVGHNTTVWDHVQRKVSLGVYGPKHIHPSFKTVVAMFGHDCTPKTLLVNDVTWQAASTPPVALQLWGKHQFVLPFPQDLQIGLYSNMSNYQVKASEGTGIIRGFQVKLGKVSRLLFMITSHNPSSISDFTLRVQVKDALDCILTQFCVQTPQPPPKTGARITGQRRFLKKREVDKIVLSPLAVTSKHPKFQDRCVTNLKFGKLIKTVIRQHKNTYLLEYKKGDVIALLSEEKIKLRGQLRTKEWYIGYYQGKLGLVHAKNVLVLGKVKPIYWCGPDLTTTMLLDQILKPCKFLTYIYATVRTVLMENVGSWRAFADALGYGNLPLNYFCRTELDNEPERVASVLEKLKEESTNMENKERKSFQRELMMALLKMDCQGLVAKLVLDFVLLTTAVEVASRWRELAEKLARVSRQQMEAYEAPHRDKNGILDNESMWKPAYDFLLTWAAHVGDSYRDVIQELHHGLDKMRNPITKRWKHLTGALVLVNCLDTLRSAAFCPTGYGDFAV
					

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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	42.8	Very low	30.6	Very low	246 Å²	246	173.6 Å²	173.6	100%	1.212	89%	0.893	S	S	*	*				0	100.3	0	-69.5	177.6	-82.1	0	0	108.6
2	A	30.4	Very low	30.3	Very low	109 Å²	109	169.6 Å²	169.6	90%	0.901	87%	0.874	S	S	*	*			trans	-158.2	-7.6	-179.6	0	0	0	0	0	116.3
3	A	27	Very low	30.1	Very low	95 Å²	95	168.5 Å²	168.5	79%	0.785	86%	0.862	S	S	*	*	S	Bend	trans	-132.1	36.7	-164.1	0	0	0	0	0	114.6
4	H	30.6	Very low	29.7	Very low	194 Å²	194	167.2 Å²	167.2	90%	0.898	86%	0.856	S	S	*	*	S	Bend	trans	-132.1	23.6	-174.8	-105.8	-84.4	0	0	0	114.3
5	R	31.1	Very low	29.8	Very low	246 Å²	246	166.7 Å²	166.7	93%	0.928	85%	0.854	S	S	*	*	S	Bend	trans	-125.1	13.5	-166.5	-122.3	-177.5	-170.5	-167.5	2.1	117.3
6	I	33.3	Very low	29.9	Very low	166 Å²	166	164.3 Å²	164.3	85%	0.851	85%	0.853	S	S	*	*	S	Bend	trans	-119	-12.1	-171.9	-65.8	-179.7	0	0	0	114.6
7	I	31.3	Very low	29.6	Very low	167 Å²	167	168.2 Å²	168.2	86%	0.856	85%	0.854	S	S	*	*	S	Bend	trans	-119.1	39	-175	-34.7	-177.6	0	0	0	113.4
8	R	30.8	Very low	29.3	Very low	243 Å²	243	165.4 Å²	165.4	92%	0.917	85%	0.851	S	S	*	*			trans	-154.1	61.1	167.9	-76.6	-159.2	-175.4	179.6	3	114.1
9	V	26.6	Very low	29.2	Very low	135 Å²	135	166.7 Å²	166.7	82%	0.818	85%	0.85	S	S	*	*			trans	-151.5	98.5	146.4	-172.9	0	0	0	0	109.3
10	N	26.9	Very low	29.1	Very low	157 Å²	157	163.5 Å²	163.5	84%	0.84	84%	0.843	S	S	*	*				-177.5	99.3	127.5	-114	1.2	0	0	0	109.8
11	N	25.6	Very low	29	Very low	152 Å²	152	165.1 Å²	165.1	81%	0.813	85%	0.847	S	S	*	*			trans	-148.6	138.9	152.5	-129.2	2.9	0	0	0	107.7
12	N	26.7	Very low	28.2	Very low	125 Å²	125	156.9 Å²	156.9	67%	0.668	82%	0.824	S	S	*	*			trans	77.5	124	168.7	-58.4	4.3	0	0	0	120
13	H	27.6	Very low	28.1	Very low	156 Å²	156	158.8 Å²	158.8	72%	0.722	83%	0.825	S	S	*	*			trans	98.6	113.1	137.6	-68.8	-39.4	0	0	0	123
14	I	24.9	Very low	28	Very low	150 Å²	150	161.6 Å²	161.6	77%	0.769	83%	0.826	S	S	*	*				83.9	135.6	127.2	-64.8	168.7	0	0	0	118.3
15	L	31.7	Very low	28	Very low	160 Å²	160	160.5 Å²	160.5	84%	0.838	83%	0.825	S	S	*	*			trans	-71.5	157.3	175.6	-66.7	163.1	0	0	0	112
16	P	30.4	Very low	27.6	Very low	127 Å²	127	156.6 Å²	156.6	83%	0.825	82%	0.817	S	S	*	*				-136.2	172.4	111.8	32.6	-19	0	0	0	115.3
17	R	25.4	Very low	27.4	Very low	232 Å²	232	156.9 Å²	156.9	88%	0.875	82%	0.82	S	S	*	*			trans	-81.1	156.4	-176.3	-68.1	169.2	155.2	131.9	-10.7	113.5
18	C	24.6	Very low	27.1	Very low	118 Å²	118	155.3 Å²	155.3	80%	0.797	81%	0.813	S	S	*	*				169.8	158.4	122.9	-93.1	0	0	0	0	111.7
19	K	26.7	Very low	26.8	Very low	190 Å²	190	152.2 Å²	152.2	83%	0.826	81%	0.809	S	S	*	*			cis	-175.9	124.6	-34.6	-131.1	-168.6	178.9	-168.8	0	109.2
20	S	28	Very low	26.7	Very low	102 Å²	102	149 Å²	149	71%	0.713	80%	0.803	S	S	*	*			trans	179.7	112.8	156.3	49.9	0	0	0	0	108
21	E	26.4	Very low	27.8	Very low	198 Å²	198	147.7 Å²	147.7	93%	0.925	80%	0.803	S	S	*	*				73.4	126.7	105.6	-67.8	177.7	164.9	0	0	114.7
22	G	26.4	Very low	27.7	Very low	72 Å²	72	145.5 Å²	145.5	74%	0.742	81%	0.806	S	S	*	*			cis	154.7	121.4	-10.4	0	0	0	0	0	113.5
23	T	27.6	Very low	27.5	Very low	149 Å²	149	143 Å²	143	91%	0.914	81%	0.809	S	S	*	*			trans	-158.2	144.5	158.8	-73	0	0	0	0	108.1
24	L	25.8	Very low	27.3	Very low	154 Å²	154	140.4 Å²	140.4	81%	0.806	82%	0.815	S	S	*	*			trans	-98.7	153.7	-175.2	-68.8	154.8	0	0	0	111.2
25	I	29.4	Very low	27.2	Very low	171 Å²	171	139.6 Å²	139.6	88%	0.877	82%	0.821	S	S	*	*				-168.5	139.6	122.1	-95.1	152.7	0	0	0	107.8
26	E	24.1	Very low	26.9	Very low	164 Å²	164	139 Å²	139	77%	0.766	82%	0.819	S	S	*	*			trans	-94.8	154.4	173.5	-57.7	174.1	128.6	0	0	109.6
27	L	27.9	Very low	26.6	Very low	173 Å²	173	138.3 Å²	138.3	91%	0.906	82%	0.817	S	S	*	*				-179.9	-177.4	108.6	-97.9	168.6	0	0	0	112.7
28	N	26.1	Very low	26.5	Very low	134 Å²	134	133.4 Å²	133.4	72%	0.717	81%	0.808	S	S	*	*			trans	-107.4	-177.8	-165.4	-168.1	25.1	0	0	0	111.6
29	E	25	Very low	26.7	Very low	178 Å²	178	133.9 Å²	133.9	83%	0.832	81%	0.807	S	S	*	*			trans	74.7	150.7	160.5	-55.8	-177.6	150.7	0	0	119.9
30	G	24.2	Very low	26.5	Very low	67 Å²	67	134.2 Å²	134.2	69%	0.691	81%	0.808	S	S	*	*			trans	-140.1	-164.7	146.9	0	0	0	0	0	106.5
31	P	49	Very low	26.7	Very low	129 Å²	129	135.2 Å²	135.2	84%	0.838	81%	0.809	S	S	*	*			cis	-126.2	-155.1	-0.1	43	-26.9	0	0	0	111.7
32	A	23	Very low	26.6	Very low	106 Å²	106	131.5 Å²	131.5	88%	0.876	80%	0.803	S	S	*	*			trans	69.6	153.3	176.9	0	0	0	0	0	115.3
33	G	23.3	Very low	26.4	Very low	72 Å²	72	133.2 Å²	133.2	74%	0.742	80%	0.803	S	S	*	*			cis	-150.2	-166	-8.7	0	0	0	0	0	108.5
34	A	24.2	Very low	26.8	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	80%	0.796	S	S	*	*			cis	166.5	133	-14.4	0	0	0	0	0	104.8
35	C	21.8	Very low	26.8	Very low	133 Å²	133	129.7 Å²	129.7	90%	0.899	80%	0.795	S	S	*	*			trans	-157.3	148.6	152.8	-158.3	0	0	0	0	109.1
36	L	25.6	Very low	26.6	Very low	149 Å²	149	126.1 Å²	126.1	78%	0.78	79%	0.791	S	S	*	*			trans	-137.4	151	-168.6	-90.8	164.9	0	0	0	111.8
37	S	23.5	Very low	26.7	Very low	112 Å²	112	126 Å²	126	78%	0.783	79%	0.794	S	S	*	*			trans	-162.4	83.4	151.1	58.6	0	0	0	0	106.7
38	D	24.6	Very low	26.5	Very low	128 Å²	128	127 Å²	127	68%	0.684	79%	0.792	S	S	*	*				65.9	94.5	95.6	-69.9	-31.6	0	0	0	112.5
39	V	28.7	Very low	26.7	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	80%	0.795	S	S	*	*				77.9	102.6	66.1	177.4	0	0	0	0	113.8
40	K	21.4	Very low	26.6	Very low	198 Å²	198	126.4 Å²	126.4	86%	0.861	79%	0.793	S	S	*	*				-163.9	157.4	117.2	-128.1	170.1	-176.9	169.9	0	113.2
41	V	32	Very low	26.6	Very low	122 Å²	122	128.6 Å²	128.6	74%	0.739	80%	0.798	S	S	*	*			trans	-127	146.6	174.3	-179.4	0	0	0	0	108.4
42	P	25.1	Very low	25.6	Very low	121 Å²	121	130.8 Å²	130.8	79%	0.786	80%	0.797	S	S	*	*			trans	-129.5	162.8	142.6	37	-26.6	0	0	0	112.7
43	S	22	Very low	25.8	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	80%	0.796	S	S	*	*			trans	-99.6	-154.6	-178.8	-49.1	0	0	0	0	111.4
44	P	36.1	Very low	26.1	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	80%	0.795	S	S	*	*				-103.4	177.1	-125.2	40.1	-28.4	0	0	0	116.1
45	S	26.1	Very low	26.8	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	80%	0.799	S	S	*	*			trans	83.6	82.2	157.3	-56.5	0	0	0	0	119.6
46	A	25.5	Very low	27.4	Very low	97 Å²	97	135.2 Å²	135.2	80%	0.802	79%	0.789	S	S	*	*			trans	-142.8	100.7	142.5	0	0	0	0	0	107.3
47	L	26	Very low	28.2	Very low	160 Å²	160	132.9 Å²	132.9	84%	0.838	79%	0.792	S	S	*	*				71.2	113.5	72.6	-71.3	179.2	0	0	0	115.1
48	K	24.1	Very low	29.6	Very low	196 Å²	196	129.9 Å²	129.9	85%	0.852	77%	0.773	S	S	*	*			trans	94	90.6	160.1	-60.1	-173.3	177.5	-175.1	0	120.3
49	L	28.6	Very low	31.8	Very low	151 Å²	151	128.1 Å²	128.1	79%	0.791	76%	0.761	S	S	*	*				73.3	156.1	112.9	-142.4	69.5	0	0	0	121.1
50	D	24.1	Very low	34.4	Very low	148 Å²	148	123.5 Å²	123.5	79%	0.791	73%	0.731	S	S	*	*			trans	70.4	140.4	175.8	-54.9	-37.8	0	0	0	116.4
51	S	24.3	Very low	37.4	Very low	113 Å²	113	114.1 Å²	114.1	79%	0.79	69%	0.69	S	S	*	*			cis	-129	172	9.8	61.8	0	0	0	0	114.3
52	Q	28.3	Very low	40.1	Very low	174 Å²	174	110.3 Å²	110.3	81%	0.813	67%	0.668	S	S	*	*			trans	-69.6	149.2	176.5	-67.5	160.6	-129.3	0	0	113.8
53	D	27.1	Very low	43.1	Very low	158 Å²	158	104.6 Å²	104.6	85%	0.845	63%	0.631	S	S	*	*				172.6	144.4	128.8	-91.6	-20.7	0	0	0	110.5
54	S	28.8	Very low	46.2	Very low	106 Å²	106	102.4 Å²	102.4	74%	0.741	61%	0.61	S	S	*	*			cis	-149.7	148	-20.3	60	0	0	0	0	108.8	G56	S54-G56 PolarHBondContact O-N 3.42Å
55	L	38.7	Very low	48.5	Very low	174 Å²	174	101.6 Å²	101.6	91%	0.911	59%	0.594	S	S	*	*			trans	-76.4	112.1	-179.2	-171.4	74.5	0	0	0	109.9	A57	L55-A57 PolarHBondContact O-N 2.85Å
56	G	34.2	Very low	51.3	Low	68 Å²	68	100.7 Å²	100.7	70%	0.701	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-58	126.2	175.5	0	0	0	0	0	111.3	S54 A58	S54-G56 PolarHBondContact O-N 3.42Å; G56-A58 PolarHBondContact O-N 3.36Å
57	A	43.9	Very low	53.9	Low	100 Å²	100	97.4 Å²	97.4	83%	0.826	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-64.3	120.5	-166.6	0	0	0	0	0	113	L55 Q59	L55-A57 PolarHBondContact O-N 2.85Å; A57-Q59 PolarHBondContact O-N 3.16Å
58	A	52.1	Low	56.3	Low	49 Å²	49	94.6 Å²	94.6	41%	0.405	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-65.1	125.6	165.7	0	0	0	0	0	109.3	G56 E60 V85 L86	G56-A58 PolarHBondContact O-N 3.36Å; A58-E60 PolarHBondContact O-N 3.09Å; A58-V85 VanDerWaalsContact CA-O 3.31Å; A58-V85 WeakPolarHBondContact CA-O 3.43Å; A58-L86 HydrophobicContact CB-CD2 4.4Å
59	Q	70.5	Confident	58.5	Low	92 Å²	92	87.7 Å²	87.7	43%	0.43	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.7	-174.9	-168.6	168.7	12	0	0	109.8	A57 V61 V85 P112	A57-Q59 PolarHBondContact O-N 3.16Å; Q59-V61 HydrophobicContact CG-CG1 4.38Å; Q59-V61 PolarHBondContact O-N 3.36Å; Q59-V85 HydrophobicContact CB-CB 4.39Å; Q59-V85 PolarHBondContact N-O 2.91Å; Q59-V85 PolarHBondContact O-N 2.78Å; Q59-P112 HydrophobicContact CG-CB 4.39Å
60	E	83.3	Confident	59.8	Low	31 Å²	31	86.3 Å²	86.3	15%	0.145	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	126.7	173.3	-168.7	-177.8	-170.5	0	0	109.9	A58 R82 Y84 V113 F115	A58-E60 PolarHBondContact O-N 3.09Å; E60-R82 VanDerWaalsContact CD-NH1 3.34Å; E60-R82 WeakPolarHBondContact OE1-CB 3.33Å; E60-R82 WeakPolarHBondContact OE1-CD 3.4Å; E60-R82 VanDerWaalsContact OE1-CG 3.26Å; E60-R82 WeakPolarHBondContact OE1-CG 3.41Å; E60-R82 IonicContact OE1-CZ 3.53Å; E60-R82 IonicContact OE1-NE 2.69Å; E60-R82 IonicContact OE1-NH1 3.87Å; E60-R82 PolarHBondContact OE1-NH1 3.08Å; E60-R82 IonicContact OE2-NH1 3.84Å; E60-R82 PolarHBondContact OE2-NH1 3.24Å; E60-Y84 HydrophobicContact CB-CD1 4.14Å; E60-Y84 HydrophobicContact CB-CE1 4.04Å; E60-Y84 HydrophobicContact CG-CD1 4.26Å; E60-Y84 HydrophobicContact CG-CE1 3.91Å; E60-V113 HydrophobicContact CG-CG2 4.08Å; E60-V113 PolarHBondContact O-N 2.82Å; E60-F115 WeakPolarHBondContact OE2-CE2 3.1Å
61	V	84.6	Confident	61.2	Low	0 Å²	0	80.7 Å²	80.7	0%	0	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146	178.4	-53.3	0	0	0	0	109.8	Q59 L83 V85 W94 I105 V110 Q111 P112	Q59-V61 HydrophobicContact CG-CG1 4.38Å; Q59-V61 PolarHBondContact O-N 3.36Å; V61-L83 HydrophobicContact CG2-CB 3.95Å; V61-L83 PolarHBondContact N-O 3.05Å; V61-L83 PolarHBondContact O-N 3.13Å; V61-V85 HydrophobicContact CB-CG2 4.43Å; V61-V85 HydrophobicContact CG1-CG2 3.71Å; V61-V85 HydrophobicContact CG2-CG2 3.76Å; V61-W94 HydrophobicContact CG1-CZ3 4.34Å; V61-I105 HydrophobicContact CG2-CD1 4.32Å; V61-V110 HydrophobicContact CB-CB 3.98Å; V61-V110 HydrophobicContact CB-CG2 4.32Å; V61-V110 HydrophobicContact CG2-CB 3.67Å; V61-V110 HydrophobicContact CG2-CG1 3.86Å; V61-V110 HydrophobicContact CG2-CG2 3.95Å; V61-Q111 CarbonylContact C-O 3.56Å; V61-Q111 WeakPolarHBondContact CA-O 3.46Å; V61-P112 HydrophobicContact CG1-CB 4.32Å
62	V	89.1	Confident	62.4	Low	43 Å²	43	84.4 Å²	84.4	26%	0.261	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	135.4	174.5	164.6	0	0	0	0	110.2	I64 D81 R82 V110 Q111 V113	V62-I64 PolarHBondContact O-N 2.72Å; V62-D81 CarbonylContact C-O 3.5Å; V62-D81 WeakPolarHBondContact CA-O 3.42Å; V62-R82 HydrophobicContact CG2-CG 3.82Å; V62-V110 CarbonylContact O-C 3.49Å; V62-V110 VanDerWaalsContact O-CA 3.32Å; V62-V110 WeakPolarHBondContact O-CA 3.1Å; V62-Q111 PolarHBondContact N-O 3.04Å; V62-Q111 PolarHBondContact O-N 2.86Å; V62-V113 HydrophobicContact CB-CG2 4.3Å; V62-V113 HydrophobicContact CG2-CG2 3.6Å
63	A	87.9	Confident	64.6	Low	1 Å²	1	77.7 Å²	77.7	1%	0.008	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	120.2	174.9	0	0	0	0	0	112.1	F77 S78 G80 D81 Y109	A63-F77 HydrophobicContact CB-CD2 3.36Å; A63-F77 HydrophobicContact CB-CE2 3.67Å; A63-F77 HydrophobicContact CB-CG 4.38Å; A63-S78 VanDerWaalsContact CB-O 3.22Å; A63-S78 WeakPolarHBondContact CB-O 3.3Å; A63-G80 PolarHBondContact O-N 3.42Å; A63-D81 HydrophobicContact CB-CB 4.37Å; A63-D81 PolarHBondContact N-O 3.03Å; A63-Y109 WeakPolarHBondContact CA-O 3.45Å
64	I	87.6	Confident	67.2	Low	62 Å²	62	70.9 Å²	70.9	32%	0.318	43%	0.428	S	S	.	.	S	Bend	trans	-91.6	-9.5	178.3	57.1	164.4	0	0	0	113.3	V62 K79 Y109 Q111	V62-I64 PolarHBondContact O-N 2.72Å; I64-K79 WeakPolarHBondContact O-CD 3.49Å; I64-K79 VanDerWaalsContact O-CE 3.24Å; I64-K79 WeakPolarHBondContact O-CE 3.48Å; I64-Y109 VanDerWaalsContact CG1-C 3.5Å; I64-Y109 VanDerWaalsContact CG1-O 3.28Å; I64-Y109 WeakPolarHBondContact CG1-O 3.33Å; I64-Y109 PolarHBondContact N-O 2.88Å; I64-Q111 HydrophobicContact CG2-CB 3.81Å
65	K	83.9	Confident	69.9	Low	100 Å²	100	66 Å²	66	44%	0.435	39%	0.394	S	S	.	.	S	Bend	trans	-145.3	152.8	177.3	-67.9	172	-174.7	161.3	0	109.7	F77 Y109	K65-F77 WeakPolarHBondContact O-CE2 3.45Å; K65-Y109 HydrophobicContact CB-CD2 3.59Å; K65-Y109 HydrophobicContact CB-CE2 3.94Å; K65-Y109 HydrophobicContact CB-CG 4.31Å; K65-Y109 HydrophobicContact CD-CD1 4.47Å; K65-Y109 HydrophobicContact CD-CD2 3.99Å; K65-Y109 HydrophobicContact CD-CE1 4.4Å; K65-Y109 HydrophobicContact CD-CE2 3.9Å; K65-Y109 HydrophobicContact CD-CG 4.27Å; K65-Y109 HydrophobicContact CG-CD2 4.43Å
66	D	85.1	Confident	72.1	Confident	91 Å²	91	63.6 Å²	63.6	49%	0.487	38%	0.376	S	S	.	.			trans	-68.4	143.5	167.7	-54.9	-80.7	0	0	0	111	S78 K79	D66-S78 WeakPolarHBondContact OD1-CA 3.43Å; D66-S78 VanDerWaalsContact OD1-CB 3.25Å; D66-S78 WeakPolarHBondContact OD1-CB 3.13Å; D66-S78 PolarHBondContact OD1-OG 2.81Å; D66-K79 PolarHBondContact OD1-N 2.74Å
67	Y	80.4	Confident	74.6	Confident	28 Å²	28	60.6 Å²	60.6	11%	0.11	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-135.6	109.7	175	-179	-93.2	0	0	0	110.9	P69 T74 L75 F77 W93 P106 Y109	Y67-P69 HydrophobicContact CE1-CB 3.93Å; Y67-T74 WeakPolarHBondContact OH-CB 3.29Å; Y67-T74 PolarHBondContact OH-OG1 3.2Å; Y67-L75 VanDerWaalsContact CD1-O 3.26Å; Y67-L75 WeakPolarHBondContact CD1-O 3.44Å; Y67-F77 VanDerWaalsContact CB-CZ 3.4Å; Y67-F77 HydrophobicContact CD1-CD1 4.33Å; Y67-F77 AromaticContact CD1-CE1 3.89Å; Y67-F77 HydrophobicContact CD1-CE1 3.89Å; Y67-F77 HydrophobicContact CD1-CZ 4.45Å; Y67-F77 AromaticContact CG-CE1 3.94Å; Y67-F77 HydrophobicContact CG-CE1 3.94Å; Y67-F77 HydrophobicContact CG-CZ 4.04Å; Y67-F77 PolarHBondContact N-O 2.73Å; Y67-F77 PolarHBondContact O-N 2.91Å; Y67-W93 HydrophobicContact CE2-CH2 4.19Å; Y67-P106 HydrophobicContact CD2-CG 3.82Å; Y67-P106 HydrophobicContact CE2-CG 3.85Å; Y67-P106 HydrophobicContact CG-CG 4.44Å; Y67-Y109 HydrophobicContact CD2-CD2 4.3Å; Y67-Y109 HydrophobicContact CD2-CE2 4.28Å
68	C	75.9	Confident	76.6	Confident	101 Å²	101	58.5 Å²	58.5	68%	0.682	32%	0.323	S	S	*	.			trans	-93.1	117.8	170.9	-72.7	0	0	0	0	109.4
69	P	71.2	Confident	78.2	Confident	52 Å²	52	63 Å²	63	34%	0.338	33%	0.334	S	S	.	.			trans	-72.6	136.7	-174.9	28.6	-35.1	0	0	0	112.2	Y67 T74 K76	Y67-P69 HydrophobicContact CE1-CB 3.93Å; P69-T74 WeakPolarHBondContact CB-O 3.24Å; P69-T74 VanDerWaalsContact CB-OG1 3.25Å; P69-T74 WeakPolarHBondContact CB-OG1 3.5Å; P69-K76 HydrophobicContact CG-CB 3.93Å
70	S	53.9	Low	78.7	Confident	122 Å²	122	61 Å²	61	85%	0.853	34%	0.337	S	S	*	.	S	Bend	trans	-96.5	-2.4	168.2	56.7	0	0	0	0	113.1
71	S	53.6	Low	78.8	Confident	30 Å²	30	62.7 Å²	62.7	21%	0.21	35%	0.347	C	S	.	.	S	Bend	trans	-135.8	143.9	-179	178.6	0	0	0	0	110.3	T73 T74	S71-T73 PolarHBondContact O-N 2.94Å; S71-T73 PolarHBondContact OG-N 3.2Å; S71-T73 PolarHBondContact OG-OG1 3.28Å; S71-T74 PolarHBondContact O-N 2.91Å; S71-T74 PolarHBondContact O-OG1 2.84Å
72	F	51	Low	79	Confident	190 Å²	190	69 Å²	69	83%	0.833	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-6.2	174.7	71	-87.3	0	0	0	113.9
73	T	73.7	Confident	78.9	Confident	34 Å²	34	66.9 Å²	66.9	21%	0.209	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-14.9	176.9	54.6	0	0	0	0	113.4	S71 Y104 W508	S71-T73 PolarHBondContact O-N 2.94Å; S71-T73 PolarHBondContact OG-N 3.2Å; S71-T73 PolarHBondContact OG-OG1 3.28Å; T73-Y104 WeakPolarHBondContact O-CD2 2.77Å; T73-Y104 PolarHBondContact O-N 2.92Å; T73-W508 HydrophobicContact CG2-CZ2 3.98Å; T73-W508 VanDerWaalsContact OG1-CH2 3.29Å; T73-W508 WeakPolarHBondContact OG1-CH2 3.43Å; T73-W508 VanDerWaalsContact OG1-CZ2 3.24Å; T73-W508 WeakPolarHBondContact OG1-CZ2 3.41Å
74	T	82.6	Confident	78.9	Confident	15 Å²	15	70.5 Å²	70.5	9%	0.092	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-107.9	138.3	-175.9	57.8	0	0	0	0	111.8	Y67 P69 S71 W93 Y104	Y67-T74 WeakPolarHBondContact OH-CB 3.29Å; Y67-T74 PolarHBondContact OH-OG1 3.2Å; P69-T74 WeakPolarHBondContact CB-O 3.24Å; P69-T74 VanDerWaalsContact CB-OG1 3.25Å; P69-T74 WeakPolarHBondContact CB-OG1 3.5Å; S71-T74 PolarHBondContact O-N 2.91Å; S71-T74 PolarHBondContact O-OG1 2.84Å; T74-W93 HydrophobicContact CG2-CE3 4.06Å; T74-W93 HydrophobicContact CG2-CH2 4.11Å; T74-W93 HydrophobicContact CG2-CZ3 3.44Å; T74-W93 VanDerWaalsContact CG2-CZ3 3.44Å; T74-Y104 CarbonylContact C-O 3.59Å; T74-Y104 WeakPolarHBondContact CA-O 3.46Å; T74-Y104 VanDerWaalsContact CB-O 3.28Å; T74-Y104 WeakPolarHBondContact CB-O 3.5Å
75	L	84.6	Confident	78.8	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	36%	0.359	C	S	.	.			trans	-76.8	137.3	-174.5	-174.7	67.5	0	0	0	110.3	Y67 F77 L83 N98 E101 Y104 I105	Y67-L75 VanDerWaalsContact CD1-O 3.26Å; Y67-L75 WeakPolarHBondContact CD1-O 3.44Å; L75-F77 WeakPolarHBondContact O-CD1 3.45Å; L75-L83 HydrophobicContact CD2-CD2 3.92Å; L75-N98 HydrophobicContact CD2-CB 4.36Å; L75-E101 HydrophobicContact CD1-CB 3.5Å; L75-E101 WeakPolarHBondContact CD1-O 3.28Å; L75-Y104 PolarHBondContact N-O 2.97Å; L75-I105 HydrophobicContact CB-CG2 3.79Å; L75-I105 HydrophobicContact CD2-CG2 4.07Å; L75-I105 HydrophobicContact CG-CG2 4.5Å
76	K	84.9	Confident	78.7	Confident	123 Å²	123	67.3 Å²	67.3	54%	0.535	36%	0.36	S	S	.	.			trans	-80.5	132.6	169.6	-171.5	-175.1	175	-167.6	0	110.1	P69	P69-K76 HydrophobicContact CG-CB 3.93Å
77	F	86.2	Confident	78.3	Confident	5 Å²	5	66.4 Å²	66.4	2%	0.022	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-151.6	153.4	172.8	59.9	-94.7	0	0	0	111.3	A63 K65 Y67 L75 D81 L83 I105 V110	A63-F77 HydrophobicContact CB-CD2 3.36Å; A63-F77 HydrophobicContact CB-CE2 3.67Å; A63-F77 HydrophobicContact CB-CG 4.38Å; K65-F77 WeakPolarHBondContact O-CE2 3.45Å; Y67-F77 VanDerWaalsContact CB-CZ 3.4Å; Y67-F77 HydrophobicContact CD1-CD1 4.33Å; Y67-F77 AromaticContact CD1-CE1 3.89Å; Y67-F77 HydrophobicContact CD1-CE1 3.89Å; Y67-F77 HydrophobicContact CD1-CZ 4.45Å; Y67-F77 AromaticContact CG-CE1 3.94Å; Y67-F77 HydrophobicContact CG-CE1 3.94Å; Y67-F77 HydrophobicContact CG-CZ 4.04Å; Y67-F77 PolarHBondContact N-O 2.73Å; Y67-F77 PolarHBondContact O-N 2.91Å; L75-F77 WeakPolarHBondContact O-CD1 3.45Å; F77-D81 WeakPolarHBondContact CA-OD2 3.4Å; F77-D81 HydrophobicContact CB-CB 4.27Å; F77-L83 HydrophobicContact CB-CD1 4.04Å; F77-L83 HydrophobicContact CB-CD2 4.24Å; F77-L83 HydrophobicContact CD1-CD1 3.84Å; F77-L83 HydrophobicContact CD2-CD1 4.24Å; F77-L83 HydrophobicContact CE1-CD1 4.31Å; F77-L83 HydrophobicContact CG-CD1 3.79Å; F77-I105 HydrophobicContact CD1-CG2 3.87Å; F77-I105 HydrophobicContact CE1-CB 3.85Å; F77-I105 HydrophobicContact CE1-CG2 3.53Å; F77-I105 HydrophobicContact CZ-CB 4.48Å; F77-V110 HydrophobicContact CZ-CG1 4.46Å
78	S	87.4	Confident	78.1	Confident	56 Å²	56	68.5 Å²	68.5	39%	0.392	37%	0.371	S	S	.	.			trans	-105.8	160.5	174.1	-106.8	0	0	0	0	111.8	A63 D66 G80 D81	A63-S78 VanDerWaalsContact CB-O 3.22Å; A63-S78 WeakPolarHBondContact CB-O 3.3Å; D66-S78 WeakPolarHBondContact OD1-CA 3.43Å; D66-S78 VanDerWaalsContact OD1-CB 3.25Å; D66-S78 WeakPolarHBondContact OD1-CB 3.13Å; D66-S78 PolarHBondContact OD1-OG 2.81Å; S78-G80 PolarHBondContact O-N 2.92Å; S78-D81 PolarHBondContact N-OD2 3.26Å; S78-D81 WeakPolarHBondContact O-CB 3.43Å; S78-D81 PolarHBondContact O-N 3.45Å
79	K	85	Confident	77.9	Confident	144 Å²	144	68.3 Å²	68.3	63%	0.626	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	121.6	178.2	-178.8	176.5	179.7	-178.2	0	110.6	I64 D66	I64-K79 WeakPolarHBondContact O-CD 3.49Å; I64-K79 VanDerWaalsContact O-CE 3.24Å; I64-K79 WeakPolarHBondContact O-CE 3.48Å; D66-K79 PolarHBondContact OD1-N 2.74Å
80	G	80.8	Confident	77.3	Confident	48 Å²	48	68 Å²	68	50%	0.495	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	105.7	-13.5	-175.1	0	0	0	0	0	114.4	A63 S78	A63-G80 PolarHBondContact O-N 3.42Å; S78-G80 PolarHBondContact O-N 2.92Å
81	D	85.8	Confident	78.2	Confident	67 Å²	67	64.4 Å²	64.4	36%	0.358	36%	0.359	S	S	.	.			trans	-63.6	138.8	177.3	-73	-10.6	0	0	0	111.5	V62 A63 F77 S78	V62-D81 CarbonylContact C-O 3.5Å; V62-D81 WeakPolarHBondContact CA-O 3.42Å; A63-D81 HydrophobicContact CB-CB 4.37Å; A63-D81 PolarHBondContact N-O 3.03Å; F77-D81 WeakPolarHBondContact CA-OD2 3.4Å; F77-D81 HydrophobicContact CB-CB 4.27Å; S78-D81 PolarHBondContact N-OD2 3.26Å; S78-D81 WeakPolarHBondContact O-CB 3.43Å; S78-D81 PolarHBondContact O-N 3.45Å
82	R	87.4	Confident	79.3	Confident	132 Å²	132	70.5 Å²	70.5	50%	0.498	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	127.2	171.4	-71.7	165.4	173.6	-106.2	3.6	109.5	E60 V62	E60-R82 VanDerWaalsContact CD-NH1 3.34Å; E60-R82 WeakPolarHBondContact OE1-CB 3.33Å; E60-R82 WeakPolarHBondContact OE1-CD 3.4Å; E60-R82 VanDerWaalsContact OE1-CG 3.26Å; E60-R82 WeakPolarHBondContact OE1-CG 3.41Å; E60-R82 IonicContact OE1-CZ 3.53Å; E60-R82 IonicContact OE1-NE 2.69Å; E60-R82 IonicContact OE1-NH1 3.87Å; E60-R82 PolarHBondContact OE1-NH1 3.08Å; E60-R82 IonicContact OE2-NH1 3.84Å; E60-R82 PolarHBondContact OE2-NH1 3.24Å; V62-R82 HydrophobicContact CG2-CG 3.82Å
83	L	87.2	Confident	80.8	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145.9	-177.3	-54.6	175.7	0	0	0	109.2	V61 L75 F77 H97 N98 I105 V110	V61-L83 HydrophobicContact CG2-CB 3.95Å; V61-L83 PolarHBondContact N-O 3.05Å; V61-L83 PolarHBondContact O-N 3.13Å; L75-L83 HydrophobicContact CD2-CD2 3.92Å; F77-L83 HydrophobicContact CB-CD1 4.04Å; F77-L83 HydrophobicContact CB-CD2 4.24Å; F77-L83 HydrophobicContact CD1-CD1 3.84Å; F77-L83 HydrophobicContact CD2-CD1 4.24Å; F77-L83 HydrophobicContact CE1-CD1 4.31Å; F77-L83 HydrophobicContact CG-CD1 3.79Å; L83-H97 WeakPolarHBondContact CA-O 3.31Å; L83-N98 HydrophobicContact CD2-CB 3.66Å; L83-I105 HydrophobicContact CD1-CD1 4.17Å; L83-I105 HydrophobicContact CD1-CG2 4.27Å; L83-V110 HydrophobicContact CD1-CG1 4.01Å
84	Y	88.4	Confident	81.4	Confident	76 Å²	76	66.8 Å²	66.8	30%	0.298	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	116.5	179.3	-61.7	-82	0	0	0	109.6	E60 A96 H97	E60-Y84 HydrophobicContact CB-CD1 4.14Å; E60-Y84 HydrophobicContact CB-CE1 4.04Å; E60-Y84 HydrophobicContact CG-CD1 4.26Å; E60-Y84 HydrophobicContact CG-CE1 3.91Å; Y84-A96 CarbonylContact O-C 3.6Å; Y84-A96 WeakPolarHBondContact O-CA 3.24Å; Y84-A96 WeakPolarHBondContact O-CB 3.36Å; Y84-H97 WeakPolarHBondContact CB-NE2 3.16Å; Y84-H97 AromaticContact CD2-CE1 3.76Å; Y84-H97 PolarHBondContact N-O 2.92Å; Y84-H97 PolarHBondContact O-N 2.74Å
85	V	85.8	Confident	81.4	Confident	6 Å²	6	69.4 Å²	69.4	4%	0.036	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	126.5	-179.6	-176.8	0	0	0	0	110	A58 Q59 V61 T88 W94 A96 I105	A58-V85 VanDerWaalsContact CA-O 3.31Å; A58-V85 WeakPolarHBondContact CA-O 3.43Å; Q59-V85 HydrophobicContact CB-CB 4.39Å; Q59-V85 PolarHBondContact N-O 2.91Å; Q59-V85 PolarHBondContact O-N 2.78Å; V61-V85 HydrophobicContact CB-CG2 4.43Å; V61-V85 HydrophobicContact CG1-CG2 3.71Å; V61-V85 HydrophobicContact CG2-CG2 3.76Å; V85-T88 HydrophobicContact CG1-CG2 3.67Å; V85-W94 HydrophobicContact CG1-CB 3.92Å; V85-W94 HydrophobicContact CG1-CE3 4.39Å; V85-W94 HydrophobicContact CG1-CG 4.41Å; V85-W94 HydrophobicContact CG2-CE3 3.93Å; V85-A96 HydrophobicContact CG2-CB 4.3Å; V85-I105 HydrophobicContact CG2-CD1 4.39Å
86	L	82.4	Confident	81.5	Confident	90 Å²	90	69.2 Å²	69.2	47%	0.471	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-31.2	179.4	-62.1	175.6	0	0	0	112.5	A58 Y95	A58-L86 HydrophobicContact CB-CD2 4.4Å; L86-Y95 HydrophobicContact CB-CD1 4.31Å; L86-Y95 HydrophobicContact CD1-CD1 4.15Å; L86-Y95 HydrophobicContact CD1-CE1 4.19Å; L86-Y95 PolarHBondContact N-O 2.89Å
87	D	76.3	Confident	81.5	Confident	71 Å²	71	65.9 Å²	65.9	38%	0.38	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	130.4	176.6	-175.1	15	0	0	0	111.7	S89 W94 Y95	D87-S89 VanDerWaalsContact CG-OG 3.24Å; D87-S89 WeakPolarHBondContact OD1-CB 3.41Å; D87-S89 PolarHBondContact OD1-N 2.99Å; D87-S89 PolarHBondContact OD1-OG 3.18Å; D87-S89 PolarHBondContact OD2-OG 2.98Å; D87-W94 CarbonylContact O-C 3.49Å; D87-W94 WeakPolarHBondContact O-CA 3.35Å; D87-Y95 PolarHBondContact N-O 2.97Å; D87-Y95 PolarHBondContact O-N 3.04Å
88	T	76.3	Confident	81.3	Confident	72 Å²	72	66.9 Å²	66.9	44%	0.442	36%	0.361	S	S	.	.			trans	-104.2	1.2	176.3	55.2	0	0	0	0	113.3	V85 G90 G91 W94	V85-T88 HydrophobicContact CG1-CG2 3.67Å; T88-G90 PolarHBondContact O-N 3.31Å; T88-G90 VanDerWaalsContact O-N 3.12Å; T88-G91 PolarHBondContact O-N 3.23Å; T88-G91 VanDerWaalsContact O-N 3.13Å; T88-W94 HydrophobicContact CG2-CD2 4Å; T88-W94 HydrophobicContact CG2-CG 4.07Å
89	S	70.8	Confident	80.6	Confident	97 Å²	97	71.1 Å²	71.1	68%	0.678	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.5	-174.9	72.4	0	0	0	0	114.5	D87 G91	D87-S89 VanDerWaalsContact CG-OG 3.24Å; D87-S89 WeakPolarHBondContact OD1-CB 3.41Å; D87-S89 PolarHBondContact OD1-N 2.99Å; D87-S89 PolarHBondContact OD1-OG 3.18Å; D87-S89 PolarHBondContact OD2-OG 2.98Å; S89-G91 PolarHBondContact O-N 2.9Å
90	G	59.1	Low	79.9	Confident	45 Å²	45	70.2 Å²	70.2	46%	0.464	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	2.3	177.7	0	0	0	0	0	115.8	T88 E92 W93	T88-G90 PolarHBondContact O-N 3.31Å; T88-G90 VanDerWaalsContact O-N 3.12Å; G90-E92 PolarHBondContact O-N 3.25Å; G90-W93 CarbonylContact C-O 3.55Å; G90-W93 WeakPolarHBondContact CA-O 3.34Å; G90-W93 PolarHBondContact O-N 2.86Å
91	G	72.6	Confident	79.8	Confident	47 Å²	47	73 Å²	73	49%	0.485	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-88.9	170.2	0	0	0	0	0	113.8	T88 S89 W93 W94	T88-G91 PolarHBondContact O-N 3.23Å; T88-G91 VanDerWaalsContact O-N 3.13Å; S89-G91 PolarHBondContact O-N 2.9Å; G91-W93 VanDerWaalsContact C-N 3.32Å; G91-W94 PolarHBondContact O-NE1 2.86Å
92	E	77.3	Confident	79.6	Confident	159 Å²	159	75.8 Å²	75.8	74%	0.743	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-19.9	175.5	-64.5	-169.6	156.5	0	0	113.1	G90 A107	G90-E92 PolarHBondContact O-N 3.25Å; E92-A107 WeakPolarHBondContact O-CB 3.46Å; E92-A107 PolarHBondContact O-N 2.86Å
93	W	82.9	Confident	79.5	Confident	95 Å²	95	69.7 Å²	69.7	36%	0.36	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	127.7	177	-67.7	80.8	0	0	0	110.1	Y67 T74 G90 G91 Y104 I105 P106	Y67-W93 HydrophobicContact CE2-CH2 4.19Å; T74-W93 HydrophobicContact CG2-CE3 4.06Å; T74-W93 HydrophobicContact CG2-CH2 4.11Å; T74-W93 HydrophobicContact CG2-CZ3 3.44Å; T74-W93 VanDerWaalsContact CG2-CZ3 3.44Å; G90-W93 CarbonylContact C-O 3.55Å; G90-W93 WeakPolarHBondContact CA-O 3.34Å; G90-W93 PolarHBondContact O-N 2.86Å; G91-W93 VanDerWaalsContact C-N 3.32Å; W93-Y104 HydrophobicContact CB-CD1 4.5Å; W93-I105 CarbonylContact C-O 3.58Å; W93-I105 WeakPolarHBondContact CA-O 3.31Å; W93-I105 VanDerWaalsContact CE3-C 3.49Å; W93-P106 HydrophobicContact CE3-CB 4.39Å; W93-P106 HydrophobicContact CE3-CG 4.24Å; W93-P106 HydrophobicContact CH2-CB 4.31Å; W93-P106 HydrophobicContact CH2-CG 3.77Å; W93-P106 HydrophobicContact CZ2-CB 4.49Å; W93-P106 HydrophobicContact CZ2-CG 4.39Å; W93-P106 HydrophobicContact CZ3-CB 4.25Å; W93-P106 HydrophobicContact CZ3-CG 3.67Å
94	W	84.8	Confident	79.4	Confident	50 Å²	50	74.6 Å²	74.6	19%	0.189	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147.4	178.6	-59	-17.3	0	0	0	109.8	V61 V85 D87 T88 G91 Y104 I105 A107 V110	V61-W94 HydrophobicContact CG1-CZ3 4.34Å; V85-W94 HydrophobicContact CG1-CB 3.92Å; V85-W94 HydrophobicContact CG1-CE3 4.39Å; V85-W94 HydrophobicContact CG1-CG 4.41Å; V85-W94 HydrophobicContact CG2-CE3 3.93Å; D87-W94 CarbonylContact O-C 3.49Å; D87-W94 WeakPolarHBondContact O-CA 3.35Å; T88-W94 HydrophobicContact CG2-CD2 4Å; T88-W94 HydrophobicContact CG2-CG 4.07Å; G91-W94 PolarHBondContact O-NE1 2.86Å; W94-Y104 CarbonylContact O-C 3.48Å; W94-Y104 WeakPolarHBondContact O-CA 3.5Å; W94-I105 HydrophobicContact CB-CG1 4.19Å; W94-I105 PolarHBondContact N-O 3.31Å; W94-I105 WeakPolarHBondContact O-CG1 3.28Å; W94-I105 PolarHBondContact O-N 2.97Å; W94-A107 HydrophobicContact CD2-CB 3.81Å; W94-A107 VanDerWaalsContact CE2-CB 3.44Å; W94-A107 HydrophobicContact CE3-CB 4.31Å; W94-A107 HydrophobicContact CG-CB 4.27Å; W94-A107 HydrophobicContact CH2-CB 4.22Å; W94-A107 HydrophobicContact CZ2-CB 3.68Å; W94-A107 HydrophobicContact CZ3-CB 4.5Å; W94-V110 HydrophobicContact CE3-CG2 3.96Å; W94-V110 HydrophobicContact CZ3-CG2 3.84Å
95	Y	83.4	Confident	79.4	Confident	70 Å²	70	71 Å²	71	28%	0.275	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	122.7	172.7	-165	-110.5	0	0	0	109.3	L86 D87 M102 Y104	L86-Y95 HydrophobicContact CB-CD1 4.31Å; L86-Y95 HydrophobicContact CD1-CD1 4.15Å; L86-Y95 HydrophobicContact CD1-CE1 4.19Å; L86-Y95 PolarHBondContact N-O 2.89Å; D87-Y95 PolarHBondContact N-O 2.97Å; D87-Y95 PolarHBondContact O-N 3.04Å; Y95-M102 HydrophobicContact CE1-CB 4.47Å; Y95-M102 WeakPolarHBondContact OH-CB 3.4Å; Y95-Y104 HydrophobicContact CD2-CD1 4.04Å; Y95-Y104 AromaticContact CD2-CD2 3.81Å; Y95-Y104 HydrophobicContact CD2-CD2 3.81Å; Y95-Y104 AromaticContact CD2-CE1 3.93Å; Y95-Y104 HydrophobicContact CD2-CE1 3.93Å; Y95-Y104 AromaticContact CD2-CE2 3.69Å; Y95-Y104 HydrophobicContact CD2-CE2 3.69Å; Y95-Y104 AromaticContact CD2-CG 3.99Å; Y95-Y104 HydrophobicContact CD2-CG 3.99Å; Y95-Y104 AromaticContact CD2-CZ 3.75Å; Y95-Y104 HydrophobicContact CE2-CD2 4.22Å; Y95-Y104 HydrophobicContact CE2-CE2 4.08Å; Y95-Y104 HydrophobicContact CG-CE1 4.36Å
96	A	86.3	Confident	79.4	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	168	-173.4	0	0	0	0	0	112	Y84 V85 M102 G103 I105	Y84-A96 CarbonylContact O-C 3.6Å; Y84-A96 WeakPolarHBondContact O-CA 3.24Å; Y84-A96 WeakPolarHBondContact O-CB 3.36Å; V85-A96 HydrophobicContact CG2-CB 4.3Å; A96-M102 WeakPolarHBondContact O-CA 3.39Å; A96-G103 PolarHBondContact N-O 3.27Å; A96-G103 PolarHBondContact O-N 3.16Å; A96-I105 HydrophobicContact CB-CD1 3.52Å; A96-I105 HydrophobicContact CB-CG1 3.79Å; A96-I105 HydrophobicContact CB-CG2 4.31Å
97	H	84.4	Confident	79.5	Confident	53 Å²	53	67.8 Å²	67.8	25%	0.245	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152.3	171	72.9	94.6	0	0	0	112.6	L83 Y84 E101 M102	L83-H97 WeakPolarHBondContact CA-O 3.31Å; Y84-H97 WeakPolarHBondContact CB-NE2 3.16Å; Y84-H97 AromaticContact CD2-CE1 3.76Å; Y84-H97 PolarHBondContact N-O 2.92Å; Y84-H97 PolarHBondContact O-N 2.74Å; H97-E101 VanDerWaalsContact CA-O 3.3Å; H97-E101 WeakPolarHBondContact CA-O 3.33Å; H97-E101 WeakPolarHBondContact CB-O 3.47Å; H97-M102 HydrophobicContact CB-CB 4.1Å; H97-M102 HydrophobicContact CB-CG 3.64Å; H97-M102 HydrophobicContact CB-SD 4.35Å
98	N	82.8	Confident	79.9	Confident	26 Å²	26	67.9 Å²	67.9	14%	0.139	38%	0.379	C	S	.	.			trans	-96.8	-164.8	159.3	68.1	29.8	0	0	0	108.6	L75 L83 T100 E101	L75-N98 HydrophobicContact CD2-CB 4.36Å; L83-N98 HydrophobicContact CD2-CB 3.66Å; N98-T100 PolarHBondContact O-N 2.82Å; N98-T100 PolarHBondContact OD1-N 3.11Å; N98-T100 PolarHBondContact OD1-OG1 2.79Å; N98-E101 PolarHBondContact N-O 3.12Å; N98-E101 PolarHBondContact OD1-N 3.46Å; N98-E101 PolarHBondContact OD1-O 2.8Å
99	N	71.8	Confident	80.3	Confident	145 Å²	145	68.2 Å²	68.2	78%	0.775	37%	0.372	S	S	*	.	S	Bend	trans	-73.8	-4.8	-177.9	-64.9	-22.3	0	0	0	114.5
100	T	70.9	Confident	81	Confident	125 Å²	125	64.1 Å²	64.1	77%	0.767	34%	0.343	S	S	*	.	S	Bend	trans	-138.4	-23.7	-172.2	47.1	0	0	0	0	115.1	N98	N98-T100 PolarHBondContact O-N 2.82Å; N98-T100 PolarHBondContact OD1-N 3.11Å; N98-T100 PolarHBondContact OD1-OG1 2.79Å
101	E	78.4	Confident	82.2	Confident	107 Å²	107	67.9 Å²	67.9	50%	0.5	35%	0.349	S	S	.	.			trans	-140.4	152.9	-170.4	-64.9	-177.7	169.1	0	0	111.4	L75 H97 N98	L75-E101 HydrophobicContact CD1-CB 3.5Å; L75-E101 WeakPolarHBondContact CD1-O 3.28Å; H97-E101 VanDerWaalsContact CA-O 3.3Å; H97-E101 WeakPolarHBondContact CA-O 3.33Å; H97-E101 WeakPolarHBondContact CB-O 3.47Å; N98-E101 PolarHBondContact N-O 3.12Å; N98-E101 PolarHBondContact OD1-N 3.46Å; N98-E101 PolarHBondContact OD1-O 2.8Å
102	M	82.7	Confident	82.6	Confident	126 Å²	126	68.2 Å²	68.2	62%	0.621	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.7	179.4	-46.8	-164.3	-74.6	0	0	110.6	Y95 A96 H97	Y95-M102 HydrophobicContact CE1-CB 4.47Å; Y95-M102 WeakPolarHBondContact OH-CB 3.4Å; A96-M102 WeakPolarHBondContact O-CA 3.39Å; H97-M102 HydrophobicContact CB-CB 4.1Å; H97-M102 HydrophobicContact CB-CG 3.64Å; H97-M102 HydrophobicContact CB-SD 4.35Å
103	G	85.3	Confident	82.5	Confident	3 Å²	3	62.8 Å²	62.8	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.2	173.6	-176.7	0	0	0	0	0	113.8	A96	A96-G103 PolarHBondContact N-O 3.27Å; A96-G103 PolarHBondContact O-N 3.16Å
104	Y	85.3	Confident	80.7	Confident	103 Å²	103	65.1 Å²	65.1	40%	0.404	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	140.1	175.5	-71.3	-84.4	0	0	0	111.6	T73 T74 L75 W93 W94 Y95	T73-Y104 WeakPolarHBondContact O-CD2 2.77Å; T73-Y104 PolarHBondContact O-N 2.92Å; T74-Y104 CarbonylContact C-O 3.59Å; T74-Y104 WeakPolarHBondContact CA-O 3.46Å; T74-Y104 VanDerWaalsContact CB-O 3.28Å; T74-Y104 WeakPolarHBondContact CB-O 3.5Å; L75-Y104 PolarHBondContact N-O 2.97Å; W93-Y104 HydrophobicContact CB-CD1 4.5Å; W94-Y104 CarbonylContact O-C 3.48Å; W94-Y104 WeakPolarHBondContact O-CA 3.5Å; Y95-Y104 HydrophobicContact CD2-CD1 4.04Å; Y95-Y104 AromaticContact CD2-CD2 3.81Å; Y95-Y104 HydrophobicContact CD2-CD2 3.81Å; Y95-Y104 AromaticContact CD2-CE1 3.93Å; Y95-Y104 HydrophobicContact CD2-CE1 3.93Å; Y95-Y104 AromaticContact CD2-CE2 3.69Å; Y95-Y104 HydrophobicContact CD2-CE2 3.69Å; Y95-Y104 AromaticContact CD2-CG 3.99Å; Y95-Y104 HydrophobicContact CD2-CG 3.99Å; Y95-Y104 AromaticContact CD2-CZ 3.75Å; Y95-Y104 HydrophobicContact CE2-CD2 4.22Å; Y95-Y104 HydrophobicContact CE2-CE2 4.08Å; Y95-Y104 HydrophobicContact CG-CE1 4.36Å
105	I	87.1	Confident	78.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145	177.3	58.5	165.6	0	0	0	110.1	V61 L75 F77 L83 V85 W93 W94 A96 A107 V110	V61-I105 HydrophobicContact CG2-CD1 4.32Å; L75-I105 HydrophobicContact CB-CG2 3.79Å; L75-I105 HydrophobicContact CD2-CG2 4.07Å; L75-I105 HydrophobicContact CG-CG2 4.5Å; F77-I105 HydrophobicContact CD1-CG2 3.87Å; F77-I105 HydrophobicContact CE1-CB 3.85Å; F77-I105 HydrophobicContact CE1-CG2 3.53Å; F77-I105 HydrophobicContact CZ-CB 4.48Å; L83-I105 HydrophobicContact CD1-CD1 4.17Å; L83-I105 HydrophobicContact CD1-CG2 4.27Å; V85-I105 HydrophobicContact CG2-CD1 4.39Å; W93-I105 CarbonylContact C-O 3.58Å; W93-I105 WeakPolarHBondContact CA-O 3.31Å; W93-I105 VanDerWaalsContact CE3-C 3.49Å; W94-I105 HydrophobicContact CB-CG1 4.19Å; W94-I105 PolarHBondContact N-O 3.31Å; W94-I105 WeakPolarHBondContact O-CG1 3.28Å; W94-I105 PolarHBondContact O-N 2.97Å; A96-I105 HydrophobicContact CB-CD1 3.52Å; A96-I105 HydrophobicContact CB-CG1 3.79Å; A96-I105 HydrophobicContact CB-CG2 4.31Å; I105-A107 PolarHBondContact O-N 2.8Å; I105-V110 HydrophobicContact CD1-CG1 3.85Å; I105-V110 HydrophobicContact CD1-CG2 3.99Å
106	P	87.5	Confident	76	Confident	11 Å²	11	77.2 Å²	77.2	7%	0.071	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	126.1	172.7	-2.8	16.6	0	0	0	109.6	Y67 W93 A108 Y109	Y67-P106 HydrophobicContact CD2-CG 3.82Å; Y67-P106 HydrophobicContact CE2-CG 3.85Å; Y67-P106 HydrophobicContact CG-CG 4.44Å; W93-P106 HydrophobicContact CE3-CB 4.39Å; W93-P106 HydrophobicContact CE3-CG 4.24Å; W93-P106 HydrophobicContact CH2-CB 4.31Å; W93-P106 HydrophobicContact CH2-CG 3.77Å; W93-P106 HydrophobicContact CZ2-CB 4.49Å; W93-P106 HydrophobicContact CZ2-CG 4.39Å; W93-P106 HydrophobicContact CZ3-CB 4.25Å; W93-P106 HydrophobicContact CZ3-CG 3.67Å; P106-A108 PolarHBondContact O-N 2.88Å; P106-Y109 HydrophobicContact CB-CD1 3.73Å; P106-Y109 HydrophobicContact CB-CE1 4.43Å; P106-Y109 HydrophobicContact CB-CG 4.15Å; P106-Y109 HydrophobicContact CG-CD1 3.95Å; P106-Y109 HydrophobicContact CG-CG 4Å; P106-Y109 WeakPolarHBondContact O-CB 3.39Å; P106-Y109 PolarHBondContact O-N 2.9Å
107	A	83.3	Confident	73.3	Confident	18 Å²	18	83.9 Å²	83.9	15%	0.149	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-55.9	-39.3	178.5	0	0	0	0	0	111.9	E92 W94 I105 Y109 V110	E92-A107 WeakPolarHBondContact O-CB 3.46Å; E92-A107 PolarHBondContact O-N 2.86Å; W94-A107 HydrophobicContact CD2-CB 3.81Å; W94-A107 VanDerWaalsContact CE2-CB 3.44Å; W94-A107 HydrophobicContact CE3-CB 4.31Å; W94-A107 HydrophobicContact CG-CB 4.27Å; W94-A107 HydrophobicContact CH2-CB 4.22Å; W94-A107 HydrophobicContact CZ2-CB 3.68Å; W94-A107 HydrophobicContact CZ3-CB 4.5Å; I105-A107 PolarHBondContact O-N 2.8Å; A107-Y109 PolarHBondContact O-N 2.82Å; A107-V110 WeakPolarHBondContact O-CG2 3.47Å; A107-V110 PolarHBondContact O-N 2.86Å
108	A	84.4	Confident	70.8	Confident	74 Å²	74	87.2 Å²	87.2	61%	0.612	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-71.2	5.1	177.8	0	0	0	0	0	115.3	P106	P106-A108 PolarHBondContact O-N 2.88Å
109	Y	85.2	Confident	68.3	Low	79 Å²	79	91.5 Å²	91.5	31%	0.31	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-113.3	-1	176.9	-80.1	58.4	0	0	0	112.6	A63 I64 K65 Y67 P106 A107	A63-Y109 WeakPolarHBondContact CA-O 3.45Å; I64-Y109 VanDerWaalsContact CG1-C 3.5Å; I64-Y109 VanDerWaalsContact CG1-O 3.28Å; I64-Y109 WeakPolarHBondContact CG1-O 3.33Å; I64-Y109 PolarHBondContact N-O 2.88Å; K65-Y109 HydrophobicContact CB-CD2 3.59Å; K65-Y109 HydrophobicContact CB-CE2 3.94Å; K65-Y109 HydrophobicContact CB-CG 4.31Å; K65-Y109 HydrophobicContact CD-CD1 4.47Å; K65-Y109 HydrophobicContact CD-CD2 3.99Å; K65-Y109 HydrophobicContact CD-CE1 4.4Å; K65-Y109 HydrophobicContact CD-CE2 3.9Å; K65-Y109 HydrophobicContact CD-CG 4.27Å; K65-Y109 HydrophobicContact CG-CD2 4.43Å; Y67-Y109 HydrophobicContact CD2-CD2 4.3Å; Y67-Y109 HydrophobicContact CD2-CE2 4.28Å; P106-Y109 HydrophobicContact CB-CD1 3.73Å; P106-Y109 HydrophobicContact CB-CE1 4.43Å; P106-Y109 HydrophobicContact CB-CG 4.15Å; P106-Y109 HydrophobicContact CG-CD1 3.95Å; P106-Y109 HydrophobicContact CG-CG 4Å; P106-Y109 WeakPolarHBondContact O-CB 3.39Å; P106-Y109 PolarHBondContact O-N 2.9Å; A107-Y109 PolarHBondContact O-N 2.82Å
110	V	85.8	Confident	66.7	Low	11 Å²	11	92.5 Å²	92.5	7%	0.067	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	160	179	-68.6	0	0	0	0	112.2	V61 V62 F77 L83 W94 I105 A107	V61-V110 HydrophobicContact CB-CB 3.98Å; V61-V110 HydrophobicContact CB-CG2 4.32Å; V61-V110 HydrophobicContact CG2-CB 3.67Å; V61-V110 HydrophobicContact CG2-CG1 3.86Å; V61-V110 HydrophobicContact CG2-CG2 3.95Å; V62-V110 CarbonylContact O-C 3.49Å; V62-V110 VanDerWaalsContact O-CA 3.32Å; V62-V110 WeakPolarHBondContact O-CA 3.1Å; F77-V110 HydrophobicContact CZ-CG1 4.46Å; L83-V110 HydrophobicContact CD1-CG1 4.01Å; W94-V110 HydrophobicContact CE3-CG2 3.96Å; W94-V110 HydrophobicContact CZ3-CG2 3.84Å; I105-V110 HydrophobicContact CD1-CG1 3.85Å; I105-V110 HydrophobicContact CD1-CG2 3.99Å; A107-V110 WeakPolarHBondContact O-CG2 3.47Å; A107-V110 PolarHBondContact O-N 2.86Å
111	Q	83.2	Confident	64.7	Low	124 Å²	124	92 Å²	92	58%	0.579	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.8	133.2	177.6	-170.4	173.2	5.2	0	0	110.4	V61 V62 I64	V61-Q111 CarbonylContact C-O 3.56Å; V61-Q111 WeakPolarHBondContact CA-O 3.46Å; V62-Q111 PolarHBondContact N-O 3.04Å; V62-Q111 PolarHBondContact O-N 2.86Å; I64-Q111 HydrophobicContact CG2-CB 3.81Å
112	P	81.3	Confident	62.4	Low	54 Å²	54	93.9 Å²	93.9	35%	0.351	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.4	-175.4	27.2	-35.1	0	0	0	113.6	Q59 V61 N114	Q59-P112 HydrophobicContact CG-CB 4.39Å; V61-P112 HydrophobicContact CG1-CB 4.32Å; P112-N114 PolarHBondContact O-N 2.81Å
113	V	74.9	Confident	60	Low	44 Å²	44	92.8 Å²	92.8	27%	0.267	51%	0.51	S	S	.	.			trans	-88.5	95.1	-178.5	-170.9	0	0	0	0	110.1	E60 V62 F115	E60-V113 HydrophobicContact CG-CG2 4.08Å; E60-V113 PolarHBondContact O-N 2.82Å; V62-V113 HydrophobicContact CB-CG2 4.3Å; V62-V113 HydrophobicContact CG2-CG2 3.6Å; V113-F115 HydrophobicContact CB-CD2 4.38Å; V113-F115 HydrophobicContact CB-CE2 4.36Å; V113-F115 HydrophobicContact CG1-CD2 3.71Å; V113-F115 HydrophobicContact CG1-CE2 3.5Å; V113-F115 VanDerWaalsContact CG1-CE2 3.5Å; V113-F115 HydrophobicContact CG1-CZ 4.29Å; V113-F115 PolarHBondContact O-N 3.21Å
114	N	47	Very low	57.4	Low	144 Å²	144	96.3 Å²	96.3	77%	0.77	55%	0.547	S	S	*	.			trans	-71.9	90.5	179	-75.1	-12.6	0	0	0	112.1	P112 R116	P112-N114 PolarHBondContact O-N 2.81Å; N114-R116 PolarHBondContact O-N 3.28Å; N114-R116 VanDerWaalsContact O-N 3.1Å
115	F	35.9	Very low	54.8	Low	151 Å²	151	99.3 Å²	99.3	66%	0.662	57%	0.566	S	S	*	*			trans	-78.7	83.9	173.4	-88.4	-79.4	0	0	0	113	E60 V113	E60-F115 WeakPolarHBondContact OE2-CE2 3.1Å; V113-F115 HydrophobicContact CB-CD2 4.38Å; V113-F115 HydrophobicContact CB-CE2 4.36Å; V113-F115 HydrophobicContact CG1-CD2 3.71Å; V113-F115 HydrophobicContact CG1-CE2 3.5Å; V113-F115 VanDerWaalsContact CG1-CE2 3.5Å; V113-F115 HydrophobicContact CG1-CZ 4.29Å; V113-F115 PolarHBondContact O-N 3.21Å
116	R	33	Very low	52	Low	224 Å²	224	105.4 Å²	105.4	85%	0.845	60%	0.598	S	S	*	*			trans	-175.2	133.1	151.3	-100.1	-171.1	-175.1	-176.2	-0.2	108.1	N114	N114-R116 PolarHBondContact O-N 3.28Å; N114-R116 VanDerWaalsContact O-N 3.1Å
117	N	28.7	Very low	49.2	Very low	139 Å²	139	111.1 Å²	111.1	74%	0.743	63%	0.628	S	S	*	*			cis	-133.2	161.5	3.6	-58	-67.4	0	0	0	110.5
118	S	32.3	Very low	46.5	Very low	124 Å²	124	114.8 Å²	114.8	87%	0.867	65%	0.652	S	S	*	*			trans	-95.4	124.1	162	45.1	0	0	0	0	110.8
119	S	30.6	Very low	43.8	Very low	115 Å²	115	119.6 Å²	119.6	80%	0.804	67%	0.666	S	S	*	*			trans	-147.7	156.6	168.8	54.5	0	0	0	0	110.5
120	L	37.2	Very low	41	Very low	166 Å²	166	118.8 Å²	118.8	87%	0.869	68%	0.682	S	S	*	*			trans	-83.8	-178.4	-169.9	-67.4	161.6	0	0	0	113.3
121	S	30.2	Very low	38.3	Very low	115 Å²	115	127.3 Å²	127.3	80%	0.804	72%	0.721	S	S	*	*			trans	78.8	121.9	-176.9	-52	0	0	0	0	113.5
122	D	28.9	Very low	35.5	Very low	146 Å²	146	125 Å²	125	78%	0.781	73%	0.731	S	S	*	*			cis	90.4	134	43.8	-170.3	18.9	0	0	0	113
123	S	34	Very low	33	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	75%	0.753	S	S	*	*			trans	61.2	87.6	164.3	-69.3	0	0	0	0	120.3
124	G	30.1	Very low	30.8	Very low	78 Å²	78	139.3 Å²	139.3	80%	0.804	78%	0.782	S	S	*	*				91.4	158	110.4	0	0	0	0	0	121.9
125	M	29.5	Very low	30.1	Very low	166 Å²	166	139.7 Å²	139.7	82%	0.818	78%	0.784	S	S	*	*			trans	70.3	112.6	150.1	-103	-178.3	72.3	0	0	122.5
126	I	29	Very low	29.8	Very low	128 Å²	128	135.6 Å²	135.6	66%	0.656	79%	0.785	S	S	*	*			trans	63.6	138.4	136.8	65.6	156.6	0	0	0	124.4
127	D	28.4	Very low	29.5	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	78%	0.779	S	S	*	*			trans	66.1	114.4	130.2	-67	19.5	0	0	0	124.5
128	S	26.8	Very low	29.5	Very low	95 Å²	95	130.9 Å²	130.9	66%	0.664	78%	0.784	S	S	*	*				78.1	131.7	113.2	-60.6	0	0	0	0	124.3
129	L	27	Very low	29.4	Very low	174 Å²	174	132.5 Å²	132.5	91%	0.911	78%	0.778	S	S	*	*			trans	71.5	162.5	140.1	-89.4	142.7	0	0	0	121.1
130	G	27.1	Very low	29.2	Very low	62 Å²	62	136 Å²	136	64%	0.639	78%	0.779	S	S	*	*			trans	93.1	116.6	-179.1	0	0	0	0	0	112.6
131	E	28.6	Very low	28.8	Very low	191 Å²	191	131.4 Å²	131.4	89%	0.893	77%	0.772	S	S	*	*			cis	64.5	135.3	44.6	-60.3	-158.6	133.7	0	0	115.3
132	G	24.5	Very low	28.7	Very low	75 Å²	75	129.4 Å²	129.4	77%	0.773	77%	0.77	S	S	*	*			trans	158.7	98.8	177.9	0	0	0	0	0	112.4
133	Y	30.2	Very low	28.8	Very low	211 Å²	211	130 Å²	130	83%	0.827	77%	0.772	S	S	*	*			trans	-87.6	178.2	179.9	-77.6	-96.2	0	0	0	113.1
134	E	28.2	Very low	28.5	Very low	188 Å²	188	128.5 Å²	128.5	88%	0.879	77%	0.773	S	S	*	*			trans	108.9	148.9	150.6	-62	-157.7	158.3	0	0	117.7
135	D	31.5	Very low	28.4	Very low	152 Å²	152	131.8 Å²	131.8	81%	0.813	77%	0.768	S	S	*	*			cis	-166.6	167.2	-30	-178.8	40.8	0	0	0	108.1
136	G	29.8	Very low	28.4	Very low	65 Å²	65	134.1 Å²	134.1	67%	0.67	77%	0.767	S	S	*	*			trans	87.3	119.1	156.8	0	0	0	0	0	115.9
137	G	26.9	Very low	28.2	Very low	71 Å²	71	135.4 Å²	135.4	73%	0.732	77%	0.773	S	S	*	*			cis	119	99.1	-5.3	0	0	0	0	0	114.1
138	K	28.8	Very low	28	Very low	192 Å²	192	132 Å²	132	84%	0.835	77%	0.768	S	S	*	*			trans	-175.4	129.6	147.3	-102.3	152	-172.6	172.7	0	108.6
139	E	29.5	Very low	28	Very low	158 Å²	158	136.2 Å²	136.2	74%	0.738	78%	0.779	S	S	*	*			cis	70	134.8	42.4	-58.8	-163.5	144.6	0	0	113.2
140	F	27.2	Very low	27.8	Very low	188 Å²	188	132.5 Å²	132.5	83%	0.825	77%	0.768	S	S	*	*			cis	-140.2	174.8	4.7	-124.6	-153.5	0	0	0	107.7
141	G	28	Very low	27.6	Very low	71 Å²	71	137.4 Å²	137.4	73%	0.732	78%	0.778	S	S	*	*			cis	122.3	147.5	29.5	0	0	0	0	0	108.5
142	G	28.5	Very low	27.3	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	78%	0.777	S	S	*	*			cis	170.9	-158.7	0.3	0	0	0	0	0	111.6
143	L	31.3	Very low	27.8	Very low	157 Å²	157	139.6 Å²	139.6	82%	0.822	78%	0.775	S	S	*	*			trans	70.8	141.8	173.3	-110	63.9	0	0	0	118
144	G	28.3	Very low	27.5	Very low	73 Å²	73	133.9 Å²	133.9	75%	0.753	77%	0.766	S	S	*	*			cis	-173.3	-174.2	-2.1	0	0	0	0	0	111.5
145	E	28.1	Very low	27.3	Very low	147 Å²	147	130.7 Å²	130.7	69%	0.687	76%	0.76	S	S	*	*			cis	-163.8	120.9	-0.6	-154	169.1	-145.2	0	0	113.8
146	W	28.1	Very low	27	Very low	215 Å²	215	130.1 Å²	130.1	81%	0.814	76%	0.756	S	S	*	*			trans	49.9	173.6	147.9	-60.3	59.4	0	0	0	120.2
147	M	25.7	Very low	26.8	Very low	155 Å²	155	136.6 Å²	136.6	76%	0.764	76%	0.761	S	S	*	*			cis	-156.3	163.6	9.2	-164.3	168.7	-67.4	0	0	108.5
148	G	24.1	Very low	26.8	Very low	58 Å²	58	139.1 Å²	139.1	60%	0.598	76%	0.758	S	S	*	*			cis	155.1	161.5	-9.2	0	0	0	0	0	112.3
149	M	25.8	Very low	26.6	Very low	184 Å²	184	136.8 Å²	136.8	91%	0.906	75%	0.754	S	S	*	*			trans	69.7	153.1	165.1	-60.7	160.9	111.9	0	0	119.1
150	S	22.6	Very low	26.4	Very low	96 Å²	96	135.4 Å²	135.4	67%	0.671	76%	0.757	S	S	*	*			cis	-168.9	143	-24	-172.9	0	0	0	0	108.4
151	L	23.8	Very low	27	Very low	165 Å²	165	130.8 Å²	130.8	86%	0.864	75%	0.746	S	S	*	*				175.1	168	94.6	-89.4	170	0	0	0	112.5
152	K	22.9	Very low	27	Very low	198 Å²	198	137.4 Å²	137.4	86%	0.861	76%	0.755	S	S	*	*			trans	-125	-177.1	175.2	-100.9	-175.5	-178.7	-179.7	0	109.9
153	P	34.9	Very low	26.8	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	75%	0.751	S	S	*	*			cis	-118.3	-135.1	12.3	31.3	-6.5	0	0	0	112.5
154	S	22.8	Very low	26.5	Very low	91 Å²	91	137.1 Å²	137.1	64%	0.636	75%	0.749	S	S	*	*			cis	-168.1	120.9	5.4	17.4	0	0	0	0	108.7
155	T	24.1	Very low	26.4	Very low	122 Å²	122	140.9 Å²	140.9	75%	0.748	75%	0.752	S	S	*	*				94.3	131.2	75.7	49.7	0	0	0	0	117.6
156	I	24.8	Very low	26.8	Very low	140 Å²	140	139.1 Å²	139.1	72%	0.718	75%	0.753	S	S	*	*			trans	80	144.4	152.7	-66.8	160.9	0	0	0	116.3
157	Y	25.5	Very low	26.7	Very low	201 Å²	201	137.9 Å²	137.9	79%	0.788	75%	0.754	S	S	*	*			cis	-146	141.6	21.5	-122.1	-39.1	0	0	0	115.7
158	N	27.6	Very low	26.6	Very low	123 Å²	123	137.9 Å²	137.9	66%	0.658	76%	0.756	S	S	*	*			trans	43.6	136	141.4	-78.4	18	0	0	0	129.2
159	N	24.3	Very low	27.1	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	77%	0.767	S	S	*	*			trans	97	152.9	132.7	-71.9	10.7	0	0	0	124.3
160	T	26.5	Very low	27.3	Very low	129 Å²	129	137.8 Å²	137.8	79%	0.791	76%	0.76	S	S	*	*			trans	-120.6	-163.9	-164.9	59.4	0	0	0	0	110.6
161	P	39.6	Very low	27.4	Very low	92 Å²	92	140.7 Å²	140.7	60%	0.597	77%	0.767	S	S	*	*			cis	-142.3	169.3	-5	42.2	-23.3	0	0	0	118.7
162	F	26.6	Very low	27.4	Very low	209 Å²	209	138.2 Å²	138.2	92%	0.917	75%	0.754	S	S	*	*			trans	53.6	170.6	158.4	-50.3	-54.5	0	0	0	119.1
163	S	25.5	Very low	27.6	Very low	97 Å²	97	136 Å²	136	68%	0.678	75%	0.747	S	S	*	*			cis	-158.2	171.8	8	79.5	0	0	0	0	113.7
164	V	24.4	Very low	27	Very low	128 Å²	128	137.3 Å²	137.3	78%	0.776	75%	0.748	S	S	*	*			trans	75.2	116.7	148.9	171.1	0	0	0	0	122
165	N	26.1	Very low	27	Very low	151 Å²	151	137.4 Å²	137.4	81%	0.807	75%	0.748	S	S	*	*			trans	-84.5	152.2	150.9	-90.7	-22.3	0	0	0	109.1
166	P	37.3	Very low	27.1	Very low	111 Å²	111	138.5 Å²	138.5	72%	0.721	75%	0.75	S	S	*	*				-159	170.5	84.7	40.9	-19.7	0	0	0	120
167	F	24.9	Very low	27.2	Very low	189 Å²	189	138.8 Å²	138.8	83%	0.829	75%	0.753	S	S	*	*			trans	-26.9	154.4	158.1	-55.5	-102.1	0	0	0	119.6
168	I	25.2	Very low	27.3	Very low	155 Å²	155	135 Å²	135	80%	0.795	75%	0.75	S	S	*	*				174.8	150	105.2	-90.7	172.3	0	0	0	111
169	C	33.5	Very low	27.2	Very low	125 Å²	125	133.8 Å²	133.8	85%	0.845	75%	0.751	S	S	*	*			trans	-114.1	144.2	166.2	-58.8	0	0	0	0	111
170	P	30.6	Very low	27.3	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	75%	0.749	S	S	*	*			trans	-139.4	123.7	147.9	33.6	-17.2	0	0	0	115.3
171	L	24.8	Very low	27.4	Very low	157 Å²	157	137.2 Å²	137.2	82%	0.822	75%	0.747	S	S	*	*				30.4	144.3	127.6	-144.2	74.3	0	0	0	123.3
172	N	24.4	Very low	26.8	Very low	112 Å²	112	138.9 Å²	138.9	60%	0.599	75%	0.751	S	S	*	*			trans	92.7	112.4	145.2	-90.7	-3.5	0	0	0	123.4
173	Q	25.3	Very low	27	Very low	153 Å²	153	134.1 Å²	134.1	72%	0.715	74%	0.743	S	S	*	*				55.4	121.5	119.3	-63.5	-177.7	29.9	0	0	123.3
174	N	23	Very low	27.2	Very low	140 Å²	140	133.8 Å²	133.8	75%	0.749	75%	0.747	S	S	*	*			trans	70.6	118.7	130.3	-69.2	5.9	0	0	0	124.1
175	S	23.2	Very low	27.3	Very low	93 Å²	93	134 Å²	134	65%	0.65	74%	0.743	S	S	*	*				68.7	111.4	127.3	69.4	0	0	0	0	123.3
176	N	26.6	Very low	27.4	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	74%	0.739	S	S	*	*				73	158.1	124.6	-63.4	13.9	0	0	0	122.6
177	D	25.9	Very low	27.1	Very low	146 Å²	146	133 Å²	133	78%	0.781	73%	0.73	S	S	*	*			trans	74.3	144.5	155	-73.2	7.7	0	0	0	120.2
178	V	27.3	Very low	27.1	Very low	121 Å²	121	133.4 Å²	133.4	73%	0.733	73%	0.728	S	S	*	*			cis	-167.1	166.4	-23.2	105.1	0	0	0	0	112
179	S	26.4	Very low	27.1	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	72%	0.722	S	S	*	*			trans	99.7	149.5	151.6	82.2	0	0	0	0	124.2
180	M	26.7	Very low	26.6	Very low	146 Å²	146	132.5 Å²	132.5	72%	0.719	72%	0.715	S	S	*	*			trans	72.7	139.5	157.9	-58	-127.4	171.3	0	0	118.9
181	R	28.4	Very low	26.4	Very low	198 Å²	198	130.9 Å²	130.9	75%	0.747	71%	0.707	S	S	*	*			cis	-163.9	140.5	-8.5	-116.3	-177.2	-179.9	173.1	2.2	105.5
182	N	27.6	Very low	26.4	Very low	128 Å²	128	130.9 Å²	130.9	68%	0.684	71%	0.707	S	S	*	*				178.4	133.2	61.1	-98.2	-15.4	0	0	0	109.6
183	S	30	Very low	26.3	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	72%	0.717	S	S	*	*				23.3	135.1	126.1	64.4	0	0	0	0	120.6
184	A	29.1	Very low	26.3	Very low	91 Å²	91	128.2 Å²	128.2	75%	0.752	72%	0.72	S	S	*	*			cis	-160.4	-174	-2.5	0	0	0	0	0	107.5
185	D	26.5	Very low	27.1	Very low	131 Å²	131	126.6 Å²	126.6	70%	0.701	72%	0.717	S	S	*	*			cis	-155.9	-161.8	4	-143.8	-3	0	0	0	106.8
186	L	29.3	Very low	27.3	Very low	136 Å²	136	127.2 Å²	127.2	71%	0.712	72%	0.721	S	S	*	*			cis	-152.5	132.2	6.8	-149.8	148.3	0	0	0	111.7
187	I	30.8	Very low	27.2	Very low	106 Å²	106	125.5 Å²	125.5	54%	0.544	72%	0.721	S	S	.	*			trans	-6.3	133	153.9	-19.8	175.5	0	0	0	117.4	L189	I187-L189 HydrophobicContact CG2-CD1 3.46Å; I187-L189 VanDerWaalsContact CG2-CD1 3.46Å
188	Y	24.4	Very low	27.1	Very low	197 Å²	197	124.3 Å²	124.3	77%	0.773	72%	0.722	S	S	*	*				-153	131	59	-104.7	-109.1	0	0	0	111.6
189	L	25.6	Very low	26.9	Very low	128 Å²	128	123 Å²	123	67%	0.67	72%	0.719	S	S	*	*				70	144.4	82.5	-94.3	103.2	0	0	0	115.9	I187	I187-L189 HydrophobicContact CG2-CD1 3.46Å; I187-L189 VanDerWaalsContact CG2-CD1 3.46Å
190	D	23.9	Very low	26.9	Very low	133 Å²	133	126.2 Å²	126.2	71%	0.711	73%	0.728	S	S	*	*			cis	-172.5	173.9	-22.7	-169.2	30.1	0	0	0	111.7
191	S	24.8	Very low	26.8	Very low	81 Å²	81	124.2 Å²	124.2	57%	0.566	73%	0.729	S	S	*	*			trans	77.6	121.4	142.7	-90.5	0	0	0	0	123.7
192	L	25.4	Very low	26.6	Very low	158 Å²	158	120.3 Å²	120.3	83%	0.827	73%	0.73	S	S	*	*			trans	51.8	125.5	136.2	-82.9	83.6	0	0	0	124.4
193	A	23.1	Very low	26.6	Very low	99 Å²	99	119.7 Å²	119.7	82%	0.818	74%	0.736	S	S	*	*				81.9	160.9	128.3	0	0	0	0	0	122.3
194	S	24.2	Very low	26.4	Very low	110 Å²	110	122.6 Å²	122.6	77%	0.769	74%	0.741	S	S	*	*			trans	-97	-173.9	-174.5	61.7	0	0	0	0	111.5
195	P	40.6	Very low	26.3	Very low	106 Å²	106	125.9 Å²	125.9	69%	0.688	74%	0.743	S	S	*	*			cis	-144.4	178.2	6.8	42.6	-22	0	0	0	118.1
196	S	26.5	Very low	26.3	Very low	105 Å²	105	123.7 Å²	123.7	73%	0.734	74%	0.738	S	S	*	*			trans	38.3	124.9	143.3	65.9	0	0	0	0	124.7
197	S	25.1	Very low	26.2	Very low	111 Å²	111	125 Å²	125	78%	0.776	75%	0.746	S	S	*	*			trans	-166.4	141	133.6	7.4	0	0	0	0	108.4
198	C	22.9	Very low	25.9	Very low	120 Å²	120	122.8 Å²	122.8	81%	0.811	75%	0.75	S	S	*	*				70	137.3	59.2	-58.1	0	0	0	0	114
199	S	24	Very low	26	Very low	94 Å²	94	123.1 Å²	123.1	66%	0.657	76%	0.755	S	S	*	*			cis	179.7	140.2	-13.9	48.2	0	0	0	0	111.6
200	N	25.7	Very low	26.2	Very low	164 Å²	164	121.8 Å²	121.8	88%	0.877	76%	0.757	S	S	*	*			trans	58.7	171.7	161.7	-54.5	-21	0	0	0	117
201	S	25.4	Very low	26.5	Very low	105 Å²	105	120.8 Å²	120.8	73%	0.734	76%	0.76	S	S	*	*			cis	-153.3	143.4	3.6	54.3	0	0	0	0	114.1
202	C	24.1	Very low	26.6	Very low	115 Å²	115	121 Å²	121	78%	0.777	76%	0.76	S	S	*	*			trans	35.3	112.9	141.9	-53.6	0	0	0	0	124.6
203	S	26.9	Very low	26.6	Very low	115 Å²	115	121.2 Å²	121.2	80%	0.804	76%	0.757	S	S	*	*				60.8	136.1	123.5	68.3	0	0	0	0	124.6
204	I	25.5	Very low	26.8	Very low	169 Å²	169	123 Å²	123	87%	0.867	75%	0.751	S	S	*	*			trans	-155.9	159.4	143.7	-109.4	160.1	0	0	0	112.6
205	M	27.6	Very low	26.9	Very low	161 Å²	161	124.5 Å²	124.5	79%	0.793	75%	0.751	S	S	*	*			trans	-42.1	171.2	173.7	-58.3	-84.6	74.6	0	0	117.5
206	S	26.6	Very low	26.3	Very low	84 Å²	84	123.9 Å²	123.9	59%	0.587	75%	0.749	S	S	*	*			cis	-176.4	164	-21.7	57.9	0	0	0	0	110.3
207	N	26.8	Very low	26.4	Very low	163 Å²	163	126.5 Å²	126.5	87%	0.872	75%	0.754	S	S	*	*			trans	147.3	157.9	140.7	-76.3	-1.9	0	0	0	114.8
208	G	24.7	Very low	26.4	Very low	61 Å²	61	128.7 Å²	128.7	63%	0.629	76%	0.757	S	S	*	*			trans	179.4	157	167.5	0	0	0	0	0	113.2
209	F	26.8	Very low	26.5	Very low	204 Å²	204	128.3 Å²	128.3	90%	0.895	76%	0.756	S	S	*	*			trans	-167.4	124.6	167.5	-92.8	-63.4	0	0	0	107.1
210	S	28.9	Very low	26.5	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	76%	0.764	S	S	*	*				57.3	137.4	95.9	85.8	0	0	0	0	115.3
211	S	30	Very low	26.7	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	76%	0.759	S	S	*	*			cis	-153.3	-155.2	7.2	48.8	0	0	0	0	109
212	C	27.9	Very low	27.2	Very low	85 Å²	85	128 Å²	128	57%	0.574	76%	0.758	S	S	*	*			cis	-167.2	-179.6	14.4	50.2	0	0	0	0	111.2
213	H	24.7	Very low	27.2	Very low	163 Å²	163	129.3 Å²	129.3	76%	0.755	76%	0.757	S	S	*	*			trans	69.9	148.3	150.4	-71.9	-22.5	0	0	0	120.3
214	I	27.3	Very low	27.1	Very low	137 Å²	137	130.4 Å²	130.4	70%	0.703	75%	0.75	S	S	*	*			cis	-155.7	176	-19.1	-138.2	169.4	0	0	0	113.3
215	N	27.4	Very low	27	Very low	141 Å²	141	129.9 Å²	129.9	75%	0.754	74%	0.744	S	S	*	*			trans	-58.2	175.5	174.4	-60.2	-8.1	0	0	0	116
216	S	27	Very low	26.8	Very low	93 Å²	93	127.3 Å²	127.3	65%	0.65	74%	0.737	S	S	*	*			cis	-178.4	158.6	-20.6	53.8	0	0	0	0	107.9
217	L	28.3	Very low	26.6	Very low	160 Å²	160	129.8 Å²	129.8	84%	0.838	75%	0.749	S	S	*	*				167.6	174.7	94.5	-110.9	156.2	0	0	0	111.4
218	N	25.1	Very low	26.4	Very low	157 Å²	157	127 Å²	127	84%	0.84	74%	0.742	S	S	*	*			trans	-95.1	162	-173.6	-58.5	-39.9	0	0	0	115.3
219	S	25	Very low	26.4	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	75%	0.75	S	S	*	*			trans	-153.7	130.3	145.7	57.6	0	0	0	0	116
220	T	25.4	Very low	26.4	Very low	135 Å²	135	131.4 Å²	131.4	83%	0.828	75%	0.751	S	S	*	*			trans	25.6	132.2	150	47.9	0	0	0	0	124.6
221	S	28.8	Very low	26.2	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	76%	0.757	S	S	*	*			trans	-84.5	161.8	146	58.4	0	0	0	0	111.8
222	P	36.5	Very low	25.8	Very low	110 Å²	110	134.7 Å²	134.7	71%	0.714	75%	0.754	S	S	*	*				-153.5	177.7	93.4	41.7	-23.8	0	0	0	116.7
223	N	25	Very low	25.5	Very low	143 Å²	143	138.5 Å²	138.5	77%	0.765	76%	0.764	S	S	*	*			trans	16.2	161	140.2	-60.6	10	0	0	0	122
224	Q	24.3	Very low	25.5	Very low	139 Å²	139	137.6 Å²	137.6	65%	0.65	76%	0.764	S	S	*	*			cis	174.2	151.3	-20.4	-165.3	-171.5	-54.2	0	0	106
225	E	23	Very low	25.3	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	77%	0.769	S	S	*	*			trans	70.7	157.5	165.9	-44.3	-150.5	161.8	0	0	117.6
226	V	23.9	Very low	25.2	Very low	108 Å²	108	141 Å²	141	66%	0.655	77%	0.774	S	S	*	*			cis	-157.6	138.7	-12.5	113.9	0	0	0	0	112.6
227	T	21.7	Very low	25.2	Very low	136 Å²	136	145 Å²	145	83%	0.834	78%	0.78	S	S	*	*			trans	58.5	169.5	165.9	63.1	0	0	0	0	118
228	S	23.4	Very low	25.1	Very low	105 Å²	105	145.9 Å²	145.9	73%	0.734	78%	0.777	S	S	*	*			cis	-141	179.1	5	69.3	0	0	0	0	112.8
229	N	23.1	Very low	25.2	Very low	149 Å²	149	143.2 Å²	143.2	80%	0.797	77%	0.771	S	S	*	*			trans	-70.4	147.2	-176.5	-57.4	-43.4	0	0	0	114
230	F	28	Very low	25.3	Very low	207 Å²	207	147.1 Å²	147.1	91%	0.908	77%	0.774	S	S	*	*			trans	-142.5	142.9	137.2	-94.5	-76.2	0	0	0	110.9
231	Q	23.5	Very low	25.4	Very low	178 Å²	178	151.1 Å²	151.1	83%	0.832	77%	0.774	S	S	*	*			trans	-87.4	157.2	170.2	-56.9	168	-89.8	0	0	107.6
232	S	22.5	Very low	25.3	Very low	102 Å²	102	150.6 Å²	150.6	71%	0.713	77%	0.77	S	S	*	*			cis	-163.8	154.9	45.2	-75.4	0	0	0	0	114.1
233	E	21.3	Very low	24.8	Very low	166 Å²	166	153.3 Å²	153.3	78%	0.776	77%	0.772	S	S	*	*			trans	58.8	135.6	139.5	-70.3	-162.3	-177.4	0	0	125.2
234	N	24.3	Very low	24.9	Very low	144 Å²	144	151.2 Å²	151.2	77%	0.77	77%	0.769	S	S	*	*			trans	67.7	107	142.4	-68.1	-38.2	0	0	0	120.8
235	L	23.1	Very low	25	Very low	152 Å²	152	151.2 Å²	151.2	80%	0.796	77%	0.773	S	S	*	*			trans	-106.8	145.1	161.1	-80.6	150.5	0	0	0	109.8
236	F	27	Very low	25.4	Very low	196 Å²	196	149.4 Å²	149.4	86%	0.86	78%	0.778	S	S	*	*				168.2	117.7	117.4	-90	-59.5	0	0	0	112.4
237	F	26.4	Very low	25.6	Very low	178 Å²	178	152.1 Å²	152.1	78%	0.781	78%	0.783	S	S	*	*			trans	-159.9	132.2	160.6	-113.2	-51.9	0	0	0	113
238	K	24.9	Very low	25.9	Very low	178 Å²	178	153.7 Å²	153.7	77%	0.774	79%	0.785	S	S	*	*			trans	61.3	166.3	157.7	-71.1	142	-177.5	167.3	0	117.9
239	S	27.8	Very low	26.1	Very low	102 Å²	102	154 Å²	154	71%	0.713	79%	0.787	S	S	*	*			cis	159.8	128.1	-37.3	173.8	0	0	0	0	109.6
240	K	27.1	Very low	26.4	Very low	194 Å²	194	153.4 Å²	153.4	84%	0.843	79%	0.789	S	S	*	*			trans	177.6	138.5	156.6	-94.4	150.2	-174.6	-174.6	0	107.1
241	R	27.7	Very low	26.4	Very low	220 Å²	220	151.4 Å²	151.4	83%	0.83	79%	0.787	S	S	*	*				67.8	143.9	51.7	-75.5	-165.3	176.7	-168.4	-0.3	112.7
242	S	26.8	Very low	26.6	Very low	98 Å²	98	152.7 Å²	152.7	69%	0.685	79%	0.793	S	S	*	*			cis	-171.7	175.8	6.7	31.5	0	0	0	0	109.5
243	H	26	Very low	26.9	Very low	167 Å²	167	151.7 Å²	151.7	77%	0.773	79%	0.791	S	S	*	*			cis	-156.8	-150.4	1.8	-123.8	-54.2	0	0	0	110.1
244	S	26.5	Very low	27.2	Very low	99 Å²	99	152.9 Å²	152.9	69%	0.692	80%	0.796	S	S	*	*			trans	86.5	97.8	168.8	-133.5	0	0	0	0	117.1
245	L	27.6	Very low	27.2	Very low	140 Å²	140	151.8 Å²	151.8	73%	0.733	80%	0.8	S	S	*	*				75.3	141	75.2	-67.7	173	0	0	0	113.1
246	S	30.5	Very low	27.3	Very low	119 Å²	119	152.3 Å²	152.3	83%	0.832	80%	0.804	S	S	*	*			cis	-124.5	167.7	23.2	44.6	0	0	0	0	116.2
247	E	28.7	Very low	27.7	Very low	165 Å²	165	148.3 Å²	148.3	77%	0.771	80%	0.797	S	S	*	*			trans	-102.1	161	-176.6	-58.8	152.9	131.9	0	0	111.8
248	L	27	Very low	27.7	Very low	168 Å²	168	146.8 Å²	146.8	88%	0.88	80%	0.803	S	S	*	*			trans	-173.9	165.9	136.4	-104.3	167.8	0	0	0	111.3
249	S	27.9	Very low	28	Very low	111 Å²	111	145.9 Å²	145.9	78%	0.776	81%	0.806	S	S	*	*			trans	69.3	63.2	167.5	-56.5	0	0	0	0	118.7
250	V	29.8	Very low	28.6	Very low	137 Å²	137	146.5 Å²	146.5	83%	0.83	81%	0.808	S	S	*	*			trans	-130.9	118.5	140.3	177.4	0	0	0	0	108.4
251	L	28	Very low	28.5	Very low	166 Å²	166	143 Å²	143	87%	0.869	81%	0.807	S	S	*	*			trans	162.6	94.6	143.4	-91.6	174.9	0	0	0	111.6
252	Q	28.2	Very low	28.4	Very low	205 Å²	205	138.7 Å²	138.7	96%	0.958	81%	0.811	S	S	*	*				-157.5	167.3	129.8	-121.4	175.1	-9.2	0	0	109.6
253	A	28	Very low	28.5	Very low	81 Å²	81	136.4 Å²	136.4	67%	0.669	80%	0.803	S	S	*	*			trans	-129.1	163.1	-150.7	0	0	0	0	0	114.7
254	Q	26.9	Very low	28.9	Very low	190 Å²	190	138.6 Å²	138.6	89%	0.888	81%	0.811	S	S	*	*			trans	58.3	111.9	151.6	-69.8	169	-3.5	0	0	119.6
255	S	24.9	Very low	29.1	Very low	122 Å²	122	143.5 Å²	143.5	85%	0.853	82%	0.82	S	S	*	*				-152.5	151.2	121.2	42.6	0	0	0	0	109.6
256	N	26.1	Very low	29.3	Very low	163 Å²	163	143.3 Å²	143.3	87%	0.872	83%	0.825	S	S	*	*			trans	-98.2	154	-173.5	-86	-19.9	0	0	0	112.5
257	P	35.5	Very low	29.6	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	82%	0.821	S	S	*	*			trans	-91.2	162.4	178.3	37.2	-36	0	0	0	113.7
258	T	25.8	Very low	30.2	Very low	146 Å²	146	138.3 Å²	138.3	90%	0.896	81%	0.81	S	S	*	*			trans	-137	155.9	161.3	22.9	0	0	0	0	111.1
259	L	30.3	Very low	31.3	Very low	159 Å²	159	136.7 Å²	136.7	83%	0.832	81%	0.808	S	S	*	*			trans	-147.5	176.5	-166.3	-93.1	163	0	0	0	107.6
260	P	41.9	Very low	32.2	Very low	116 Å²	116	134.5 Å²	134.5	75%	0.753	80%	0.796	S	S	*	*			cis	-132.7	-177.2	-7	35.4	-16.4	0	0	0	114.5
261	S	23.8	Very low	33.5	Very low	120 Å²	120	129 Å²	129	84%	0.839	76%	0.764	S	S	*	*			trans	-140.2	167.2	136	61.8	0	0	0	0	109.9
262	S	27.1	Very low	35.1	Very low	129 Å²	129	126 Å²	126	90%	0.902	75%	0.748	S	S	*	*			trans	-81.8	138.6	-148.9	49.3	0	0	0	0	116.7
263	G	26.9	Very low	36.3	Very low	51 Å²	51	120 Å²	120	53%	0.526	73%	0.727	S	S	.	*			trans	-140	146.1	167.9	0	0	0	0	0	111.5	F265	G263-F265 PolarHBondContact O-N 2.65Å; G263-F265 VanDerWaalsContact O-N 3.17Å
264	F	34.6	Very low	37.8	Very low	212 Å²	212	125 Å²	125	93%	0.93	74%	0.737	S	S	*	*	S	Bend	trans	-79.8	10.2	-171.2	-120.5	-91.4	0	0	0	115.3
265	F	30.9	Very low	39.4	Very low	203 Å²	203	122.1 Å²	122.1	89%	0.89	72%	0.723	S	S	*	*			trans	-137.3	56.2	-175	-84.5	-78	0	0	0	113.2	G263	G263-F265 PolarHBondContact O-N 2.65Å; G263-F265 VanDerWaalsContact O-N 3.17Å
266	T	31.7	Very low	41.5	Very low	135 Å²	135	119.5 Å²	119.5	83%	0.828	70%	0.696	S	S	*	*			trans	-126.3	94.6	170.3	50	0	0	0	0	110.4
267	G	38.1	Very low	43.1	Very low	73 Å²	73	122 Å²	122	75%	0.753	70%	0.702	S	S	*	*			trans	-177.2	10	-175.6	0	0	0	0	0	119.4
268	L	40.8	Very low	44.5	Very low	106 Å²	106	118.5 Å²	118.5	56%	0.555	68%	0.681	S	S	*	*			trans	-139.7	84.2	174.8	-74.5	178.2	0	0	0	111.6
269	T	50.1	Low	46.1	Very low	134 Å²	134	121.6 Å²	121.6	82%	0.822	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-83.8	138.7	164.9	42.7	0	0	0	0	110.1
270	A	47.7	Very low	47.8	Very low	65 Å²	65	119.9 Å²	119.9	54%	0.537	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-72.3	136.5	-179.4	0	0	0	0	0	110.9	L272	A270-L272 PolarHBondContact O-N 2.66Å
271	P	56.5	Low	48.9	Very low	23 Å²	23	118.4 Å²	118.4	15%	0.149	65%	0.65	C	S	.	*	P	Polyproline II helix	trans	-62.5	133.2	179.6	23.4	-32.6	0	0	0	111.5	F276 W286 H289	P271-F276 HydrophobicContact CB-CE2 3.62Å; P271-F276 HydrophobicContact CB-CZ 3.93Å; P271-W286 HydrophobicContact CG-CB 4.46Å; P271-H289 HydrophobicContact CG-CB 4.35Å
272	L	62	Low	51.2	Low	101 Å²	101	115.3 Å²	115.3	53%	0.529	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-90.1	146.9	178.7	-71.2	165.9	0	0	0	110.9	A270 E274 Q275 F276	A270-L272 PolarHBondContact O-N 2.66Å; L272-E274 VanDerWaalsContact C-N 3.25Å; L272-E274 PolarHBondContact O-N 2.92Å; L272-Q275 HydrophobicContact CB-CG 4.21Å; L272-Q275 PolarHBondContact O-N 2.86Å; L272-F276 WeakPolarHBondContact O-CD2 3.5Å
273	P	52.9	Low	52.9	Low	79 Å²	79	116.9 Å²	116.9	51%	0.513	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-59.5	-33.5	-177	-24.4	34.6	0	0	0	114.2	Q275 F276 F282	P273-Q275 PolarHBondContact O-N 3.09Å; P273-F276 PolarHBondContact O-N 2.75Å; P273-F282 HydrophobicContact CB-CE2 4.3Å; P273-F282 HydrophobicContact CB-CZ 4.49Å; P273-F282 HydrophobicContact CG-CE2 4.06Å; P273-F282 HydrophobicContact CG-CZ 4Å
274	E	59	Low	54.7	Low	188 Å²	188	117.8 Å²	117.8	88%	0.879	60%	0.603	S	S	*	*	G	3₁₀ helix	trans	-71.8	-12.4	-176.3	-68.8	157.5	-159.8	0	0	113.6	L272 F276	L272-E274 VanDerWaalsContact C-N 3.25Å; L272-E274 PolarHBondContact O-N 2.92Å; E274-F276 VanDerWaalsContact C-N 3.33Å
275	Q	61.4	Low	56.1	Low	128 Å²	128	108.9 Å²	108.9	60%	0.598	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-84.8	-3.9	-179.9	-65	170.9	-34.1	0	0	113.4	L272 P273	L272-Q275 HydrophobicContact CB-CG 4.21Å; L272-Q275 PolarHBondContact O-N 2.86Å; P273-Q275 PolarHBondContact O-N 3.09Å
276	F	68.2	Low	57.6	Low	68 Å²	68	104.3 Å²	104.3	30%	0.298	55%	0.546	S	S	.	.			trans	-132.2	122.7	-171.7	-61.1	-92.2	0	0	0	111.5	P271 L272 P273 E274 S278 D281 F282 A285	P271-F276 HydrophobicContact CB-CE2 3.62Å; P271-F276 HydrophobicContact CB-CZ 3.93Å; L272-F276 WeakPolarHBondContact O-CD2 3.5Å; P273-F276 PolarHBondContact O-N 2.75Å; E274-F276 VanDerWaalsContact C-N 3.33Å; F276-S278 VanDerWaalsContact C-N 3.32Å; F276-S278 PolarHBondContact O-N 3.46Å; F276-D281 HydrophobicContact CD1-CB 4.4Å; F276-F282 HydrophobicContact CB-CB 3.93Å; F276-F282 HydrophobicContact CD2-CB 4.4Å; F276-F282 AromaticContact CD2-CD2 3.89Å; F276-F282 HydrophobicContact CD2-CD2 3.89Å; F276-F282 HydrophobicContact CE2-CD2 4.42Å; F276-F282 HydrophobicContact CG-CB 4.19Å; F276-A285 HydrophobicContact CD1-CB 4.33Å; F276-A285 HydrophobicContact CE1-CB 3.56Å; F276-A285 HydrophobicContact CZ-CB 3.68Å
277	Q	60.7	Low	58.6	Low	214 Å²	214	101.8 Å²	101.8	100%	1	53%	0.526	S	S	*	.	S	Bend	trans	-76.2	-17	-177.3	-63.9	-177.3	-0	0	0	113.8
278	S	63.4	Low	59.2	Low	39 Å²	39	101.7 Å²	101.7	27%	0.273	51%	0.509	S	S	.	.	S	Bend	trans	-119.3	147.6	177.4	111.7	0	0	0	0	112.3	F276 E280 D281 F282	F276-S278 VanDerWaalsContact C-N 3.32Å; F276-S278 PolarHBondContact O-N 3.46Å; S278-E280 PolarHBondContact OG-N 2.81Å; S278-D281 VanDerWaalsContact CB-OD2 3.28Å; S278-D281 WeakPolarHBondContact CB-OD2 3.27Å; S278-D281 PolarHBondContact O-N 3.34Å; S278-D281 WeakPolarHBondContact OG-CB 3.38Å; S278-D281 PolarHBondContact OG-N 2.86Å; S278-D281 PolarHBondContact OG-OD2 2.86Å; S278-F282 PolarHBondContact O-N 3.36Å; S278-F282 VanDerWaalsContact O-N 3.14Å
279	R	60.2	Low	59.8	Low	211 Å²	211	98.7 Å²	98.7	80%	0.796	49%	0.492	S	S	*	.	H	α-helix	trans	-75.4	-28.6	-178.1	-162.6	176.6	-173.3	100.4	1.2	111.9	R283	R279-R283 VanDerWaalsContact O-CB 3.23Å; R279-R283 WeakPolarHBondContact O-CB 3.36Å; R279-R283 PolarHBondContact O-N 3.34Å
280	E	65.3	Low	59.7	Low	122 Å²	122	97.7 Å²	97.7	57%	0.57	47%	0.473	S	S	*	.	H	α-helix	trans	-67.7	-42.9	171.9	-78.5	51.7	-124.5	0	0	110.5	S278 R283 T284	S278-E280 PolarHBondContact OG-N 2.81Å; E280-R283 CarbonylContact O-C 3.5Å; E280-R283 WeakPolarHBondContact O-CA 3.4Å; E280-R283 WeakPolarHBondContact O-CB 3.01Å; E280-R283 PolarHBondContact O-N 2.89Å; E280-R283 VanDerWaalsContact O-N 3.12Å; E280-T284 WeakPolarHBondContact O-CG2 3.22Å; E280-T284 PolarHBondContact O-N 2.99Å; E280-T284 PolarHBondContact O-OG1 3.35Å
281	D	66.2	Low	59.5	Low	86 Å²	86	100.9 Å²	100.9	46%	0.46	48%	0.475	S	S	.	.	H	α-helix	trans	-74.1	-40	-177	-64.4	-49.7	0	0	0	113	F276 S278 R283 T284 A285	F276-D281 HydrophobicContact CD1-CB 4.4Å; S278-D281 VanDerWaalsContact CB-OD2 3.28Å; S278-D281 WeakPolarHBondContact CB-OD2 3.27Å; S278-D281 PolarHBondContact O-N 3.34Å; S278-D281 WeakPolarHBondContact OG-CB 3.38Å; S278-D281 PolarHBondContact OG-N 2.86Å; S278-D281 PolarHBondContact OG-OD2 2.86Å; D281-R283 PolarHBondContact O-N 2.85Å; D281-T284 WeakPolarHBondContact CA-OG1 3.39Å; D281-T284 PolarHBondContact O-N 3.45Å; D281-T284 PolarHBondContact O-OG1 3.01Å; D281-T284 VanDerWaalsContact O-OG1 3.06Å; D281-A285 WeakPolarHBondContact O-CB 3.31Å; D281-A285 PolarHBondContact O-N 3.07Å
282	F	72.1	Confident	58.8	Low	55 Å²	55	104.7 Å²	104.7	24%	0.241	49%	0.493	C	S	.	.	H	α-helix	trans	-55.4	-40.2	166.5	175.3	-107.6	0	0	0	111	P273 F276 S278 W286	P273-F282 HydrophobicContact CB-CE2 4.3Å; P273-F282 HydrophobicContact CB-CZ 4.49Å; P273-F282 HydrophobicContact CG-CE2 4.06Å; P273-F282 HydrophobicContact CG-CZ 4Å; F276-F282 HydrophobicContact CB-CB 3.93Å; F276-F282 HydrophobicContact CD2-CB 4.4Å; F276-F282 AromaticContact CD2-CD2 3.89Å; F276-F282 HydrophobicContact CD2-CD2 3.89Å; F276-F282 HydrophobicContact CE2-CD2 4.42Å; F276-F282 HydrophobicContact CG-CB 4.19Å; S278-F282 PolarHBondContact O-N 3.36Å; S278-F282 VanDerWaalsContact O-N 3.14Å; F282-W286 WeakPolarHBondContact O-CB 3.49Å; F282-W286 PolarHBondContact O-N 2.79Å
283	R	61.6	Low	57.9	Low	161 Å²	161	102.9 Å²	102.9	61%	0.608	49%	0.493	S	S	*	.	H	α-helix	trans	-73.1	-36.9	-178	-170.7	179.1	-171.8	176.6	1.7	112.6	R279 E280 D281 L287	R279-R283 VanDerWaalsContact O-CB 3.23Å; R279-R283 WeakPolarHBondContact O-CB 3.36Å; R279-R283 PolarHBondContact O-N 3.34Å; E280-R283 CarbonylContact O-C 3.5Å; E280-R283 WeakPolarHBondContact O-CA 3.4Å; E280-R283 WeakPolarHBondContact O-CB 3.01Å; E280-R283 PolarHBondContact O-N 2.89Å; E280-R283 VanDerWaalsContact O-N 3.12Å; D281-R283 PolarHBondContact O-N 2.85Å; R283-L287 HydrophobicContact CG-CD1 4.21Å; R283-L287 WeakPolarHBondContact O-CB 3.29Å; R283-L287 WeakPolarHBondContact O-CD1 3.24Å; R283-L287 WeakPolarHBondContact O-CG 3.47Å; R283-L287 PolarHBondContact O-N 2.87Å
284	T	64.8	Low	57.2	Low	71 Å²	71	107.3 Å²	107.3	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-72.1	-42.7	174.2	56.9	0	0	0	0	111	E280 D281 L287 N288	E280-T284 WeakPolarHBondContact O-CG2 3.22Å; E280-T284 PolarHBondContact O-N 2.99Å; E280-T284 PolarHBondContact O-OG1 3.35Å; D281-T284 WeakPolarHBondContact CA-OG1 3.39Å; D281-T284 PolarHBondContact O-N 3.45Å; D281-T284 PolarHBondContact O-OG1 3.01Å; D281-T284 VanDerWaalsContact O-OG1 3.06Å; T284-L287 PolarHBondContact O-N 3.42Å; T284-N288 VanDerWaalsContact O-CB 3.31Å; T284-N288 WeakPolarHBondContact O-CB 3.33Å; T284-N288 VanDerWaalsContact O-CG 3.27Å; T284-N288 PolarHBondContact O-N 3.48Å
285	A	65.3	Low	56.1	Low	25 Å²	25	102.5 Å²	102.5	21%	0.207	49%	0.486	C	S	.	.	H	α-helix	trans	-60.2	-48.5	174.2	0	0	0	0	0	111.9	F276 D281 L287 N288 H289	F276-A285 HydrophobicContact CD1-CB 4.33Å; F276-A285 HydrophobicContact CE1-CB 3.56Å; F276-A285 HydrophobicContact CZ-CB 3.68Å; D281-A285 WeakPolarHBondContact O-CB 3.31Å; D281-A285 PolarHBondContact O-N 3.07Å; A285-L287 PolarHBondContact O-N 3.42Å; A285-N288 PolarHBondContact O-N 3.04Å; A285-H289 WeakPolarHBondContact O-CB 3.41Å; A285-H289 PolarHBondContact O-N 2.84Å
286	W	62.1	Low	54.9	Low	107 Å²	107	101.3 Å²	101.3	41%	0.405	49%	0.491	S	S	.	.	H	α-helix	trans	-65	-36.8	176.9	-171.2	91.4	0	0	0	112.7	P271 F282 R290	P271-W286 HydrophobicContact CG-CB 4.46Å; F282-W286 WeakPolarHBondContact O-CB 3.49Å; F282-W286 PolarHBondContact O-N 2.79Å; W286-R290 HydrophobicContact CE3-CG 4.49Å; W286-R290 WeakPolarHBondContact O-CB 3.44Å; W286-R290 WeakPolarHBondContact O-CG 3.33Å; W286-R290 PolarHBondContact O-N 3.35Å
287	L	52.5	Low	53.4	Low	81 Å²	81	104 Å²	104	42%	0.424	50%	0.504	S	S	.	.	H	α-helix	trans	-68.9	-35.9	172.6	-76.8	171.1	0	0	0	112.4	R283 T284 A285 R290 K291	R283-L287 HydrophobicContact CG-CD1 4.21Å; R283-L287 WeakPolarHBondContact O-CB 3.29Å; R283-L287 WeakPolarHBondContact O-CD1 3.24Å; R283-L287 WeakPolarHBondContact O-CG 3.47Å; R283-L287 PolarHBondContact O-N 2.87Å; T284-L287 PolarHBondContact O-N 3.42Å; A285-L287 PolarHBondContact O-N 3.42Å; L287-R290 CarbonylContact O-C 3.57Å; L287-R290 PolarHBondContact O-N 3.12Å; L287-K291 WeakPolarHBondContact O-CG 3.45Å; L287-K291 PolarHBondContact O-N 3.22Å
288	N	49.7	Very low	52	Low	72 Å²	72	99.8 Å²	99.8	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-75.3	-37.7	177.6	-74.1	-14.9	0	0	0	111.8	T284 A285 R290 K291 L292	T284-N288 VanDerWaalsContact O-CB 3.31Å; T284-N288 WeakPolarHBondContact O-CB 3.33Å; T284-N288 VanDerWaalsContact O-CG 3.27Å; T284-N288 PolarHBondContact O-N 3.48Å; A285-N288 PolarHBondContact O-N 3.04Å; N288-R290 VanDerWaalsContact C-N 3.26Å; N288-R290 PolarHBondContact O-N 3.25Å; N288-K291 CarbonylContact O-C 3.47Å; N288-K291 WeakPolarHBondContact O-CA 3.42Å; N288-K291 WeakPolarHBondContact O-CB 3.48Å; N288-K291 PolarHBondContact O-N 3.29Å; N288-K291 PolarHBondContact OD1-NZ 3.13Å; N288-L292 PolarHBondContact O-N 3.22Å
289	H	53.9	Low	50.6	Low	43 Å²	43	104.7 Å²	104.7	20%	0.199	51%	0.511	C	S	.	.	H	α-helix	trans	-56.5	-42.6	166.5	-178	-86.4	0	0	0	110.7	P271 A285 K291 L292 A293	P271-H289 HydrophobicContact CG-CB 4.35Å; A285-H289 WeakPolarHBondContact O-CB 3.41Å; A285-H289 PolarHBondContact O-N 2.84Å; H289-K291 VanDerWaalsContact C-N 3.31Å; H289-K291 PolarHBondContact O-N 2.83Å; H289-L292 PolarHBondContact O-N 2.8Å; H289-A293 VanDerWaalsContact O-CB 3.28Å; H289-A293 WeakPolarHBondContact O-CB 3.48Å; H289-A293 PolarHBondContact O-N 2.68Å
290	R	48.4	Very low	49.3	Very low	112 Å²	112	102.3 Å²	102.3	42%	0.423	51%	0.514	S	S	.	.	H	α-helix	trans	-72.1	-14.4	172.9	-73.2	-179.5	69.3	98.6	3.8	115.2	W286 L287 N288 R294	W286-R290 HydrophobicContact CE3-CG 4.49Å; W286-R290 WeakPolarHBondContact O-CB 3.44Å; W286-R290 WeakPolarHBondContact O-CG 3.33Å; W286-R290 PolarHBondContact O-N 3.35Å; L287-R290 CarbonylContact O-C 3.57Å; L287-R290 PolarHBondContact O-N 3.12Å; N288-R290 VanDerWaalsContact C-N 3.26Å; N288-R290 PolarHBondContact O-N 3.25Å; R290-R294 VanDerWaalsContact O-CD 3.24Å; R290-R294 WeakPolarHBondContact O-CD 3.36Å; R290-R294 VanDerWaalsContact O-CG 3.24Å; R290-R294 WeakPolarHBondContact O-CG 3.44Å
291	K	43.6	Very low	47.8	Very low	132 Å²	132	100.7 Å²	100.7	57%	0.574	52%	0.516	S	S	*	.	H	α-helix	trans	-82.9	-47.8	167.4	-73.3	173.8	-168.5	161.4	0	110.1	L287 N288 H289 R294 S295	L287-K291 WeakPolarHBondContact O-CG 3.45Å; L287-K291 PolarHBondContact O-N 3.22Å; N288-K291 CarbonylContact O-C 3.47Å; N288-K291 WeakPolarHBondContact O-CA 3.42Å; N288-K291 WeakPolarHBondContact O-CB 3.48Å; N288-K291 PolarHBondContact O-N 3.29Å; N288-K291 PolarHBondContact OD1-NZ 3.13Å; H289-K291 VanDerWaalsContact C-N 3.31Å; H289-K291 PolarHBondContact O-N 2.83Å; K291-R294 CarbonylContact O-C 3.59Å; K291-R294 VanDerWaalsContact O-CA 3.3Å; K291-R294 WeakPolarHBondContact O-CA 3.39Å; K291-R294 WeakPolarHBondContact O-CB 3.2Å; K291-R294 PolarHBondContact O-N 2.97Å; K291-S295 VanDerWaalsContact O-CB 3.28Å; K291-S295 WeakPolarHBondContact O-CB 3.4Å; K291-S295 PolarHBondContact O-N 2.83Å
292	L	40.9	Very low	46	Very low	104 Å²	104	102 Å²	102	55%	0.545	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-47	178.7	-73	164.7	0	0	0	111.5	N288 H289 R294 S295 C296	N288-L292 PolarHBondContact O-N 3.22Å; H289-L292 PolarHBondContact O-N 2.8Å; L292-R294 PolarHBondContact O-N 3.43Å; L292-S295 PolarHBondContact O-N 3.29Å; L292-C296 PolarHBondContact O-N 3.21Å; L292-C296 VanDerWaalsContact O-N 3.14Å
293	A	43.7	Very low	44	Very low	62 Å²	62	103 Å²	103	51%	0.512	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	8.1	170.7	0	0	0	0	0	114.7	H289	H289-A293 VanDerWaalsContact O-CB 3.28Å; H289-A293 WeakPolarHBondContact O-CB 3.48Å; H289-A293 PolarHBondContact O-N 2.68Å
294	R	39	Very low	42.9	Very low	173 Å²	173	102.5 Å²	102.5	65%	0.653	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.8	1.9	169.1	-67.7	-178.8	172.8	-147.3	-12.7	112.8	R290 K291 L292	R290-R294 VanDerWaalsContact O-CD 3.24Å; R290-R294 WeakPolarHBondContact O-CD 3.36Å; R290-R294 VanDerWaalsContact O-CG 3.24Å; R290-R294 WeakPolarHBondContact O-CG 3.44Å; K291-R294 CarbonylContact O-C 3.59Å; K291-R294 VanDerWaalsContact O-CA 3.3Å; K291-R294 WeakPolarHBondContact O-CA 3.39Å; K291-R294 WeakPolarHBondContact O-CB 3.2Å; K291-R294 PolarHBondContact O-N 2.97Å; L292-R294 PolarHBondContact O-N 3.43Å
295	S	35	Very low	41.1	Very low	87 Å²	87	103.9 Å²	103.9	61%	0.608	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-13.9	179.8	-162.7	0	0	0	0	111	K291 L292 H297	K291-S295 VanDerWaalsContact O-CB 3.28Å; K291-S295 WeakPolarHBondContact O-CB 3.4Å; K291-S295 PolarHBondContact O-N 2.83Å; L292-S295 PolarHBondContact O-N 3.29Å; S295-H297 PolarHBondContact O-N 2.72Å
296	C	36.8	Very low	39.7	Very low	102 Å²	102	108.8 Å²	108.8	69%	0.689	60%	0.595	S	S	*	*			trans	-70	47.4	151.3	-51.4	0	0	0	0	110.9	L292	L292-C296 PolarHBondContact O-N 3.21Å; L292-C296 VanDerWaalsContact O-N 3.14Å
297	H	37	Very low	38	Very low	126 Å²	126	106.8 Å²	106.8	58%	0.583	61%	0.608	S	S	*	*			trans	-130.8	81.5	166.8	-89.3	17.2	0	0	0	104.7	S295 L299	S295-H297 PolarHBondContact O-N 2.72Å; H297-L299 PolarHBondContact O-N 2.67Å
298	D	30.2	Very low	36.9	Very low	124 Å²	124	115.8 Å²	115.8	66%	0.663	64%	0.637	S	S	*	*			trans	-60.9	130.5	174.2	-153.7	-12.2	0	0	0	108.6	D300 S301	D298-D300 PolarHBondContact O-N 2.77Å; D298-D300 VanDerWaalsContact O-N 3.13Å; D298-S301 WeakPolarHBondContact O-CB 3.43Å; D298-S301 PolarHBondContact O-N 2.87Å
299	L	33.7	Very low	35.9	Very low	142 Å²	142	115.1 Å²	115.1	74%	0.743	65%	0.647	S	S	*	*	G	3₁₀ helix	trans	-73.6	-15.1	-154.1	-102.3	166.6	0	0	0	113.9	H297 S301	H297-L299 PolarHBondContact O-N 2.67Å; L299-S301 VanDerWaalsContact C-N 3.34Å
300	D	34.3	Very low	34.5	Very low	162 Å²	162	121.7 Å²	121.7	87%	0.866	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-81.2	-10.3	174	-63.6	-41.5	0	0	0	113.6	D298	D298-D300 PolarHBondContact O-N 2.77Å; D298-D300 VanDerWaalsContact O-N 3.13Å
301	S	33.2	Very low	33.7	Very low	87 Å²	87	122.5 Å²	122.5	61%	0.608	70%	0.695	S	S	*	*	G	3₁₀ helix	trans	-82.3	-13.4	-178.6	-64.1	0	0	0	0	114.7	D298 L299 G303	D298-S301 WeakPolarHBondContact O-CB 3.43Å; D298-S301 PolarHBondContact O-N 2.87Å; L299-S301 VanDerWaalsContact C-N 3.34Å; S301-G303 PolarHBondContact O-N 3.38Å; S301-G303 VanDerWaalsContact O-N 3.08Å
302	L	28.4	Very low	33	Very low	113 Å²	113	123.4 Å²	123.4	59%	0.592	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	19.1	-166.9	-111.3	167.7	0	0	0	115.6
303	G	30.8	Very low	32.7	Very low	77 Å²	77	122.2 Å²	122.2	79%	0.794	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-16.3	169.9	0	0	0	0	0	114.8	S301	S301-G303 PolarHBondContact O-N 3.38Å; S301-G303 VanDerWaalsContact O-N 3.08Å
304	Q	38.8	Very low	32.9	Very low	151 Å²	151	122.6 Å²	122.6	71%	0.706	70%	0.696	S	S	*	*			trans	-129	102.6	-171.4	-61.5	-167.2	18.8	0	0	114
305	S	26.3	Very low	33.7	Very low	99 Å²	99	117.6 Å²	117.6	69%	0.692	68%	0.68	S	S	*	*			trans	-160.8	102.7	147.9	40.8	0	0	0	0	110.2
306	P	35.2	Very low	35.2	Very low	128 Å²	128	114.1 Å²	114.1	83%	0.831	66%	0.655	S	S	*	*			trans	-68.8	137.6	171.5	28.7	-32.6	0	0	0	109.9
307	G	27.6	Very low	37.4	Very low	66 Å²	66	112.9 Å²	112.9	68%	0.68	64%	0.641	S	S	*	*			trans	-64.4	153.7	172.7	0	0	0	0	0	111.6	G309	G307-G309 PolarHBondContact O-N 3.41Å
308	W	28.9	Very low	39.8	Very low	270 Å²	270	108.7 Å²	108.7	100%	1.023	62%	0.623	S	S	*	*	S	Bend	trans	-49.7	107.8	-177.7	-78	74.5	0	0	0	112
309	G	27.4	Very low	42.7	Very low	58 Å²	58	106.7 Å²	106.7	60%	0.598	62%	0.615	S	S	*	*			trans	174.7	47.2	-164.7	0	0	0	0	0	109.1	G307 T311	G307-G309 PolarHBondContact O-N 3.41Å; G309-T311 VanDerWaalsContact C-N 3.3Å; G309-T311 PolarHBondContact O-N 2.83Å
310	Q	26.5	Very low	45.4	Very low	181 Å²	181	101.6 Å²	101.6	85%	0.846	59%	0.591	S	S	*	*			trans	-72.8	81	-172.1	-169.8	176.9	14.7	0	0	110.2	Q312	Q310-Q312 PolarHBondContact O-N 2.82Å
311	T	29.6	Very low	48.1	Very low	128 Å²	128	101.6 Å²	101.6	79%	0.785	58%	0.579	S	S	*	*			trans	-62	107.1	169.3	48.1	0	0	0	0	108.8	G309	G309-T311 VanDerWaalsContact C-N 3.3Å; G309-T311 PolarHBondContact O-N 2.83Å
312	Q	30.2	Very low	50.8	Low	151 Å²	151	99.2 Å²	99.2	71%	0.706	56%	0.559	S	S	*	*			trans	-54	158.1	167.7	-76.9	-176.9	-12.6	0	0	110.7	Q310 V314	Q310-Q312 PolarHBondContact O-N 2.82Å; Q312-V314 PolarHBondContact O-N 2.91Å
313	P	34.4	Very low	53.7	Low	79 Å²	79	97.4 Å²	97.4	51%	0.513	55%	0.55	S	S	.	.			trans	-54	126.6	-177	20.9	-33.9	0	0	0	111.5	E315 L502	P313-E315 PolarHBondContact O-N 3.48Å; P313-L502 VanDerWaalsContact CA-CD1 3.48Å; P313-L502 HydrophobicContact CB-CD1 3.61Å
314	V	47	Very low	56.6	Low	71 Å²	71	94.6 Å²	94.6	43%	0.43	52%	0.518	S	S	.	.			trans	-81.9	64.8	-178	-168.7	0	0	0	0	110.1	Q312	Q312-V314 PolarHBondContact O-N 2.91Å
315	E	57	Low	59	Low	67 Å²	67	92.1 Å²	92.1	31%	0.313	51%	0.509	S	S	.	.	S	Bend	trans	-63.1	142.8	143.3	-64.5	161.9	95.7	0	0	107.1	P313 N317 K356 L358	P313-E315 PolarHBondContact O-N 3.48Å; E315-N317 PolarHBondContact O-N 2.97Å; E315-K356 HydrophobicContact CB-CG 4.4Å; E315-K356 WeakPolarHBondContact OE1-CE 3.47Å; E315-K356 IonicContact OE1-NZ 2.72Å; E315-K356 PolarHBondContact OE1-NZ 2.81Å; E315-K356 WeakPolarHBondContact OE2-CE 3.42Å; E315-K356 IonicContact OE2-NZ 2.71Å; E315-K356 PolarHBondContact OE2-NZ 3.42Å; E315-L358 WeakPolarHBondContact OE1-CD2 3.5Å
316	T	66.4	Low	61.9	Low	14 Å²	14	87.9 Å²	87.9	9%	0.086	48%	0.481	C	S	.	.	S	Bend	trans	-67.6	108.2	-175.4	33.3	0	0	0	0	110	K356 A357 P498	T316-K356 WeakPolarHBondContact O-CA 3.27Å; T316-A357 PolarHBondContact O-N 3.22Å; T316-P498 HydrophobicContact CG2-CB 4.1Å
317	N	83	Confident	64.6	Low	76 Å²	76	83.1 Å²	83.1	41%	0.406	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	158.9	-176.5	68.5	-11.5	0	0	0	112.7	E315 M355 K356	E315-N317 PolarHBondContact O-N 2.97Å; N317-M355 CarbonylContact C-O 3.6Å; N317-M355 VanDerWaalsContact CA-O 3.27Å; N317-M355 WeakPolarHBondContact CA-O 3.12Å; N317-K356 HydrophobicContact CB-CB 4.15Å; N317-K356 HydrophobicContact CB-CG 4.23Å
318	I	87.9	Confident	67.8	Low	39 Å²	39	84.1 Å²	84.1	20%	0.2	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141	173.4	-174.7	165.9	0	0	0	109.4	V329 Q330 P332 S354 M355	I318-V329 HydrophobicContact CD1-CG1 4.06Å; I318-V329 HydrophobicContact CG1-CG1 4.3Å; I318-V329 HydrophobicContact CG2-CG1 3.82Å; I318-Q330 WeakPolarHBondContact CD1-O 3.35Å; I318-P332 HydrophobicContact CB-CG 4.39Å; I318-S354 CarbonylContact O-C 3.57Å; I318-S354 WeakPolarHBondContact O-CA 3.47Å; I318-M355 HydrophobicContact CG2-CB 4.01Å; I318-M355 HydrophobicContact CG2-CE 4.11Å; I318-M355 PolarHBondContact N-O 3.17Å; I318-M355 PolarHBondContact O-N 2.85Å
319	V	90.6	Very high	70.8	Confident	81 Å²	81	71.5 Å²	71.5	49%	0.491	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	119.6	173.5	-172.9	0	0	0	0	108.2	Q352 I353	V319-Q352 HydrophobicContact CG1-CG 3.82Å; V319-I353 WeakPolarHBondContact CA-O 3.32Å
320	C	89.2	Confident	73.9	Confident	35 Å²	35	73.9 Å²	73.9	24%	0.236	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	151.9	-179.7	-70.6	0	0	0	0	110.2	V329 Q352 I353	C320-V329 HydrophobicContact CB-CG1 4.32Å; C320-V329 HydrophobicContact CB-CG2 3.85Å; C320-Q352 CarbonylContact O-C 3.59Å; C320-Q352 VanDerWaalsContact O-CA 3.29Å; C320-Q352 WeakPolarHBondContact O-CA 3.31Å; C320-Q352 WeakPolarHBondContact O-CG 3.48Å; C320-I353 HydrophobicContact CB-CG2 4.14Å; C320-I353 PolarHBondContact N-O 2.96Å; C320-I353 PolarHBondContact O-N 2.83Å
321	R	91.6	Very high	76.9	Confident	163 Å²	163	65.2 Å²	65.2	62%	0.615	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.8	163	-69.4	-177.5	-174.7	175.2	-0.2	108.1	Y350 Q351 Q352	R321-Y350 HydrophobicContact CG-CD2 4.25Å; R321-Q351 WeakPolarHBondContact CA-O 3.5Å; R321-Q352 HydrophobicContact CG-CB 3.95Å; R321-Q352 HydrophobicContact CG-CG 3.79Å; R321-Q352 VanDerWaalsContact CZ-OE1 3.31Å
322	L	90.8	Very high	79.4	Confident	36 Å²	36	61.8 Å²	61.8	19%	0.188	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	147.7	178.4	-65.6	167.9	0	0	0	108.5	V329 I340 Y350 Q351	L322-V329 HydrophobicContact CD1-CG2 3.75Å; L322-I340 HydrophobicContact CD1-CB 4.5Å; L322-I340 HydrophobicContact CD1-CD1 3.39Å; L322-Y350 CarbonylContact O-C 3.53Å; L322-Y350 WeakPolarHBondContact O-CA 3.5Å; L322-Y350 WeakPolarHBondContact O-CB 3.44Å; L322-Q351 PolarHBondContact N-O 2.84Å; L322-Q351 PolarHBondContact O-N 2.81Å
323	D	89.3	Confident	81.7	Confident	76 Å²	76	58.6 Å²	58.6	41%	0.406	32%	0.323	S	S	.	.			trans	-98.2	-164.1	179.3	59.8	20.7	0	0	0	110.5	N325 G326	D323-N325 PolarHBondContact O-N 2.87Å; D323-N325 VanDerWaalsContact O-N 3.11Å; D323-N325 WeakPolarHBondContact OD1-CB 3.46Å; D323-N325 VanDerWaalsContact OD1-CG 3.3Å; D323-N325 PolarHBondContact OD1-N 2.78Å; D323-N325 PolarHBondContact OD1-ND2 2.77Å; D323-N325 PolarHBondContact OD2-ND2 2.82Å; D323-G326 PolarHBondContact O-N 2.95Å
324	C	90.2	Very high	84.1	Confident	17 Å²	17	55.3 Å²	55.3	12%	0.115	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-15.7	177.2	57.2	0	0	0	0	114.7	G326 G343 V345 H347	C324-G326 PolarHBondContact O-N 3.29Å; C324-G343 PolarHBondContact O-N 3.23Å; C324-V345 WeakPolarHBondContact CB-O 3.35Å; C324-H347 PolarHBondContact SG-ND1 3Å
325	N	89.4	Confident	86	Confident	100 Å²	100	57 Å²	57	54%	0.535	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.1	-180	-51.1	-55.9	0	0	0	112.7	D323	D323-N325 PolarHBondContact O-N 2.87Å; D323-N325 VanDerWaalsContact O-N 3.11Å; D323-N325 WeakPolarHBondContact OD1-CB 3.46Å; D323-N325 VanDerWaalsContact OD1-CG 3.3Å; D323-N325 PolarHBondContact OD1-N 2.78Å; D323-N325 PolarHBondContact OD1-ND2 2.77Å; D323-N325 PolarHBondContact OD2-ND2 2.82Å
326	G	88.4	Confident	87.7	Confident	9 Å²	9	53.9 Å²	53.9	9%	0.093	29%	0.29	C	S	.	.			trans	72.7	-154.9	-177.9	0	0	0	0	0	113	D323 C324 I340	D323-G326 PolarHBondContact O-N 2.95Å; C324-G326 PolarHBondContact O-N 3.29Å; G326-I340 WeakPolarHBondContact CA-O 3.49Å
327	G	92.3	Very high	89	Confident	28 Å²	28	53.8 Å²	53.8	29%	0.289	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151	-173.8	176.1	0	0	0	0	0	114.3	I340	G327-I340 PolarHBondContact N-O 2.87Å; G327-I340 PolarHBondContact O-N 2.93Å
328	V	93.3	Very high	89.6	Confident	88 Å²	88	50.2 Å²	50.2	53%	0.533	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	128.5	179.5	-171.4	0	0	0	0	110	H339	V328-H339 VanDerWaalsContact CG2-ND1 3.32Å; V328-H339 WeakPolarHBondContact CG2-ND1 3.33Å
329	V	93.1	Very high	89.9	Confident	4 Å²	4	51 Å²	51	2%	0.024	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	106.5	177.6	-178.1	0	0	0	0	108.7	I318 C320 L322 S337 V338 I340 I353 M355	I318-V329 HydrophobicContact CD1-CG1 4.06Å; I318-V329 HydrophobicContact CG1-CG1 4.3Å; I318-V329 HydrophobicContact CG2-CG1 3.82Å; C320-V329 HydrophobicContact CB-CG1 4.32Å; C320-V329 HydrophobicContact CB-CG2 3.85Å; L322-V329 HydrophobicContact CD1-CG2 3.75Å; V329-S337 CarbonylContact O-C 3.6Å; V329-S337 WeakPolarHBondContact O-CA 3.39Å; V329-V338 PolarHBondContact N-O 2.78Å; V329-V338 PolarHBondContact O-N 2.68Å; V329-I340 HydrophobicContact CG2-CD1 4.25Å; V329-I353 HydrophobicContact CB-CG2 4.46Å; V329-I353 HydrophobicContact CG1-CG2 4.49Å; V329-I353 HydrophobicContact CG2-CG2 3.76Å; V329-M355 HydrophobicContact CG1-CE 4.07Å; V329-M355 WeakPolarHBondContact O-CE 3.18Å
330	Q	92.4	Very high	90	Very high	108 Å²	108	47.6 Å²	47.6	51%	0.505	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134.7	175.4	-170.8	-178.2	-5.5	0	0	110.8	I318 T334 I336	I318-Q330 WeakPolarHBondContact CD1-O 3.35Å; Q330-T334 PolarHBondContact NE2-O 3.24Å; Q330-I336 WeakPolarHBondContact CA-O 3.28Å; Q330-I336 WeakPolarHBondContact CG-O 3.27Å
331	L	88.5	Confident	90.2	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-76.4	122.8	177.4	-167.1	127.1	0	0	0	110.5	D333 T334 I336 M355 A357	L331-D333 PolarHBondContact O-N 3.26Å; L331-T334 WeakPolarHBondContact CB-OG1 3.45Å; L331-T334 HydrophobicContact CD2-CG2 3.64Å; L331-T334 WeakPolarHBondContact CD2-OG1 3.39Å; L331-T334 PolarHBondContact O-N 3.33Å; L331-T334 PolarHBondContact O-OG1 2.88Å; L331-I336 HydrophobicContact CB-CB 4.29Å; L331-I336 PolarHBondContact N-O 2.69Å; L331-M355 HydrophobicContact CB-CE 3.76Å; L331-M355 HydrophobicContact CB-SD 4.23Å; L331-M355 HydrophobicContact CD1-CB 4.15Å; L331-M355 HydrophobicContact CD1-CE 4.32Å; L331-M355 HydrophobicContact CD1-CG 3.61Å; L331-M355 HydrophobicContact CD1-SD 4.1Å; L331-A357 HydrophobicContact CD1-CB 4.35Å; L331-A357 HydrophobicContact CD2-CB 3.77Å
332	P	83.5	Confident	90.2	Very high	55 Å²	55	47.9 Å²	47.9	36%	0.357	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	135.7	-170.4	-30.9	35.6	0	0	0	114.4	I318 T334	I318-P332 HydrophobicContact CB-CG 4.39Å; P332-T334 PolarHBondContact O-N 2.79Å
333	D	76.8	Confident	90	Very high	84 Å²	84	47.9 Å²	47.9	45%	0.449	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	22.7	178.2	-57.4	-47.6	0	0	0	115.5	L331 K499	L331-D333 PolarHBondContact O-N 3.26Å; D333-K499 HydrophobicContact CB-CG 4.41Å; D333-K499 VanDerWaalsContact OD1-CE 3.22Å; D333-K499 WeakPolarHBondContact OD1-CE 3.23Å; D333-K499 IonicContact OD1-NZ 3.68Å; D333-K499 PolarHBondContact OD1-NZ 2.85Å; D333-K499 WeakPolarHBondContact OD2-CD 3.35Å; D333-K499 WeakPolarHBondContact OD2-CE 3.41Å; D333-K499 WeakPolarHBondContact OD2-CG 3.43Å; D333-K499 IonicContact OD2-NZ 2.69Å; D333-K499 PolarHBondContact OD2-NZ 3.39Å
334	T	84.9	Confident	90	Very high	10 Å²	10	44.3 Å²	44.3	6%	0.061	25%	0.251	C	S	.	.	S	Bend	trans	-132.5	166.1	173	71.2	0	0	0	0	112	Q330 L331 P332 I336 C496	Q330-T334 PolarHBondContact NE2-O 3.24Å; L331-T334 WeakPolarHBondContact CB-OG1 3.45Å; L331-T334 HydrophobicContact CD2-CG2 3.64Å; L331-T334 WeakPolarHBondContact CD2-OG1 3.39Å; L331-T334 PolarHBondContact O-N 3.33Å; L331-T334 PolarHBondContact O-OG1 2.88Å; P332-T334 PolarHBondContact O-N 2.79Å; T334-I336 VanDerWaalsContact C-N 3.32Å; T334-I336 PolarHBondContact O-N 3.03Å; T334-C496 HydrophobicContact CG2-CB 4.06Å
335	H	87.9	Confident	90	Very high	107 Å²	107	43.6 Å²	43.6	50%	0.495	25%	0.246	S	C	.	.	S	Bend	trans	-98.3	57.1	169.7	-63	-65.9	0	0	0	109.9	K395 D495	H335-K395 HydrophobicContact CB-CB 3.43Å; H335-K395 VanDerWaalsContact CB-CB 3.43Å; H335-K395 HydrophobicContact CB-CD 4.08Å; H335-K395 HydrophobicContact CB-CG 4.35Å; H335-K395 PolarHBondContact O-N 2.88Å; H335-D495 IonicContact CD2-OD2 3.87Å
336	I	92.5	Very high	90	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	123.1	177.4	-59.6	177	0	0	0	107.7	Q330 L331 T334 M355 P375 V377 L392 E393 I394	Q330-I336 WeakPolarHBondContact CA-O 3.28Å; Q330-I336 WeakPolarHBondContact CG-O 3.27Å; L331-I336 HydrophobicContact CB-CB 4.29Å; L331-I336 PolarHBondContact N-O 2.69Å; T334-I336 VanDerWaalsContact C-N 3.32Å; T334-I336 PolarHBondContact O-N 3.03Å; I336-M355 HydrophobicContact CG2-SD 3.88Å; I336-P375 HydrophobicContact CD1-CG 3.61Å; I336-V377 HydrophobicContact CD1-CG2 3.95Å; I336-V377 HydrophobicContact CG2-CG1 4.36Å; I336-V377 HydrophobicContact CG2-CG2 4.03Å; I336-L392 HydrophobicContact CG2-CD1 4.23Å; I336-E393 WeakPolarHBondContact CA-O 3.25Å; I336-I394 HydrophobicContact CG1-CG1 4.34Å; I336-I394 HydrophobicContact CG2-CG1 4.19Å
337	S	94.2	Very high	89.9	Confident	13 Å²	13	48.4 Å²	48.4	9%	0.091	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	141.6	-178.8	31.3	0	0	0	0	112.4	V329 E393	V329-S337 CarbonylContact O-C 3.6Å; V329-S337 WeakPolarHBondContact O-CA 3.39Å; S337-E393 PolarHBondContact N-O 2.93Å; S337-E393 PolarHBondContact O-N 2.67Å
338	V	94.9	Very high	89.4	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.2	170.1	-179.5	0	0	0	0	108.3	V329 I340 I353 M355 I379 L390 T391 L392	V329-V338 PolarHBondContact N-O 2.78Å; V329-V338 PolarHBondContact O-N 2.68Å; V338-I340 HydrophobicContact CG1-CG1 4.22Å; V338-I353 HydrophobicContact CB-CD1 4.15Å; V338-I353 HydrophobicContact CG1-CD1 3.89Å; V338-I353 HydrophobicContact CG2-CD1 4.44Å; V338-M355 HydrophobicContact CG2-CE 4.28Å; V338-M355 HydrophobicContact CG2-SD 3.77Å; V338-I379 HydrophobicContact CG2-CD1 4.05Å; V338-L390 HydrophobicContact CG1-CB 4.07Å; V338-L390 HydrophobicContact CG1-CD1 4.17Å; V338-T391 WeakPolarHBondContact CA-O 3.32Å; V338-L392 HydrophobicContact CG2-CD1 3.73Å
339	H	93.6	Very high	89.2	Confident	57 Å²	57	49.7 Å²	49.7	26%	0.264	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.6	172	-53.5	-99.6	0	0	0	108.8	V328 T391 E393	V328-H339 VanDerWaalsContact CG2-ND1 3.32Å; V328-H339 WeakPolarHBondContact CG2-ND1 3.33Å; H339-T391 PolarHBondContact N-O 2.86Å; H339-T391 PolarHBondContact O-N 2.92Å; H339-E393 IonicContact CD2-OE2 2.88Å; H339-E393 IonicContact CE1-OE2 2.85Å; H339-E393 IonicContact NE2-OE2 3.28Å; H339-E393 PolarHBondContact NE2-OE2 2.83Å
340	I	93.3	Very high	89.1	Confident	8 Å²	8	55.4 Å²	55.4	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.9	-179.2	-65.1	150.2	0	0	0	106.6	L322 G326 G327 V329 V338 H344 I353 L390	L322-I340 HydrophobicContact CD1-CB 4.5Å; L322-I340 HydrophobicContact CD1-CD1 3.39Å; G326-I340 WeakPolarHBondContact CA-O 3.49Å; G327-I340 PolarHBondContact N-O 2.87Å; G327-I340 PolarHBondContact O-N 2.93Å; V329-I340 HydrophobicContact CG2-CD1 4.25Å; V338-I340 HydrophobicContact CG1-CG1 4.22Å; I340-H344 HydrophobicContact CG2-CB 3.86Å; I340-I353 HydrophobicContact CD1-CD1 4.07Å; I340-I353 HydrophobicContact CD1-CG2 4Å; I340-L390 HydrophobicContact CB-CD2 4.07Å; I340-L390 HydrophobicContact CG1-CD2 3.54Å; I340-L390 HydrophobicContact CG2-CD2 4.04Å
341	P	92.3	Very high	88.9	Confident	47 Å²	47	50.3 Å²	50.3	31%	0.305	28%	0.28	S	S	.	.			trans	-72.1	159.7	-175.1	31.2	-36.7	0	0	0	112.2	H344 S388 F389	P341-H344 VanDerWaalsContact O-CB 3.29Å; P341-H344 WeakPolarHBondContact O-CB 3.47Å; P341-H344 PolarHBondContact O-N 3.38Å; P341-S388 VanDerWaalsContact CG-OG 3.3Å; P341-S388 WeakPolarHBondContact CG-OG 3.09Å; P341-F389 WeakPolarHBondContact CD-O 3.45Å
342	E	91.5	Very high	89.2	Confident	158 Å²	158	53.1 Å²	53.1	74%	0.738	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	144.5	169.6	-171.6	174.1	-178.4	0	0	110.7	H344	E342-H344 VanDerWaalsContact C-N 3.3Å; E342-H344 PolarHBondContact O-N 2.84Å
343	G	87.5	Confident	89.6	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	4.6	-177.8	0	0	0	0	0	115.8	C324 V345	C324-G343 PolarHBondContact O-N 3.23Å; G343-V345 VanDerWaalsContact C-N 3.28Å; G343-V345 PolarHBondContact O-N 3.38Å
344	H	89.2	Confident	90.4	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.264	C	S	.	.	S	Bend	trans	-57.2	-35.9	-179.5	-179.1	71.7	0	0	0	114	I340 P341 E342 T386 K387 S388 L390	I340-H344 HydrophobicContact CG2-CB 3.86Å; P341-H344 VanDerWaalsContact O-CB 3.29Å; P341-H344 WeakPolarHBondContact O-CB 3.47Å; P341-H344 PolarHBondContact O-N 3.38Å; E342-H344 VanDerWaalsContact C-N 3.3Å; E342-H344 PolarHBondContact O-N 2.84Å; H344-T386 VanDerWaalsContact CE1-CG2 3.48Å; H344-T386 WeakPolarHBondContact CE1-CG2 3.48Å; H344-T386 WeakPolarHBondContact NE2-CG2 3.03Å; H344-T386 WeakPolarHBondContact O-CA 3.37Å; H344-K387 PolarHBondContact O-N 3.43Å; H344-S388 VanDerWaalsContact CA-OG 3.32Å; H344-S388 WeakPolarHBondContact CA-OG 3.3Å; H344-S388 WeakPolarHBondContact CB-OG 3.49Å; H344-S388 PolarHBondContact CE1-O 3.3Å; H344-S388 VanDerWaalsContact CE1-O 3.25Å; H344-S388 PolarHBondContact ND1-O 2.83Å; H344-S388 PolarHBondContact ND1-OG 3.17Å; H344-S388 VanDerWaalsContact ND1-OG 3.08Å; H344-L390 WeakPolarHBondContact CE1-CD2 3.44Å
345	V	91.3	Very high	90.8	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.018	26%	0.261	C	S	.	.	S	Bend	trans	-122.6	161.3	171.9	-64.2	0	0	0	0	110.6	C324 G343 D349 Q351	C324-V345 WeakPolarHBondContact CB-O 3.35Å; G343-V345 VanDerWaalsContact C-N 3.28Å; G343-V345 PolarHBondContact O-N 3.38Å; V345-D349 HydrophobicContact CB-CB 4.14Å; V345-D349 HydrophobicContact CG2-CB 4.44Å; V345-Q351 HydrophobicContact CG1-CB 4.05Å
346	S	88.9	Confident	90.9	Very high	36 Å²	36	43.9 Å²	43.9	25%	0.252	24%	0.244	S	C	.	.			trans	-69.6	159.5	179.2	-41.6	0	0	0	0	112.7	G348 D349 K387	S346-G348 PolarHBondContact O-N 2.87Å; S346-D349 WeakPolarHBondContact CB-OD2 3.3Å; S346-D349 PolarHBondContact O-N 3.11Å; S346-D349 VanDerWaalsContact O-N 3.07Å; S346-D349 PolarHBondContact OG-OD2 3.4Å; S346-K387 PolarHBondContact OG-NZ 3.4Å
347	H	85.1	Confident	90.8	Very high	174 Å²	174	43.9 Å²	43.9	81%	0.806	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	120.2	171.7	-65	-62.1	0	0	0	110.9	C324	C324-H347 PolarHBondContact SG-ND1 3Å
348	G	83.2	Confident	90.5	Very high	76 Å²	76	43.7 Å²	43.7	78%	0.784	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.7	-22.1	-176.4	0	0	0	0	0	114	S346	S346-G348 PolarHBondContact O-N 2.87Å
349	D	88.6	Confident	90	Very high	66 Å²	66	44.7 Å²	44.7	35%	0.353	25%	0.247	S	C	.	.			trans	-86.5	166	174.9	-63	-40.3	0	0	0	111.8	V345 S346	V345-D349 HydrophobicContact CB-CB 4.14Å; V345-D349 HydrophobicContact CG2-CB 4.44Å; S346-D349 WeakPolarHBondContact CB-OD2 3.3Å; S346-D349 PolarHBondContact O-N 3.11Å; S346-D349 VanDerWaalsContact O-N 3.07Å; S346-D349 PolarHBondContact OG-OD2 3.4Å
350	Y	90	Very high	89.5	Confident	124 Å²	124	44.3 Å²	44.3	49%	0.486	25%	0.248	S	C	.	.			trans	-140.1	138.4	175.5	59	-85.2	0	0	0	112	R321 L322	R321-Y350 HydrophobicContact CG-CD2 4.25Å; L322-Y350 CarbonylContact O-C 3.53Å; L322-Y350 WeakPolarHBondContact O-CA 3.5Å; L322-Y350 WeakPolarHBondContact O-CB 3.44Å
351	Q	89.9	Confident	89.2	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	115.6	168	-162.7	65.6	16	0	0	108.7	R321 L322 V345 N383	R321-Q351 WeakPolarHBondContact CA-O 3.5Å; L322-Q351 PolarHBondContact N-O 2.84Å; L322-Q351 PolarHBondContact O-N 2.81Å; V345-Q351 HydrophobicContact CG1-CB 4.05Å; Q351-N383 PolarHBondContact NE2-O 2.85Å; Q351-N383 PolarHBondContact OE1-O 3.44Å
352	Q	93	Very high	88.9	Confident	59 Å²	59	42.7 Å²	42.7	28%	0.276	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	115.8	161.4	-165.4	-177.9	-82.4	0	0	108.6	V319 C320 R321 S382	V319-Q352 HydrophobicContact CG1-CG 3.82Å; C320-Q352 CarbonylContact O-C 3.59Å; C320-Q352 VanDerWaalsContact O-CA 3.29Å; C320-Q352 WeakPolarHBondContact O-CA 3.31Å; C320-Q352 WeakPolarHBondContact O-CG 3.48Å; R321-Q352 HydrophobicContact CG-CB 3.95Å; R321-Q352 HydrophobicContact CG-CG 3.79Å; R321-Q352 VanDerWaalsContact CZ-OE1 3.31Å; Q352-S382 WeakPolarHBondContact CA-OG 3.28Å; Q352-S382 VanDerWaalsContact CB-OG 3.27Å; Q352-S382 WeakPolarHBondContact CB-OG 3.47Å; Q352-S382 PolarHBondContact N-OG 3.4Å; Q352-S382 PolarHBondContact O-N 3.25Å; Q352-S382 PolarHBondContact O-OG 2.91Å
353	I	93.6	Very high	88.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.2	173.9	-176.5	169.5	0	0	0	109.4	V319 C320 V329 V338 I340 I379 K380 L381 L390	V319-I353 WeakPolarHBondContact CA-O 3.32Å; C320-I353 HydrophobicContact CB-CG2 4.14Å; C320-I353 PolarHBondContact N-O 2.96Å; C320-I353 PolarHBondContact O-N 2.83Å; V329-I353 HydrophobicContact CB-CG2 4.46Å; V329-I353 HydrophobicContact CG1-CG2 4.49Å; V329-I353 HydrophobicContact CG2-CG2 3.76Å; V338-I353 HydrophobicContact CB-CD1 4.15Å; V338-I353 HydrophobicContact CG1-CD1 3.89Å; V338-I353 HydrophobicContact CG2-CD1 4.44Å; I340-I353 HydrophobicContact CD1-CD1 4.07Å; I340-I353 HydrophobicContact CD1-CG2 4Å; I353-I379 HydrophobicContact CD1-CG2 4.1Å; I353-I379 HydrophobicContact CG1-CG2 4.26Å; I353-K380 WeakPolarHBondContact CA-O 3.5Å; I353-L381 HydrophobicContact CB-CD2 4.11Å; I353-L381 HydrophobicContact CD1-CD2 4.07Å; I353-L381 HydrophobicContact CG1-CD2 3.88Å; I353-L390 HydrophobicContact CD1-CD1 4.42Å
354	S	93.1	Very high	88.2	Confident	27 Å²	27	43.5 Å²	43.5	19%	0.189	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.8	174.7	167.3	0	0	0	0	108.5	I318 K380	I318-S354 CarbonylContact O-C 3.57Å; I318-S354 WeakPolarHBondContact O-CA 3.47Å; S354-K380 PolarHBondContact N-O 3.06Å; S354-K380 PolarHBondContact O-N 3.47Å
355	M	93	Very high	88.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.7	-179.5	-171.3	-178.2	26.4	0	0	110.2	N317 I318 V329 L331 I336 V338 V377 E378 I379	N317-M355 CarbonylContact C-O 3.6Å; N317-M355 VanDerWaalsContact CA-O 3.27Å; N317-M355 WeakPolarHBondContact CA-O 3.12Å; I318-M355 HydrophobicContact CG2-CB 4.01Å; I318-M355 HydrophobicContact CG2-CE 4.11Å; I318-M355 PolarHBondContact N-O 3.17Å; I318-M355 PolarHBondContact O-N 2.85Å; V329-M355 HydrophobicContact CG1-CE 4.07Å; V329-M355 WeakPolarHBondContact O-CE 3.18Å; L331-M355 HydrophobicContact CB-CE 3.76Å; L331-M355 HydrophobicContact CB-SD 4.23Å; L331-M355 HydrophobicContact CD1-CB 4.15Å; L331-M355 HydrophobicContact CD1-CE 4.32Å; L331-M355 HydrophobicContact CD1-CG 3.61Å; L331-M355 HydrophobicContact CD1-SD 4.1Å; I336-M355 HydrophobicContact CG2-SD 3.88Å; V338-M355 HydrophobicContact CG2-CE 4.28Å; V338-M355 HydrophobicContact CG2-SD 3.77Å; M355-V377 HydrophobicContact CG-CG1 3.5Å; M355-V377 HydrophobicContact SD-CG1 3.79Å; M355-E378 CarbonylContact C-O 3.49Å; M355-E378 WeakPolarHBondContact CA-O 3.18Å; M355-I379 HydrophobicContact CG-CG1 4.28Å
356	K	90.3	Very high	87.9	Confident	36 Å²	36	44.1 Å²	44.1	16%	0.157	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	131.2	-173.8	176.6	-165.3	-177.3	-163.1	0	111	E315 T316 N317 L358 E378	E315-K356 HydrophobicContact CB-CG 4.4Å; E315-K356 WeakPolarHBondContact OE1-CE 3.47Å; E315-K356 IonicContact OE1-NZ 2.72Å; E315-K356 PolarHBondContact OE1-NZ 2.81Å; E315-K356 WeakPolarHBondContact OE2-CE 3.42Å; E315-K356 IonicContact OE2-NZ 2.71Å; E315-K356 PolarHBondContact OE2-NZ 3.42Å; T316-K356 WeakPolarHBondContact O-CA 3.27Å; N317-K356 HydrophobicContact CB-CB 4.15Å; N317-K356 HydrophobicContact CB-CG 4.23Å; K356-L358 HydrophobicContact CD-CD2 3.93Å; K356-L358 HydrophobicContact CG-CD2 4.34Å; K356-E378 HydrophobicContact CB-CB 4.22Å; K356-E378 WeakPolarHBondContact CD-OE2 3.49Å; K356-E378 PolarHBondContact N-O 2.77Å; K356-E378 PolarHBondContact O-N 3.16Å
357	A	89.4	Confident	87.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	120.8	175.7	0	0	0	0	0	111.9	T316 L331 P375	T316-A357 PolarHBondContact O-N 3.22Å; L331-A357 HydrophobicContact CD1-CB 4.35Å; L331-A357 HydrophobicContact CD2-CB 3.77Å; A357-P375 HydrophobicContact CB-CB 4.3Å; A357-P375 HydrophobicContact CB-CG 4.3Å
358	L	88.1	Confident	87.8	Confident	10 Å²	10	40.5 Å²	40.5	5%	0.052	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.9	172.2	-49.8	176.8	0	0	0	108.6	E315 K356 P375 V376 E378 K418 Y447	E315-L358 WeakPolarHBondContact OE1-CD2 3.5Å; K356-L358 HydrophobicContact CD-CD2 3.93Å; K356-L358 HydrophobicContact CG-CD2 4.34Å; L358-P375 WeakPolarHBondContact O-CB 3.14Å; L358-V376 HydrophobicContact CB-CB 4.28Å; L358-V376 WeakPolarHBondContact CB-O 3.34Å; L358-V376 PolarHBondContact N-O 3.26Å; L358-V376 PolarHBondContact O-N 2.89Å; L358-E378 HydrophobicContact CD1-CB 4.44Å; L358-K418 HydrophobicContact CD1-CD 4.15Å; L358-K418 HydrophobicContact CD1-CG 4.18Å; L358-Y447 HydrophobicContact CD1-CD1 3.98Å; L358-Y447 HydrophobicContact CD1-CE1 4.06Å
359	L	85.4	Confident	88	Confident	20 Å²	20	43.6 Å²	43.6	11%	0.105	21%	0.214	C	C	.	.	S	Bend	trans	-87.4	-25.4	-168.5	-51.3	174.1	0	0	0	113.5	P361 P375 F492 P498 V566	L359-P361 WeakPolarHBondContact O-CD 3.34Å; L359-P375 HydrophobicContact CD2-CB 4.46Å; L359-F492 HydrophobicContact CD1-CE1 4.2Å; L359-P498 HydrophobicContact CD1-CB 4.46Å; L359-P498 HydrophobicContact CD1-CG 3.7Å; L359-V566 HydrophobicContact CB-CG2 3.82Å; L359-V566 VanDerWaalsContact O-CG2 3.27Å; L359-V566 WeakPolarHBondContact O-CG2 3.47Å
360	D	83.8	Confident	88	Confident	50 Å²	50	41.2 Å²	41.2	27%	0.267	20%	0.202	S	C	.	.	S	Bend	trans	-99	107.6	175.3	-75	-71.9	0	0	0	108.5	V566 R568	D360-V566 PolarHBondContact OD1-N 3.17Å; D360-R568 IonicContact OD1-NH1 3.57Å; D360-R568 PolarHBondContact OD1-NH1 2.95Å; D360-R568 IonicContact OD2-CZ 3.2Å; D360-R568 IonicContact OD2-NH1 3.62Å; D360-R568 PolarHBondContact OD2-NH1 3.02Å; D360-R568 IonicContact OD2-NH2 3.13Å; D360-R568 PolarHBondContact OD2-NH2 3.02Å
361	P	85.4	Confident	88	Confident	13 Å²	13	35.3 Å²	35.3	8%	0.084	18%	0.179	C	C	.	.			trans	-76.2	156.1	-175.4	30.9	-35.6	0	0	0	112.8	L359 T372 V376 G564	L359-P361 WeakPolarHBondContact O-CD 3.34Å; P361-T372 HydrophobicContact CB-CG2 4.29Å; P361-V376 HydrophobicContact CB-CG2 4.09Å; P361-G564 WeakPolarHBondContact CD-O 3.46Å
362	P	85.7	Confident	88.1	Confident	7 Å²	7	35.5 Å²	35.5	5%	0.045	18%	0.18	C	C	.	.			trans	-57.2	150	168.7	-25.2	35.2	0	0	0	112.7	E364 L365 K418 Y422	P362-E364 VanDerWaalsContact C-N 3.31Å; P362-E364 PolarHBondContact O-N 2.86Å; P362-L365 PolarHBondContact O-N 2.67Å; P362-K418 WeakPolarHBondContact CG-O 3.2Å; P362-Y422 HydrophobicContact CB-CE2 4.32Å; P362-Y422 HydrophobicContact CG-CE2 3.9Å
363	L	81.5	Confident	88	Confident	104 Å²	104	32.8 Å²	32.8	55%	0.545	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-67.8	-30.1	-176.8	-58.4	175.9	0	0	0	112.6	L365 N366 L563	L363-L365 PolarHBondContact O-N 3.27Å; L363-N366 PolarHBondContact O-N 3.15Å; L363-N366 VanDerWaalsContact O-N 3.12Å; L363-L563 HydrophobicContact CD2-CD1 4.4Å; L363-L563 HydrophobicContact CD2-CD2 4.08Å
364	E	84.3	Confident	87.8	Confident	107 Å²	107	33 Å²	33	50%	0.5	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-55.6	-35.1	175.9	-173.8	178.4	-131.2	0	0	112.2	P362 N366 P421 Y422	P362-E364 VanDerWaalsContact C-N 3.31Å; P362-E364 PolarHBondContact O-N 2.86Å; E364-N366 PolarHBondContact O-N 2.79Å; E364-P421 WeakPolarHBondContact OE2-CA 3.42Å; E364-Y422 WeakPolarHBondContact OE2-CD2 3.4Å; E364-Y422 PolarHBondContact OE2-N 2.74Å
365	L	86.3	Confident	87.7	Confident	7 Å²	7	31.9 Å²	31.9	4%	0.037	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-79	3.1	-177.8	-57.6	-173.9	0	0	0	114.3	P362 L363 T371 T372 V376 V413 Y422 A449 V451	P362-L365 PolarHBondContact O-N 2.67Å; L363-L365 PolarHBondContact O-N 3.27Å; L365-T371 CarbonylContact O-C 3.52Å; L365-T371 WeakPolarHBondContact O-CA 3.43Å; L365-T372 WeakPolarHBondContact CB-OG1 3.31Å; L365-T372 HydrophobicContact CD1-CG2 4.2Å; L365-T372 PolarHBondContact O-N 2.7Å; L365-T372 PolarHBondContact O-OG1 3.43Å; L365-V376 HydrophobicContact CD1-CG2 4.17Å; L365-V413 HydrophobicContact CD2-CG2 3.99Å; L365-Y422 HydrophobicContact CD1-CD1 4.35Å; L365-Y422 HydrophobicContact CD1-CD2 4.43Å; L365-Y422 HydrophobicContact CD1-CE1 4.24Å; L365-Y422 HydrophobicContact CD1-CE2 4.34Å; L365-Y422 HydrophobicContact CD1-CG 4.46Å; L365-Y422 HydrophobicContact CD2-CD1 4.17Å; L365-Y422 HydrophobicContact CD2-CD2 3.87Å; L365-Y422 HydrophobicContact CD2-CG 3.66Å; L365-Y422 HydrophobicContact CG-CD2 4.2Å; L365-Y422 HydrophobicContact CG-CE2 4.44Å; L365-Y422 HydrophobicContact CG-CG 4.38Å; L365-A449 HydrophobicContact CD1-CB 4.02Å; L365-V451 HydrophobicContact CB-CG1 4.33Å; L365-V451 HydrophobicContact CD2-CG1 4.24Å
366	N	87.7	Confident	87.7	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.053	16%	0.161	C	C	.	.			trans	-139.4	103	-179.4	-68.3	-75.7	0	0	0	112.3	L363 E364 C370 T371 T372 L563	L363-N366 PolarHBondContact O-N 3.15Å; L363-N366 VanDerWaalsContact O-N 3.12Å; E364-N366 PolarHBondContact O-N 2.79Å; N366-C370 CarbonylContact C-O 3.6Å; N366-C370 WeakPolarHBondContact CA-O 3.3Å; N366-T371 WeakPolarHBondContact OD1-CA 3.41Å; N366-T371 PolarHBondContact OD1-OG1 3.47Å; N366-T372 PolarHBondContact ND2-OG1 2.89Å; N366-T372 PolarHBondContact OD1-N 2.82Å; N366-T372 PolarHBondContact OD1-OG1 2.87Å; N366-L563 PolarHBondContact ND2-O 2.71Å
367	S	86.4	Confident	87.8	Confident	52 Å²	52	30.2 Å²	30.2	36%	0.364	15%	0.154	S	C	.	.	S	Bend	trans	-137.5	-169.1	-178.1	73.6	0	0	0	0	111.3	R369 C370	S367-R369 PolarHBondContact O-N 2.81Å; S367-R369 PolarHBondContact OG-N 2.88Å; S367-R369 VanDerWaalsContact OG-N 3.12Å; S367-C370 PolarHBondContact N-O 2.86Å; S367-C370 VanDerWaalsContact O-O 3.1Å; S367-C370 PolarHBondContact OG-N 3.21Å; S367-C370 VanDerWaalsContact OG-N 3.11Å
368	N	85.6	Confident	88.1	Confident	82 Å²	82	31 Å²	31	44%	0.439	16%	0.158	S	C	.	.	S	Bend	trans	-67.3	-26	169.4	-69.4	-9.2	0	0	0	112.3	T462 V463 K562	N368-T462 CarbonylContact O-C 3.56Å; N368-T462 WeakPolarHBondContact O-CA 3.19Å; N368-V463 PolarHBondContact O-N 3.47Å; N368-K562 WeakPolarHBondContact OD1-CE 3.43Å; N368-K562 PolarHBondContact OD1-NZ 3.47Å
369	R	86.4	Confident	88.4	Confident	141 Å²	141	30.6 Å²	30.6	53%	0.532	16%	0.155	S	C	.	.	S	Bend	trans	-101.3	-17.7	-176.5	-61.1	-164.7	172.8	-175.8	-2.7	114.3	S367 Q453 A454 V457	S367-R369 PolarHBondContact O-N 2.81Å; S367-R369 PolarHBondContact OG-N 2.88Å; S367-R369 VanDerWaalsContact OG-N 3.12Å; R369-Q453 CarbonylContact O-C 3.47Å; R369-Q453 WeakPolarHBondContact O-CA 3.39Å; R369-A454 PolarHBondContact O-N 3.24Å; R369-V457 HydrophobicContact CB-CG2 4.34Å; R369-V457 HydrophobicContact CG-CB 4.08Å; R369-V457 HydrophobicContact CG-CG2 3.79Å
370	C	89.1	Confident	88.7	Confident	15 Å²	15	33 Å²	33	10%	0.101	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	145.2	-173.7	-170.7	0	0	0	0	111	N366 S367 V452	N366-C370 CarbonylContact C-O 3.6Å; N366-C370 WeakPolarHBondContact CA-O 3.3Å; S367-C370 PolarHBondContact N-O 2.86Å; S367-C370 VanDerWaalsContact O-O 3.1Å; S367-C370 PolarHBondContact OG-N 3.21Å; S367-C370 VanDerWaalsContact OG-N 3.11Å; C370-V452 CarbonylContact C-O 3.54Å; C370-V452 VanDerWaalsContact CA-O 3.31Å; C370-V452 WeakPolarHBondContact CA-O 3.35Å
371	T	90.6	Very high	89.2	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	140.2	166.8	-170.3	0	0	0	0	112.3	L365 N366 V451 V452 V463 R469	L365-T371 CarbonylContact O-C 3.52Å; L365-T371 WeakPolarHBondContact O-CA 3.43Å; N366-T371 WeakPolarHBondContact OD1-CA 3.41Å; N366-T371 PolarHBondContact OD1-OG1 3.47Å; T371-V451 CarbonylContact O-C 3.57Å; T371-V451 VanDerWaalsContact O-CA 3.28Å; T371-V451 WeakPolarHBondContact O-CA 3.32Å; T371-V452 PolarHBondContact N-O 2.64Å; T371-V452 PolarHBondContact O-N 2.84Å; T371-V463 HydrophobicContact CG2-CG1 3.81Å; T371-R469 PolarHBondContact OG1-NH1 2.96Å
372	T	91.1	Very high	89.4	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.025	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	136.3	179	-24.6	0	0	0	0	111.1	P361 L365 N366 S374 A449 V451 R469	P361-T372 HydrophobicContact CB-CG2 4.29Å; L365-T372 WeakPolarHBondContact CB-OG1 3.31Å; L365-T372 HydrophobicContact CD1-CG2 4.2Å; L365-T372 PolarHBondContact O-N 2.7Å; L365-T372 PolarHBondContact O-OG1 3.43Å; N366-T372 PolarHBondContact ND2-OG1 2.89Å; N366-T372 PolarHBondContact OD1-N 2.82Å; N366-T372 PolarHBondContact OD1-OG1 2.87Å; T372-S374 WeakPolarHBondContact CG2-O 3.43Å; T372-A449 HydrophobicContact CG2-CB 4.11Å; T372-V451 HydrophobicContact CG2-CG1 4.2Å; T372-R469 PolarHBondContact O-NH1 3.37Å; T372-R469 PolarHBondContact O-NH2 3.32Å
373	V	90.4	Very high	89.5	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.012	18%	0.179	C	C	.	.			trans	-122.3	-5.8	-177.6	-59.7	0	0	0	0	114.3	I396 V398 V450 V452	V373-I396 HydrophobicContact CG2-CB 4.36Å; V373-I396 HydrophobicContact CG2-CG2 3.94Å; V373-V398 HydrophobicContact CB-CB 4.35Å; V373-V398 HydrophobicContact CB-CG2 3.76Å; V373-V398 HydrophobicContact CG1-CB 4.08Å; V373-V398 HydrophobicContact CG1-CG1 4.35Å; V373-V398 HydrophobicContact CG1-CG2 3.52Å; V373-V450 HydrophobicContact CG2-CB 3.96Å; V373-V450 HydrophobicContact CG2-CG1 3.7Å; V373-V450 WeakPolarHBondContact CG2-O 3.47Å; V373-V450 PolarHBondContact N-O 2.89Å; V373-V452 HydrophobicContact CG1-CG2 3.86Å; V373-V452 HydrophobicContact CG2-CG2 4.39Å
374	S	91.2	Very high	89.8	Confident	4 Å²	4	33.5 Å²	33.5	3%	0.028	17%	0.171	C	C	.	.	S	Bend	trans	-116.3	170.8	164.9	72.7	0	0	0	0	110.3	T372 V450	T372-S374 WeakPolarHBondContact CG2-O 3.43Å; S374-V450 PolarHBondContact N-O 2.87Å; S374-V450 PolarHBondContact OG-N 3.15Å
375	P	90.9	Very high	89.7	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.026	18%	0.18	C	C	.	.			trans	-63.9	166.3	154.8	31.7	-38.1	0	0	0	110.2	I336 A357 L358 L359 C496	I336-P375 HydrophobicContact CD1-CG 3.61Å; A357-P375 HydrophobicContact CB-CB 4.3Å; A357-P375 HydrophobicContact CB-CG 4.3Å; L358-P375 WeakPolarHBondContact O-CB 3.14Å; L359-P375 HydrophobicContact CD2-CB 4.46Å; P375-C496 HydrophobicContact CB-CB 4.49Å; P375-C496 HydrophobicContact CG-CB 3.82Å
376	V	91.8	Very high	89.6	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.1	168.5	-176.1	0	0	0	0	108.5	L358 P361 L365 A449	L358-V376 HydrophobicContact CB-CB 4.28Å; L358-V376 WeakPolarHBondContact CB-O 3.34Å; L358-V376 PolarHBondContact N-O 3.26Å; L358-V376 PolarHBondContact O-N 2.89Å; P361-V376 HydrophobicContact CB-CG2 4.09Å; L365-V376 HydrophobicContact CD1-CG2 4.17Å; V376-A449 HydrophobicContact CB-CB 4.47Å; V376-A449 HydrophobicContact CG1-CB 4.49Å; V376-A449 HydrophobicContact CG2-CB 4.02Å
377	V	93.6	Very high	89.3	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.3	-178.1	-170.5	0	0	0	0	109.1	I336 M355 I379 I394 Y447 V448	I336-V377 HydrophobicContact CD1-CG2 3.95Å; I336-V377 HydrophobicContact CG2-CG1 4.36Å; I336-V377 HydrophobicContact CG2-CG2 4.03Å; M355-V377 HydrophobicContact CG-CG1 3.5Å; M355-V377 HydrophobicContact SD-CG1 3.79Å; V377-I379 HydrophobicContact CG1-CD1 4.41Å; V377-I379 HydrophobicContact CG1-CG1 3.9Å; V377-I394 HydrophobicContact CG2-CD1 4.1Å; V377-Y447 CarbonylContact O-C 3.57Å; V377-Y447 WeakPolarHBondContact O-CA 3.26Å; V377-V448 PolarHBondContact N-O 2.97Å; V377-V448 PolarHBondContact O-N 3.1Å
378	E	93.8	Very high	89.3	Confident	18 Å²	18	42.1 Å²	42.1	8%	0.084	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.8	166.1	177.2	-169.4	-96.3	0	0	108.5	M355 K356 L358 K380 M446 Y447	M355-E378 CarbonylContact C-O 3.49Å; M355-E378 WeakPolarHBondContact CA-O 3.18Å; K356-E378 HydrophobicContact CB-CB 4.22Å; K356-E378 WeakPolarHBondContact CD-OE2 3.49Å; K356-E378 PolarHBondContact N-O 2.77Å; K356-E378 PolarHBondContact O-N 3.16Å; L358-E378 HydrophobicContact CD1-CB 4.44Å; E378-K380 HydrophobicContact CG-CD 4.33Å; E378-K380 HydrophobicContact CG-CG 4.41Å; E378-K380 WeakPolarHBondContact OE1-CE 3.38Å; E378-K380 IonicContact OE1-NZ 2.94Å; E378-K380 PolarHBondContact OE1-NZ 2.81Å; E378-K380 WeakPolarHBondContact OE2-CE 3.45Å; E378-K380 IonicContact OE2-NZ 3.51Å; E378-K380 PolarHBondContact OE2-NZ 3.08Å; E378-M446 CarbonylContact C-O 3.59Å; E378-M446 WeakPolarHBondContact CA-O 3.46Å; E378-Y447 HydrophobicContact CB-CD1 3.99Å; E378-Y447 HydrophobicContact CB-CE1 3.92Å; E378-Y447 HydrophobicContact CG-CD1 4.28Å; E378-Y447 HydrophobicContact CG-CE1 3.8Å
379	I	94.4	Very high	89.5	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.4	175.6	-56.4	174.9	0	0	0	107.6	V338 I353 M355 V377 L381 L392 L439 C445 M446 V448	V338-I379 HydrophobicContact CG2-CD1 4.05Å; I353-I379 HydrophobicContact CD1-CG2 4.1Å; I353-I379 HydrophobicContact CG1-CG2 4.26Å; M355-I379 HydrophobicContact CG-CG1 4.28Å; V377-I379 HydrophobicContact CG1-CD1 4.41Å; V377-I379 HydrophobicContact CG1-CG1 3.9Å; I379-L381 HydrophobicContact CG2-CD2 4.4Å; I379-L392 HydrophobicContact CD1-CD1 4.35Å; I379-L392 HydrophobicContact CD1-CD2 4.25Å; I379-L439 HydrophobicContact CD1-CD1 4Å; I379-C445 CarbonylContact O-C 3.27Å; I379-C445 WeakPolarHBondContact O-CA 3.38Å; I379-M446 HydrophobicContact CB-CE 4.39Å; I379-M446 HydrophobicContact CG2-CE 4.08Å; I379-M446 PolarHBondContact N-O 3.04Å; I379-M446 PolarHBondContact O-N 2.8Å; I379-V448 HydrophobicContact CD1-CG2 4.47Å
380	K	93.6	Very high	89.8	Confident	72 Å²	72	35.3 Å²	35.3	31%	0.313	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.2	177.2	-75.4	166	-178.6	156.7	0	110.8	I353 S354 E378 P444 C445	I353-K380 WeakPolarHBondContact CA-O 3.5Å; S354-K380 PolarHBondContact N-O 3.06Å; S354-K380 PolarHBondContact O-N 3.47Å; E378-K380 HydrophobicContact CG-CD 4.33Å; E378-K380 HydrophobicContact CG-CG 4.41Å; E378-K380 WeakPolarHBondContact OE1-CE 3.38Å; E378-K380 IonicContact OE1-NZ 2.94Å; E378-K380 PolarHBondContact OE1-NZ 2.81Å; E378-K380 WeakPolarHBondContact OE2-CE 3.45Å; E378-K380 IonicContact OE2-NZ 3.51Å; E378-K380 PolarHBondContact OE2-NZ 3.08Å; K380-P444 VanDerWaalsContact CA-O 3.23Å; K380-P444 WeakPolarHBondContact CA-O 3.16Å; K380-C445 WeakPolarHBondContact CE-SG 3.38Å; K380-C445 HydrophobicContact CG-CB 3.93Å
381	L	92.5	Very high	90	Very high	12 Å²	12	35.5 Å²	35.5	6%	0.063	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.2	-173.4	-63.6	179.7	0	0	0	109.9	I353 I379 M384 L390 L442 P444 M446	I353-L381 HydrophobicContact CB-CD2 4.11Å; I353-L381 HydrophobicContact CD1-CD2 4.07Å; I353-L381 HydrophobicContact CG1-CD2 3.88Å; I379-L381 HydrophobicContact CG2-CD2 4.4Å; L381-M384 HydrophobicContact CB-SD 4.33Å; L381-L390 HydrophobicContact CD1-CD1 4.15Å; L381-L390 HydrophobicContact CD2-CD1 3.95Å; L381-L442 HydrophobicContact CD1-CB 4Å; L381-L442 HydrophobicContact CD1-CD1 4.38Å; L381-L442 HydrophobicContact CD1-CD2 4.07Å; L381-L442 HydrophobicContact CD1-CG 4.38Å; L381-P444 PolarHBondContact N-O 2.93Å; L381-M446 HydrophobicContact CD1-CE 3.62Å; L381-M446 HydrophobicContact CG-CE 4.18Å
382	S	91.3	Very high	90.2	Very high	65 Å²	65	35.5 Å²	35.5	46%	0.455	18%	0.18	S	C	.	.	S	Bend	trans	-96.2	-25.8	-177.4	68.5	0	0	0	0	115.4	Q352	Q352-S382 WeakPolarHBondContact CA-OG 3.28Å; Q352-S382 VanDerWaalsContact CB-OG 3.27Å; Q352-S382 WeakPolarHBondContact CB-OG 3.47Å; Q352-S382 PolarHBondContact N-OG 3.4Å; Q352-S382 PolarHBondContact O-N 3.25Å; Q352-S382 PolarHBondContact O-OG 2.91Å
383	N	86.3	Confident	90.4	Very high	31 Å²	31	38.2 Å²	38.2	17%	0.166	19%	0.192	C	C	.	.			trans	-121	139.6	176.8	-178.1	9.9	0	0	0	108	Q351 E385	Q351-N383 PolarHBondContact NE2-O 2.85Å; Q351-N383 PolarHBondContact OE1-O 3.44Å; N383-E385 PolarHBondContact OD1-N 2.83Å
384	M	88.8	Confident	90.5	Very high	76 Å²	76	38.2 Å²	38.2	37%	0.374	19%	0.192	S	C	.	.			trans	-113.1	-5.4	-177	-56	-49.4	-55.3	0	0	112.4	L381 T386 L442 P444	L381-M384 HydrophobicContact CB-SD 4.33Å; M384-T386 PolarHBondContact O-N 3.28Å; M384-L442 HydrophobicContact CE-CB 4.41Å; M384-L442 WeakPolarHBondContact CE-O 3.33Å; M384-P444 HydrophobicContact CE-CG 4.35Å; M384-P444 HydrophobicContact CG-CG 4.24Å; M384-P444 HydrophobicContact SD-CB 4.3Å; M384-P444 HydrophobicContact SD-CG 3.8Å
385	E	82.9	Confident	90.5	Very high	150 Å²	150	41.8 Å²	41.8	70%	0.701	21%	0.207	S	C	*	.			trans	-79.9	43.8	175	-59.6	-174.2	-172.4	0	0	111.4	N383	N383-E385 PolarHBondContact OD1-N 2.83Å
386	T	83.3	Confident	90.4	Very high	35 Å²	35	41.9 Å²	41.9	22%	0.215	21%	0.207	C	C	.	.			trans	-84.8	133.8	-172.7	53.7	0	0	0	0	111.5	H344 M384 L442	H344-T386 VanDerWaalsContact CE1-CG2 3.48Å; H344-T386 WeakPolarHBondContact CE1-CG2 3.48Å; H344-T386 WeakPolarHBondContact NE2-CG2 3.03Å; H344-T386 WeakPolarHBondContact O-CA 3.37Å; M384-T386 PolarHBondContact O-N 3.28Å; T386-L442 HydrophobicContact CG2-CD1 4.3Å
387	K	81.7	Confident	90	Very high	138 Å²	138	42.8 Å²	42.8	60%	0.6	21%	0.214	S	C	*	.			trans	-96.4	1.7	-172.9	-62.1	173.2	-169.4	165.6	0	114.5	H344 S346	H344-K387 PolarHBondContact O-N 3.43Å; S346-K387 PolarHBondContact OG-NZ 3.4Å
388	S	87.1	Confident	89.6	Confident	34 Å²	34	43.5 Å²	43.5	24%	0.238	22%	0.218	C	C	.	.	S	Bend	trans	-159.6	155.6	-171.3	55.2	0	0	0	0	112.2	P341 H344	P341-S388 VanDerWaalsContact CG-OG 3.3Å; P341-S388 WeakPolarHBondContact CG-OG 3.09Å; H344-S388 VanDerWaalsContact CA-OG 3.32Å; H344-S388 WeakPolarHBondContact CA-OG 3.3Å; H344-S388 WeakPolarHBondContact CB-OG 3.49Å; H344-S388 PolarHBondContact CE1-O 3.3Å; H344-S388 VanDerWaalsContact CE1-O 3.25Å; H344-S388 PolarHBondContact ND1-O 2.83Å; H344-S388 PolarHBondContact ND1-OG 3.17Å; H344-S388 VanDerWaalsContact ND1-OG 3.08Å
389	F	89.9	Confident	89.2	Confident	79 Å²	79	45.1 Å²	45.1	35%	0.346	24%	0.235	S	C	.	.			trans	-67.5	158.9	175.7	61.4	-96.7	0	0	0	112.7	P341 T391 Q438 L439 D440	P341-F389 WeakPolarHBondContact CD-O 3.45Å; F389-T391 WeakPolarHBondContact CE2-OG1 3.42Å; F389-Q438 HydrophobicContact CD2-CB 4.02Å; F389-Q438 HydrophobicContact CD2-CG 3.78Å; F389-Q438 HydrophobicContact CE2-CB 4.49Å; F389-Q438 HydrophobicContact CE2-CG 3.76Å; F389-Q438 HydrophobicContact CG-CB 4.41Å; F389-Q438 HydrophobicContact CZ-CG 4.45Å; F389-L439 WeakPolarHBondContact CA-O 3.41Å; F389-L439 WeakPolarHBondContact CB-O 3.48Å; F389-D440 WeakPolarHBondContact CB-OD1 3.48Å
390	L	92.6	Very high	88.6	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	145.5	168.8	-59.1	-172.2	0	0	0	110.5	V338 I340 H344 I353 L381 Q438 L439 L442	V338-L390 HydrophobicContact CG1-CB 4.07Å; V338-L390 HydrophobicContact CG1-CD1 4.17Å; I340-L390 HydrophobicContact CB-CD2 4.07Å; I340-L390 HydrophobicContact CG1-CD2 3.54Å; I340-L390 HydrophobicContact CG2-CD2 4.04Å; H344-L390 WeakPolarHBondContact CE1-CD2 3.44Å; I353-L390 HydrophobicContact CD1-CD1 4.42Å; L381-L390 HydrophobicContact CD1-CD1 4.15Å; L381-L390 HydrophobicContact CD2-CD1 3.95Å; L390-Q438 CarbonylContact O-C 3.58Å; L390-L439 HydrophobicContact CB-CB 4.3Å; L390-L439 PolarHBondContact N-O 3.23Å; L390-L439 VanDerWaalsContact N-O 3.15Å; L390-L439 PolarHBondContact O-N 2.93Å; L390-L442 HydrophobicContact CB-CD2 4.21Å; L390-L442 HydrophobicContact CD1-CD1 4.41Å; L390-L442 HydrophobicContact CD1-CD2 3.96Å; L390-L442 HydrophobicContact CG-CD1 3.95Å; L390-L442 HydrophobicContact CG-CD2 3.81Å
391	T	93.3	Very high	88.1	Confident	20 Å²	20	47.5 Å²	47.5	12%	0.123	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	111	176.1	-54.7	0	0	0	0	110.3	V338 H339 F389 Q436 V437	V338-T391 WeakPolarHBondContact CA-O 3.32Å; H339-T391 PolarHBondContact N-O 2.86Å; H339-T391 PolarHBondContact O-N 2.92Å; F389-T391 WeakPolarHBondContact CE2-OG1 3.42Å; T391-Q436 HydrophobicContact CG2-CG 3.56Å; T391-V437 CarbonylContact C-O 3.58Å; T391-V437 WeakPolarHBondContact CA-O 3.29Å
392	L	94.3	Very high	87.3	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	131.9	176.4	175.1	64.2	0	0	0	110.1	I336 V338 I379 I394 Q436 V437 L439 V448	I336-L392 HydrophobicContact CG2-CD1 4.23Å; V338-L392 HydrophobicContact CG2-CD1 3.73Å; I379-L392 HydrophobicContact CD1-CD1 4.35Å; I379-L392 HydrophobicContact CD1-CD2 4.25Å; L392-I394 HydrophobicContact CD1-CD1 4.35Å; L392-I394 HydrophobicContact CD1-CG1 4.11Å; L392-I394 HydrophobicContact CD2-CD1 3.86Å; L392-I394 HydrophobicContact CD2-CG1 4.4Å; L392-I394 HydrophobicContact CG-CD1 4.1Å; L392-I394 HydrophobicContact CG-CG1 4.08Å; L392-Q436 CarbonylContact O-C 3.51Å; L392-Q436 WeakPolarHBondContact O-CA 3.48Å; L392-V437 PolarHBondContact N-O 3.44Å; L392-V437 PolarHBondContact O-N 2.61Å; L392-L439 HydrophobicContact CB-CD1 4.03Å; L392-L439 HydrophobicContact CB-CG 4.39Å; L392-L439 HydrophobicContact CD2-CD1 4.46Å; L392-V448 HydrophobicContact CD2-CB 3.82Å; L392-V448 HydrophobicContact CD2-CG1 3.48Å; L392-V448 VanDerWaalsContact CD2-CG1 3.48Å; L392-V448 HydrophobicContact CD2-CG2 4.37Å
393	E	94.3	Very high	86.3	Confident	60 Å²	60	62 Å²	62	28%	0.28	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	123.1	176.8	-172	-174.7	168.9	0	0	109.2	I336 S337 H339 T434 V435	I336-E393 WeakPolarHBondContact CA-O 3.25Å; S337-E393 PolarHBondContact N-O 2.93Å; S337-E393 PolarHBondContact O-N 2.67Å; H339-E393 IonicContact CD2-OE2 2.88Å; H339-E393 IonicContact CE1-OE2 2.85Å; H339-E393 IonicContact NE2-OE2 3.28Å; H339-E393 PolarHBondContact NE2-OE2 2.83Å; E393-T434 HydrophobicContact CG-CG2 3.5Å; E393-V435 WeakPolarHBondContact CA-O 3.37Å
394	I	93.6	Very high	85.4	Confident	3 Å²	3	61.2 Å²	61.2	2%	0.015	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	127.2	180	-67.5	173.7	0	0	0	109.4	I336 V377 L392 I396 V435 V450	I336-I394 HydrophobicContact CG1-CG1 4.34Å; I336-I394 HydrophobicContact CG2-CG1 4.19Å; V377-I394 HydrophobicContact CG2-CD1 4.1Å; L392-I394 HydrophobicContact CD1-CD1 4.35Å; L392-I394 HydrophobicContact CD1-CG1 4.11Å; L392-I394 HydrophobicContact CD2-CD1 3.86Å; L392-I394 HydrophobicContact CD2-CG1 4.4Å; L392-I394 HydrophobicContact CG-CD1 4.1Å; L392-I394 HydrophobicContact CG-CG1 4.08Å; I394-I396 HydrophobicContact CG2-CG2 4.25Å; I394-V435 PolarHBondContact N-O 2.81Å; I394-V435 PolarHBondContact O-N 2.91Å; I394-V450 HydrophobicContact CB-CG2 4.17Å; I394-V450 HydrophobicContact CD1-CG2 4.04Å; I394-V450 HydrophobicContact CG2-CG2 3.95Å
395	K	90.3	Very high	84.2	Confident	79 Å²	79	60.8 Å²	60.8	34%	0.343	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	127.6	168.9	-159.4	175.5	-175.8	168.8	0	112.1	H335 D433	H335-K395 HydrophobicContact CB-CB 3.43Å; H335-K395 VanDerWaalsContact CB-CB 3.43Å; H335-K395 HydrophobicContact CB-CD 4.08Å; H335-K395 HydrophobicContact CB-CG 4.35Å; H335-K395 PolarHBondContact O-N 2.88Å; K395-D433 CarbonylContact C-O 3.58Å; K395-D433 WeakPolarHBondContact CA-O 3.22Å; K395-D433 WeakPolarHBondContact CE-OD2 3.36Å; K395-D433 VanDerWaalsContact CG-O 3.28Å; K395-D433 WeakPolarHBondContact CG-O 3.16Å; K395-D433 IonicContact NZ-OD2 2.68Å; K395-D433 PolarHBondContact NZ-OD2 2.85Å
396	I	89.8	Confident	83.5	Confident	5 Å²	5	61.1 Å²	61.1	3%	0.026	31%	0.308	C	S	.	.			trans	-106.2	161.7	178.1	59.9	169.5	0	0	0	111.9	V373 I394 V410 D433 V435 V450	V373-I396 HydrophobicContact CG2-CB 4.36Å; V373-I396 HydrophobicContact CG2-CG2 3.94Å; I394-I396 HydrophobicContact CG2-CG2 4.25Å; I396-V410 HydrophobicContact CD1-CG1 3.94Å; I396-V410 HydrophobicContact CD1-CG2 4.5Å; I396-D433 WeakPolarHBondContact CG1-O 3.09Å; I396-D433 PolarHBondContact N-O 2.82Å; I396-V435 HydrophobicContact CD1-CG2 3.87Å; I396-V435 HydrophobicContact CG1-CG2 4.19Å; I396-V435 HydrophobicContact CG2-CG2 4.19Å; I396-V450 HydrophobicContact CG2-CB 3.97Å; I396-V450 HydrophobicContact CG2-CG1 3.93Å; I396-V450 HydrophobicContact CG2-CG2 4.17Å
397	S	83.4	Confident	83.1	Confident	20 Å²	20	60.5 Å²	60.5	14%	0.14	31%	0.306	C	S	.	.			trans	-122.9	36.2	-178.1	-64.6	0	0	0	0	112.7	K470	S397-K470 WeakPolarHBondContact O-CB 3.33Å; S397-K470 PolarHBondContact O-N 3.06Å
398	V	85.8	Confident	83.2	Confident	15 Å²	15	54 Å²	54	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	140.2	-177.4	-177	0	0	0	0	109.3	V373 V452 V467 Q468 R469	V373-V398 HydrophobicContact CB-CB 4.35Å; V373-V398 HydrophobicContact CB-CG2 3.76Å; V373-V398 HydrophobicContact CG1-CB 4.08Å; V373-V398 HydrophobicContact CG1-CG1 4.35Å; V373-V398 HydrophobicContact CG1-CG2 3.52Å; V398-V452 HydrophobicContact CG1-CG2 4.39Å; V398-V467 HydrophobicContact CG1-CB 3.74Å; V398-V467 HydrophobicContact CG1-CG1 4.03Å; V398-V467 HydrophobicContact CG1-CG2 4.23Å; V398-Q468 WeakPolarHBondContact CA-O 3.26Å; V398-R469 HydrophobicContact CG1-CB 4.41Å; V398-R469 HydrophobicContact CG2-CB 4.01Å; V398-R469 HydrophobicContact CG2-CG 3.78Å
399	A	83.4	Confident	83.2	Confident	53 Å²	53	55.3 Å²	55.3	44%	0.438	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	138.7	168.8	0	0	0	0	0	109.6	V467 Q468	A399-V467 CarbonylContact O-C 3.6Å; A399-V467 WeakPolarHBondContact O-CA 3.49Å; A399-Q468 PolarHBondContact N-O 3.33Å; A399-Q468 PolarHBondContact O-N 3.19Å
400	V	83.8	Confident	83.2	Confident	43 Å²	43	52.7 Å²	52.7	26%	0.261	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	138.1	168.9	-177.8	0	0	0	0	108.6	A408 V410 V467	V400-A408 WeakPolarHBondContact CG1-O 3.46Å; V400-V410 HydrophobicContact CG2-CG2 4Å; V400-V467 HydrophobicContact CG2-CG1 4.47Å
401	K	83.1	Confident	83.1	Confident	78 Å²	78	55.2 Å²	55.2	34%	0.339	29%	0.286	S	S	.	.			trans	-66.3	138.8	177.5	-64.2	178.1	-169.4	173	0	109.2	E403 S404 C405 D465 H466 V467	K401-E403 PolarHBondContact O-N 3.47Å; K401-E403 VanDerWaalsContact O-N 3.16Å; K401-S404 CarbonylContact O-C 3.57Å; K401-S404 WeakPolarHBondContact O-CA 3.48Å; K401-S404 PolarHBondContact O-N 2.89Å; K401-C405 PolarHBondContact O-N 2.99Å; K401-D465 WeakPolarHBondContact CD-O 3.24Å; K401-D465 VanDerWaalsContact CE-O 3.3Å; K401-D465 WeakPolarHBondContact CE-O 3.33Å; K401-D465 PolarHBondContact NZ-O 3.4Å; K401-H466 PolarHBondContact N-O 3.5Å; K401-V467 WeakPolarHBondContact CE-O 3.4Å
402	K	74.3	Confident	83.1	Confident	195 Å²	195	54.3 Å²	54.3	85%	0.848	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-56.2	-35	-177.3	-69.8	-174.4	177.5	-177.6	0	113.3	S404 C405	K402-S404 PolarHBondContact O-N 2.86Å; K402-C405 PolarHBondContact O-SG 2.97Å; K402-C405 VanDerWaalsContact O-SG 3.36Å
403	E	70.3	Confident	83.1	Confident	187 Å²	187	54.7 Å²	54.7	87%	0.874	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-73.5	-8.2	176.9	-67.1	142.9	-146.8	0	0	113.7	K401	K401-E403 PolarHBondContact O-N 3.47Å; K401-E403 VanDerWaalsContact O-N 3.16Å
404	S	67.6	Low	83	Confident	15 Å²	15	53 Å²	53	11%	0.105	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-123	15.7	-175.2	-64.3	0	0	0	0	113.5	K401 K402 H406 A407 A408 H466	K401-S404 CarbonylContact O-C 3.57Å; K401-S404 WeakPolarHBondContact O-CA 3.48Å; K401-S404 PolarHBondContact O-N 2.89Å; K402-S404 PolarHBondContact O-N 2.86Å; S404-H406 PolarHBondContact O-N 3Å; S404-H406 VanDerWaalsContact O-N 3.09Å; S404-A407 PolarHBondContact O-N 2.77Å; S404-A408 PolarHBondContact O-N 2.89Å; S404-H466 WeakPolarHBondContact CB-ND1 3.48Å; S404-H466 PolarHBondContact OG-ND1 2.77Å
405	C	63.6	Low	83	Confident	66 Å²	66	53.2 Å²	53.2	45%	0.446	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-11.4	179.3	60.4	0	0	0	0	115.1	K401 K402	K401-C405 PolarHBondContact O-N 2.99Å; K402-C405 PolarHBondContact O-SG 2.97Å; K402-C405 VanDerWaalsContact O-SG 3.36Å
406	H	67.6	Low	83	Confident	158 Å²	158	53.3 Å²	53.3	73%	0.731	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111	4.4	172.4	-56.6	-47.7	0	0	0	112.8	S404	S404-H406 PolarHBondContact O-N 3Å; S404-H406 VanDerWaalsContact O-N 3.09Å
407	A	76.3	Confident	83	Confident	22 Å²	22	56.8 Å²	56.8	18%	0.182	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-29	-176.5	0	0	0	0	0	112.9	S404 A454 Q455	S404-A407 PolarHBondContact O-N 2.77Å; A407-A454 CarbonylContact O-C 3.55Å; A407-A454 VanDerWaalsContact O-CA 3.24Å; A407-A454 WeakPolarHBondContact O-CA 3.43Å; A407-Q455 PolarHBondContact O-N 2.87Å
408	A	83.9	Confident	83.1	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.017	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	133.1	177.5	0	0	0	0	0	113.5	V400 S404 V452 Q453 A454 H466	V400-A408 WeakPolarHBondContact CG1-O 3.46Å; S404-A408 PolarHBondContact O-N 2.89Å; A408-V452 HydrophobicContact CB-CG1 3.97Å; A408-Q453 CarbonylContact C-O 3.54Å; A408-Q453 VanDerWaalsContact CA-O 3.29Å; A408-Q453 WeakPolarHBondContact CA-O 3.27Å; A408-A454 HydrophobicContact CB-CB 4.19Å; A408-H466 HydrophobicContact CB-CB 3.79Å
409	D	86.5	Confident	83.2	Confident	60 Å²	60	64.8 Å²	64.8	32%	0.321	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	146.3	-177.7	-63.1	-58.6	0	0	0	111.8	L411 V452 Q453 Q455	D409-L411 HydrophobicContact CB-CD2 4.3Å; D409-L411 HydrophobicContact CB-CG 4.37Å; D409-V452 CarbonylContact O-C 3.55Å; D409-V452 VanDerWaalsContact O-CA 3.31Å; D409-V452 WeakPolarHBondContact O-CA 3.44Å; D409-V452 WeakPolarHBondContact O-CG1 3.41Å; D409-Q453 PolarHBondContact N-O 2.83Å; D409-Q453 PolarHBondContact O-N 3.17Å; D409-Q455 PolarHBondContact OD2-NE2 2.84Å
410	V	90	Very high	83.4	Confident	24 Å²	24	63 Å²	63	15%	0.145	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124.1	166	-173.3	0	0	0	0	107.6	I396 V400 I430 V435 V450 V452	I396-V410 HydrophobicContact CD1-CG1 3.94Å; I396-V410 HydrophobicContact CD1-CG2 4.5Å; V400-V410 HydrophobicContact CG2-CG2 4Å; V410-I430 HydrophobicContact CB-CD1 3.99Å; V410-I430 HydrophobicContact CG1-CD1 4.43Å; V410-I430 WeakPolarHBondContact O-CD1 3.24Å; V410-V435 HydrophobicContact CG1-CG2 4.21Å; V410-V450 HydrophobicContact CG1-CG1 3.52Å; V410-V452 HydrophobicContact CG2-CG2 4.16Å
411	L	91.1	Very high	83.7	Confident	53 Å²	53	65.6 Å²	65.6	28%	0.277	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.5	179.9	-61.2	176.6	0	0	0	110.1	D409 V450 V451 Q453	D409-L411 HydrophobicContact CB-CD2 4.3Å; D409-L411 HydrophobicContact CB-CG 4.37Å; L411-V450 WeakPolarHBondContact O-CA 3.34Å; L411-V450 WeakPolarHBondContact O-CG1 3.33Å; L411-V451 HydrophobicContact CB-CG2 4.05Å; L411-V451 PolarHBondContact N-O 2.83Å; L411-V451 PolarHBondContact O-N 3.47Å; L411-V451 VanDerWaalsContact O-O 3.12Å; L411-Q453 HydrophobicContact CD1-CB 3.94Å
412	C	93.1	Very high	84.1	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.014	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	132.8	164.7	-163.1	0	0	0	0	109.2	P424 I425 A428 V437 V448 A449	C412-P424 WeakPolarHBondContact O-CA 3.1Å; C412-I425 HydrophobicContact CB-CD1 4.43Å; C412-I425 PolarHBondContact O-N 2.79Å; C412-A428 HydrophobicContact CB-CB 4.24Å; C412-V437 HydrophobicContact CB-CG1 4.43Å; C412-V437 HydrophobicContact CB-CG2 3.68Å; C412-V448 WeakPolarHBondContact SG-CG1 3.4Å; C412-A449 WeakPolarHBondContact CA-O 3.28Å; C412-A449 PolarHBondContact SG-O 2.93Å; C412-A449 VanDerWaalsContact SG-O 3.41Å
413	V	93.1	Very high	85	Confident	8 Å²	8	57.8 Å²	57.8	5%	0.048	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.7	-177.8	-64.9	0	0	0	0	110.9	L365 Y422 T423 V448 A449 V451	L365-V413 HydrophobicContact CD2-CG2 3.99Å; V413-Y422 HydrophobicContact CB-CD1 4.36Å; V413-Y422 HydrophobicContact CG2-CD1 3.98Å; V413-T423 CarbonylContact C-O 3.53Å; V413-T423 WeakPolarHBondContact CA-O 3.2Å; V413-V448 WeakPolarHBondContact O-CA 3.46Å; V413-A449 HydrophobicContact CG2-CB 4.21Å; V413-A449 WeakPolarHBondContact CG2-O 3.15Å; V413-A449 PolarHBondContact N-O 3.33Å; V413-A449 PolarHBondContact O-N 2.79Å; V413-V451 HydrophobicContact CG1-CG2 3.87Å; V413-V451 HydrophobicContact CG2-CG1 3.94Å; V413-V451 HydrophobicContact CG2-CG2 4.3Å
414	R	93.1	Very high	86	Confident	25 Å²	25	52.9 Å²	52.9	9%	0.094	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	146.8	179.5	169.4	-179.9	173.9	159.9	-7.2	110.6	D416 Y422 T423 I425 S441 M446 Y447	R414-D416 IonicContact CZ-OD1 3.6Å; R414-D416 IonicContact NE-OD1 2.78Å; R414-D416 PolarHBondContact NE-OD1 3.45Å; R414-D416 IonicContact NH2-OD1 3.95Å; R414-D416 PolarHBondContact NH2-OD1 2.78Å; R414-Y422 VanDerWaalsContact C-CD1 3.47Å; R414-Y422 CarbonylContact O-C 3.57Å; R414-Y422 VanDerWaalsContact O-CA 3.28Å; R414-Y422 WeakPolarHBondContact O-CA 3.34Å; R414-T423 PolarHBondContact N-O 2.99Å; R414-T423 PolarHBondContact O-N 2.83Å; R414-T423 PolarHBondContact O-OG1 3.28Å; R414-I425 HydrophobicContact CB-CD1 3.96Å; R414-I425 HydrophobicContact CB-CG1 3.88Å; R414-S441 PolarHBondContact NH1-O 2.94Å; R414-S441 PolarHBondContact NH2-O 2.96Å; R414-M446 PolarHBondContact NH1-SD 3.02Å; R414-Y447 CarbonylContact C-O 3.55Å; R414-Y447 VanDerWaalsContact CA-O 3.3Å; R414-Y447 WeakPolarHBondContact CA-O 3.33Å
415	S	93.3	Very high	87	Confident	7 Å²	7	53.5 Å²	53.5	5%	0.049	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.5	152.7	-166	0	0	0	0	109.9	C417 P421 Y447	S415-C417 VanDerWaalsContact C-N 3.33Å; S415-C417 VanDerWaalsContact CB-O 3.27Å; S415-C417 WeakPolarHBondContact CB-O 3.41Å; S415-C417 PolarHBondContact OG-N 2.86Å; S415-C417 PolarHBondContact OG-O 2.8Å; S415-P421 WeakPolarHBondContact CB-O 3.39Å; S415-P421 PolarHBondContact OG-O 3.2Å; S415-Y447 PolarHBondContact N-O 3.18Å; S415-Y447 PolarHBondContact O-N 2.95Å
416	D	90.4	Very high	87.7	Confident	82 Å²	82	54.7 Å²	54.7	44%	0.439	31%	0.307	S	S	.	.	S	Bend	trans	-90.2	-9	170.3	-46.4	-55.5	0	0	0	110.8	R414 Y447	R414-D416 IonicContact CZ-OD1 3.6Å; R414-D416 IonicContact NE-OD1 2.78Å; R414-D416 PolarHBondContact NE-OD1 3.45Å; R414-D416 IonicContact NH2-OD1 3.95Å; R414-D416 PolarHBondContact NH2-OD1 2.78Å; D416-Y447 WeakPolarHBondContact O-CE2 3.22Å
417	C	88.7	Confident	88	Confident	78 Å²	78	53.6 Å²	53.6	53%	0.527	31%	0.307	S	S	.	.	S	Bend	trans	-116.4	137.3	175.7	-79.5	0	0	0	0	111.2	S415 E419 G420 Y447	S415-C417 VanDerWaalsContact C-N 3.33Å; S415-C417 VanDerWaalsContact CB-O 3.27Å; S415-C417 WeakPolarHBondContact CB-O 3.41Å; S415-C417 PolarHBondContact OG-N 2.86Å; S415-C417 PolarHBondContact OG-O 2.8Å; C417-E419 VanDerWaalsContact C-N 3.31Å; C417-E419 PolarHBondContact O-N 2.73Å; C417-G420 VanDerWaalsContact CB-O 3.24Å; C417-G420 WeakPolarHBondContact CB-O 3.41Å; C417-G420 PolarHBondContact O-N 3.12Å; C417-G420 VanDerWaalsContact O-N 3.12Å; C417-Y447 VanDerWaalsContact C-CD2 3.49Å
418	K	86.9	Confident	88.3	Confident	85 Å²	85	53.9 Å²	53.9	37%	0.37	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-43.7	-174.7	179.8	177.2	171	-77.9	0	113.4	L358 P362 Y422 Y447	L358-K418 HydrophobicContact CD1-CD 4.15Å; L358-K418 HydrophobicContact CD1-CG 4.18Å; P362-K418 WeakPolarHBondContact CG-O 3.2Å; K418-Y422 PolarHBondContact O-OH 2.9Å; K418-Y447 HydrophobicContact CB-CD1 4.21Å; K418-Y447 HydrophobicContact CB-CE1 3.75Å; K418-Y447 HydrophobicContact CB-CE2 4.23Å; K418-Y447 HydrophobicContact CG-CD1 4.4Å; K418-Y447 HydrophobicContact CG-CE1 4.11Å; K418-Y447 VanDerWaalsContact N-CE2 3.34Å
419	E	87.3	Confident	88.4	Confident	117 Å²	117	60.6 Å²	60.6	55%	0.547	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	4.1	-174.9	-50.1	-53.6	149.7	0	0	113.9	C417	C417-E419 VanDerWaalsContact C-N 3.31Å; C417-E419 PolarHBondContact O-N 2.73Å
420	G	87.2	Confident	88.2	Confident	16 Å²	16	61.2 Å²	61.2	17%	0.165	34%	0.338	C	S	.	.			trans	105.1	-176.3	-176.3	0	0	0	0	0	113.9	C417 Y422	C417-G420 VanDerWaalsContact CB-O 3.24Å; C417-G420 WeakPolarHBondContact CB-O 3.41Å; C417-G420 PolarHBondContact O-N 3.12Å; C417-G420 VanDerWaalsContact O-N 3.12Å; G420-Y422 VanDerWaalsContact CA-CD2 3.47Å
421	P	90.3	Very high	87.8	Confident	97 Å²	97	65.2 Å²	65.2	63%	0.63	35%	0.353	S	S	*	.			cis	-73.4	143.4	4.7	30.6	-35.8	0	0	0	112.5	E364 S415	E364-P421 WeakPolarHBondContact OE2-CA 3.42Å; S415-P421 WeakPolarHBondContact CB-O 3.39Å; S415-P421 PolarHBondContact OG-O 3.2Å
422	Y	91.9	Very high	87.3	Confident	26 Å²	26	70.8 Å²	70.8	10%	0.102	38%	0.375	C	S	.	.			trans	-96.6	130.6	177.4	-77.3	-96.9	0	0	0	113.2	P362 E364 L365 V413 R414 K418 G420 Y447	P362-Y422 HydrophobicContact CB-CE2 4.32Å; P362-Y422 HydrophobicContact CG-CE2 3.9Å; E364-Y422 WeakPolarHBondContact OE2-CD2 3.4Å; E364-Y422 PolarHBondContact OE2-N 2.74Å; L365-Y422 HydrophobicContact CD1-CD1 4.35Å; L365-Y422 HydrophobicContact CD1-CD2 4.43Å; L365-Y422 HydrophobicContact CD1-CE1 4.24Å; L365-Y422 HydrophobicContact CD1-CE2 4.34Å; L365-Y422 HydrophobicContact CD1-CG 4.46Å; L365-Y422 HydrophobicContact CD2-CD1 4.17Å; L365-Y422 HydrophobicContact CD2-CD2 3.87Å; L365-Y422 HydrophobicContact CD2-CG 3.66Å; L365-Y422 HydrophobicContact CG-CD2 4.2Å; L365-Y422 HydrophobicContact CG-CE2 4.44Å; L365-Y422 HydrophobicContact CG-CG 4.38Å; V413-Y422 HydrophobicContact CB-CD1 4.36Å; V413-Y422 HydrophobicContact CG2-CD1 3.98Å; R414-Y422 VanDerWaalsContact C-CD1 3.47Å; R414-Y422 CarbonylContact O-C 3.57Å; R414-Y422 VanDerWaalsContact O-CA 3.28Å; R414-Y422 WeakPolarHBondContact O-CA 3.34Å; K418-Y422 PolarHBondContact O-OH 2.9Å; G420-Y422 VanDerWaalsContact CA-CD2 3.47Å; Y422-Y447 WeakPolarHBondContact OH-CB 3.39Å
423	T	92.3	Very high	86.9	Confident	84 Å²	84	74 Å²	74	52%	0.515	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146	178.1	57.3	0	0	0	0	111.7	V413 R414	V413-T423 CarbonylContact C-O 3.53Å; V413-T423 WeakPolarHBondContact CA-O 3.2Å; R414-T423 PolarHBondContact N-O 2.99Å; R414-T423 PolarHBondContact O-N 2.83Å; R414-T423 PolarHBondContact O-OG1 3.28Å
424	P	91.4	Very high	86.8	Confident	84 Å²	84	75.2 Å²	75.2	55%	0.545	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	137.2	177.5	30.3	-34.3	0	0	0	111.6	C412	C412-P424 WeakPolarHBondContact O-CA 3.1Å
425	I	90.1	Very high	86.8	Confident	27 Å²	27	74.1 Å²	74.1	14%	0.138	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-85.7	126.8	176.3	-47	175.3	0	0	0	108.5	C412 R414 V437 L439 V448	C412-I425 HydrophobicContact CB-CD1 4.43Å; C412-I425 PolarHBondContact O-N 2.79Å; R414-I425 HydrophobicContact CB-CD1 3.96Å; R414-I425 HydrophobicContact CB-CG1 3.88Å; I425-V437 HydrophobicContact CB-CG1 3.96Å; I425-V437 HydrophobicContact CD1-CG1 4.06Å; I425-V437 HydrophobicContact CG2-CG1 3.61Å; I425-L439 HydrophobicContact CD1-CD2 3.79Å; I425-V448 HydrophobicContact CD1-CG1 3.91Å
426	P	78.1	Confident	86.8	Confident	92 Å²	92	77.5 Å²	77.5	60%	0.597	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	158	175	28.3	-34.9	0	0	0	111.6	A428	P426-A428 VanDerWaalsContact C-N 3.33Å; P426-A428 PolarHBondContact O-N 2.69Å
427	N	72.8	Confident	86.9	Confident	135 Å²	135	73.8 Å²	73.8	72%	0.722	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	31.9	172	-53.2	-28.2	0	0	0	116	Y429	N427-Y429 PolarHBondContact O-N 3.38Å
428	A	82.3	Confident	87.1	Confident	28 Å²	28	74 Å²	74	23%	0.231	38%	0.384	C	S	.	.			trans	-65.5	113.5	167.8	0	0	0	0	0	111.1	C412 P426 V437	C412-A428 HydrophobicContact CB-CB 4.24Å; P426-A428 VanDerWaalsContact C-N 3.33Å; P426-A428 PolarHBondContact O-N 2.69Å; A428-V437 HydrophobicContact CB-CG1 4.31Å; A428-V437 HydrophobicContact CB-CG2 3.85Å
429	Y	86.1	Confident	87.3	Confident	142 Å²	142	70 Å²	70	56%	0.557	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	129.2	175.1	-178.6	-109.5	0	0	0	110.4	N427 F431 Q436	N427-Y429 PolarHBondContact O-N 3.38Å; Y429-F431 HydrophobicContact CE1-CB 3.74Å; Y429-Q436 PolarHBondContact N-O 2.71Å; Y429-Q436 PolarHBondContact O-N 2.82Å
430	I	83.5	Confident	87.1	Confident	73 Å²	73	69.2 Å²	69.2	37%	0.374	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	117.8	-175	-60.5	148.6	0	0	0	108.6	V410 V435	V410-I430 HydrophobicContact CB-CD1 3.99Å; V410-I430 HydrophobicContact CG1-CD1 4.43Å; V410-I430 WeakPolarHBondContact O-CD1 3.24Å; I430-V435 HydrophobicContact CG1-CG1 4.11Å; I430-V435 HydrophobicContact CG1-CG2 4.16Å; I430-V435 HydrophobicContact CG2-CG2 4.41Å
431	F	80.7	Confident	86.9	Confident	108 Å²	108	72.7 Å²	72.7	47%	0.474	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	110.7	178.8	-175.8	-101	0	0	0	111	Y429 D433 T434	Y429-F431 HydrophobicContact CE1-CB 3.74Å; F431-D433 PolarHBondContact O-N 3.01Å; F431-T434 PolarHBondContact N-O 2.78Å; F431-T434 PolarHBondContact O-N 2.76Å
432	K	80.1	Confident	86.8	Confident	170 Å²	170	69 Å²	69	74%	0.739	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	-97.4	-176.4	-58.2	175	-178.3	173.8	0	112.5
433	D	86	Confident	86.6	Confident	69 Å²	69	72.2 Å²	72.2	37%	0.369	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	4.8	-177.3	53.7	-14.9	0	0	0	112.9	K395 I396 F431	K395-D433 CarbonylContact C-O 3.58Å; K395-D433 WeakPolarHBondContact CA-O 3.22Å; K395-D433 WeakPolarHBondContact CE-OD2 3.36Å; K395-D433 VanDerWaalsContact CG-O 3.28Å; K395-D433 WeakPolarHBondContact CG-O 3.16Å; K395-D433 IonicContact NZ-OD2 2.68Å; K395-D433 PolarHBondContact NZ-OD2 2.85Å; I396-D433 WeakPolarHBondContact CG1-O 3.09Å; I396-D433 PolarHBondContact N-O 2.82Å; F431-D433 PolarHBondContact O-N 3.01Å
434	T	90.7	Very high	86.5	Confident	35 Å²	35	71.3 Å²	71.3	22%	0.215	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.5	173.7	-64.1	0	0	0	0	111.1	E393 F431	E393-T434 HydrophobicContact CG-CG2 3.5Å; F431-T434 PolarHBondContact N-O 2.78Å; F431-T434 PolarHBondContact O-N 2.76Å
435	V	92.8	Very high	86.5	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	127.6	170.7	-175.5	0	0	0	0	108.4	E393 I394 I396 V410 I430 V437 V450	E393-V435 WeakPolarHBondContact CA-O 3.37Å; I394-V435 PolarHBondContact N-O 2.81Å; I394-V435 PolarHBondContact O-N 2.91Å; I396-V435 HydrophobicContact CD1-CG2 3.87Å; I396-V435 HydrophobicContact CG1-CG2 4.19Å; I396-V435 HydrophobicContact CG2-CG2 4.19Å; V410-V435 HydrophobicContact CG1-CG2 4.21Å; I430-V435 HydrophobicContact CG1-CG1 4.11Å; I430-V435 HydrophobicContact CG1-CG2 4.16Å; I430-V435 HydrophobicContact CG2-CG2 4.41Å; V435-V437 HydrophobicContact CG1-CG2 3.89Å; V435-V450 HydrophobicContact CB-CG2 4.27Å; V435-V450 HydrophobicContact CG1-CG2 4.32Å; V435-V450 HydrophobicContact CG2-CG1 4.13Å; V435-V450 HydrophobicContact CG2-CG2 4.46Å
436	Q	93.4	Very high	86.7	Confident	78 Å²	78	67.4 Å²	67.4	36%	0.364	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	128	-177.3	-171.8	179.6	17	0	0	109.4	T391 L392 Y429	T391-Q436 HydrophobicContact CG2-CG 3.56Å; L392-Q436 CarbonylContact O-C 3.51Å; L392-Q436 WeakPolarHBondContact O-CA 3.48Å; Y429-Q436 PolarHBondContact N-O 2.71Å; Y429-Q436 PolarHBondContact O-N 2.82Å
437	V	93.6	Very high	87.4	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.024	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.8	-168.6	-165.2	0	0	0	0	110.8	T391 L392 C412 I425 A428 V435	T391-V437 CarbonylContact C-O 3.58Å; T391-V437 WeakPolarHBondContact CA-O 3.29Å; L392-V437 PolarHBondContact N-O 3.44Å; L392-V437 PolarHBondContact O-N 2.61Å; C412-V437 HydrophobicContact CB-CG1 4.43Å; C412-V437 HydrophobicContact CB-CG2 3.68Å; I425-V437 HydrophobicContact CB-CG1 3.96Å; I425-V437 HydrophobicContact CD1-CG1 4.06Å; I425-V437 HydrophobicContact CG2-CG1 3.61Å; A428-V437 HydrophobicContact CB-CG1 4.31Å; A428-V437 HydrophobicContact CB-CG2 3.85Å; V435-V437 HydrophobicContact CG1-CG2 3.89Å
438	Q	92.2	Very high	88.5	Confident	81 Å²	81	57.9 Å²	57.9	38%	0.379	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	133.4	173.4	-66.7	175.5	-28.8	0	0	109.8	F389 L390	F389-Q438 HydrophobicContact CD2-CB 4.02Å; F389-Q438 HydrophobicContact CD2-CG 3.78Å; F389-Q438 HydrophobicContact CE2-CB 4.49Å; F389-Q438 HydrophobicContact CE2-CG 3.76Å; F389-Q438 HydrophobicContact CG-CB 4.41Å; F389-Q438 HydrophobicContact CZ-CG 4.45Å; L390-Q438 CarbonylContact O-C 3.58Å
439	L	90.6	Very high	89	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	92.9	180	-58.3	-180	0	0	0	107.7	I379 F389 L390 L392 I425 L442 V448	I379-L439 HydrophobicContact CD1-CD1 4Å; F389-L439 WeakPolarHBondContact CA-O 3.41Å; F389-L439 WeakPolarHBondContact CB-O 3.48Å; L390-L439 HydrophobicContact CB-CB 4.3Å; L390-L439 PolarHBondContact N-O 3.23Å; L390-L439 VanDerWaalsContact N-O 3.15Å; L390-L439 PolarHBondContact O-N 2.93Å; L392-L439 HydrophobicContact CB-CD1 4.03Å; L392-L439 HydrophobicContact CB-CG 4.39Å; L392-L439 HydrophobicContact CD2-CD1 4.46Å; I425-L439 HydrophobicContact CD1-CD2 3.79Å; L439-L442 HydrophobicContact CB-CD2 3.93Å; L439-L442 WeakPolarHBondContact O-CD2 3.35Å; L439-V448 HydrophobicContact CD2-CG2 4.39Å
440	D	83.9	Confident	89.3	Confident	100 Å²	100	49.9 Å²	49.9	54%	0.535	26%	0.257	S	S	.	.			trans	-87.1	-46.6	-173.3	-55.3	-24.4	0	0	0	111.9	F389 L442	F389-D440 WeakPolarHBondContact CB-OD1 3.48Å; D440-L442 VanDerWaalsContact C-N 3.26Å; D440-L442 PolarHBondContact O-N 3.24Å
441	S	82.8	Confident	89.8	Confident	90 Å²	90	46.4 Å²	46.4	63%	0.629	24%	0.239	S	C	*	.	S	Bend	trans	-81.7	57.6	-175.9	-46.4	0	0	0	0	112.5	R414 E443	R414-S441 PolarHBondContact NH1-O 2.94Å; R414-S441 PolarHBondContact NH2-O 2.96Å; S441-E443 PolarHBondContact O-N 3.39Å
442	L	87.4	Confident	90.3	Very high	19 Å²	19	41.3 Å²	41.3	10%	0.099	22%	0.217	C	C	.	.			trans	-58.6	133.8	-171.1	-61	175.7	0	0	0	112.9	L381 M384 T386 L390 L439 D440 M446	L381-L442 HydrophobicContact CD1-CB 4Å; L381-L442 HydrophobicContact CD1-CD1 4.38Å; L381-L442 HydrophobicContact CD1-CD2 4.07Å; L381-L442 HydrophobicContact CD1-CG 4.38Å; M384-L442 HydrophobicContact CE-CB 4.41Å; M384-L442 WeakPolarHBondContact CE-O 3.33Å; T386-L442 HydrophobicContact CG2-CD1 4.3Å; L390-L442 HydrophobicContact CB-CD2 4.21Å; L390-L442 HydrophobicContact CD1-CD1 4.41Å; L390-L442 HydrophobicContact CD1-CD2 3.96Å; L390-L442 HydrophobicContact CG-CD1 3.95Å; L390-L442 HydrophobicContact CG-CD2 3.81Å; L439-L442 HydrophobicContact CB-CD2 3.93Å; L439-L442 WeakPolarHBondContact O-CD2 3.35Å; D440-L442 VanDerWaalsContact C-N 3.26Å; D440-L442 PolarHBondContact O-N 3.24Å; L442-M446 HydrophobicContact CD2-CE 3.98Å; L442-M446 HydrophobicContact CD2-SD 4.31Å
443	E	88.1	Confident	90.7	Very high	93 Å²	93	37.3 Å²	37.3	44%	0.435	20%	0.201	S	C	.	.			trans	-125.4	158.6	177.2	-77.5	-68.3	163.5	0	0	110.9	S441 C445 M446	S441-E443 PolarHBondContact O-N 3.39Å; E443-C445 PolarHBondContact O-N 3.11Å; E443-C445 VanDerWaalsContact O-N 3.11Å; E443-M446 HydrophobicContact CB-CG 3.88Å; E443-M446 HydrophobicContact CB-SD 4.5Å
444	P	89	Confident	90.8	Very high	66 Å²	66	34.1 Å²	34.1	43%	0.429	18%	0.184	S	C	.	.	S	Bend	trans	-60.1	-23.7	-179.1	-23.8	33.5	0	0	0	114.3	K380 L381 M384	K380-P444 VanDerWaalsContact CA-O 3.23Å; K380-P444 WeakPolarHBondContact CA-O 3.16Å; L381-P444 PolarHBondContact N-O 2.93Å; M384-P444 HydrophobicContact CE-CG 4.35Å; M384-P444 HydrophobicContact CG-CG 4.24Å; M384-P444 HydrophobicContact SD-CB 4.3Å; M384-P444 HydrophobicContact SD-CG 3.8Å
445	C	91.9	Very high	90.4	Very high	29 Å²	29	37.1 Å²	37.1	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	125.7	173.3	-174.1	0	0	0	0	109.9	I379 K380 E443	I379-C445 CarbonylContact O-C 3.27Å; I379-C445 WeakPolarHBondContact O-CA 3.38Å; K380-C445 WeakPolarHBondContact CE-SG 3.38Å; K380-C445 HydrophobicContact CG-CB 3.93Å; E443-C445 PolarHBondContact O-N 3.11Å; E443-C445 VanDerWaalsContact O-N 3.11Å
446	M	93.9	Very high	89.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	147.8	179.2	-60.9	171.2	-74.6	0	0	109.6	E378 I379 L381 R414 L442 E443	E378-M446 CarbonylContact C-O 3.59Å; E378-M446 WeakPolarHBondContact CA-O 3.46Å; I379-M446 HydrophobicContact CB-CE 4.39Å; I379-M446 HydrophobicContact CG2-CE 4.08Å; I379-M446 PolarHBondContact N-O 3.04Å; I379-M446 PolarHBondContact O-N 2.8Å; L381-M446 HydrophobicContact CD1-CE 3.62Å; L381-M446 HydrophobicContact CG-CE 4.18Å; R414-M446 PolarHBondContact NH1-SD 3.02Å; L442-M446 HydrophobicContact CD2-CE 3.98Å; L442-M446 HydrophobicContact CD2-SD 4.31Å; E443-M446 HydrophobicContact CB-CG 3.88Å; E443-M446 HydrophobicContact CB-SD 4.5Å
447	Y	94.2	Very high	88.1	Confident	27 Å²	27	43 Å²	43	11%	0.106	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	116.5	175.3	-58.5	-90.7	0	0	0	108.3	L358 V377 E378 R414 S415 D416 C417 K418 Y422	L358-Y447 HydrophobicContact CD1-CD1 3.98Å; L358-Y447 HydrophobicContact CD1-CE1 4.06Å; V377-Y447 CarbonylContact O-C 3.57Å; V377-Y447 WeakPolarHBondContact O-CA 3.26Å; E378-Y447 HydrophobicContact CB-CD1 3.99Å; E378-Y447 HydrophobicContact CB-CE1 3.92Å; E378-Y447 HydrophobicContact CG-CD1 4.28Å; E378-Y447 HydrophobicContact CG-CE1 3.8Å; R414-Y447 CarbonylContact C-O 3.55Å; R414-Y447 VanDerWaalsContact CA-O 3.3Å; R414-Y447 WeakPolarHBondContact CA-O 3.33Å; S415-Y447 PolarHBondContact N-O 3.18Å; S415-Y447 PolarHBondContact O-N 2.95Å; D416-Y447 WeakPolarHBondContact O-CE2 3.22Å; C417-Y447 VanDerWaalsContact C-CD2 3.49Å; K418-Y447 HydrophobicContact CB-CD1 4.21Å; K418-Y447 HydrophobicContact CB-CE1 3.75Å; K418-Y447 HydrophobicContact CB-CE2 4.23Å; K418-Y447 HydrophobicContact CG-CD1 4.4Å; K418-Y447 HydrophobicContact CG-CE1 4.11Å; K418-Y447 VanDerWaalsContact N-CE2 3.34Å; Y422-Y447 WeakPolarHBondContact OH-CB 3.39Å
448	V	94.4	Very high	86.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	134.3	-173.8	-172.6	0	0	0	0	110.6	V377 I379 L392 C412 V413 I425 L439	V377-V448 PolarHBondContact N-O 2.97Å; V377-V448 PolarHBondContact O-N 3.1Å; I379-V448 HydrophobicContact CD1-CG2 4.47Å; L392-V448 HydrophobicContact CD2-CB 3.82Å; L392-V448 HydrophobicContact CD2-CG1 3.48Å; L392-V448 VanDerWaalsContact CD2-CG1 3.48Å; L392-V448 HydrophobicContact CD2-CG2 4.37Å; C412-V448 WeakPolarHBondContact SG-CG1 3.4Å; V413-V448 WeakPolarHBondContact O-CA 3.46Å; I425-V448 HydrophobicContact CD1-CG1 3.91Å; L439-V448 HydrophobicContact CD2-CG2 4.39Å
449	A	93.6	Very high	85.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	152.9	-179.1	0	0	0	0	0	111.4	L365 T372 V376 C412 V413	L365-A449 HydrophobicContact CD1-CB 4.02Å; T372-A449 HydrophobicContact CG2-CB 4.11Å; V376-A449 HydrophobicContact CB-CB 4.47Å; V376-A449 HydrophobicContact CG1-CB 4.49Å; V376-A449 HydrophobicContact CG2-CB 4.02Å; C412-A449 WeakPolarHBondContact CA-O 3.28Å; C412-A449 PolarHBondContact SG-O 2.93Å; C412-A449 VanDerWaalsContact SG-O 3.41Å; V413-A449 HydrophobicContact CG2-CB 4.21Å; V413-A449 WeakPolarHBondContact CG2-O 3.15Å; V413-A449 PolarHBondContact N-O 3.33Å; V413-A449 PolarHBondContact O-N 2.79Å
450	V	93.1	Very high	84.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	130.2	167.8	-169.2	0	0	0	0	108.7	V373 S374 I394 I396 V410 L411 V435	V373-V450 HydrophobicContact CG2-CB 3.96Å; V373-V450 HydrophobicContact CG2-CG1 3.7Å; V373-V450 WeakPolarHBondContact CG2-O 3.47Å; V373-V450 PolarHBondContact N-O 2.89Å; S374-V450 PolarHBondContact N-O 2.87Å; S374-V450 PolarHBondContact OG-N 3.15Å; I394-V450 HydrophobicContact CB-CG2 4.17Å; I394-V450 HydrophobicContact CD1-CG2 4.04Å; I394-V450 HydrophobicContact CG2-CG2 3.95Å; I396-V450 HydrophobicContact CG2-CB 3.97Å; I396-V450 HydrophobicContact CG2-CG1 3.93Å; I396-V450 HydrophobicContact CG2-CG2 4.17Å; V410-V450 HydrophobicContact CG1-CG1 3.52Å; L411-V450 WeakPolarHBondContact O-CA 3.34Å; L411-V450 WeakPolarHBondContact O-CG1 3.33Å; V435-V450 HydrophobicContact CB-CG2 4.27Å; V435-V450 HydrophobicContact CG1-CG2 4.32Å; V435-V450 HydrophobicContact CG2-CG1 4.13Å; V435-V450 HydrophobicContact CG2-CG2 4.46Å
451	V	92.7	Very high	84.1	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	163.9	175.4	-62.3	0	0	0	0	110	L365 T371 T372 L411 V413	L365-V451 HydrophobicContact CB-CG1 4.33Å; L365-V451 HydrophobicContact CD2-CG1 4.24Å; T371-V451 CarbonylContact O-C 3.57Å; T371-V451 VanDerWaalsContact O-CA 3.28Å; T371-V451 WeakPolarHBondContact O-CA 3.32Å; T372-V451 HydrophobicContact CG2-CG1 4.2Å; L411-V451 HydrophobicContact CB-CG2 4.05Å; L411-V451 PolarHBondContact N-O 2.83Å; L411-V451 PolarHBondContact O-N 3.47Å; L411-V451 VanDerWaalsContact O-O 3.12Å; V413-V451 HydrophobicContact CG1-CG2 3.87Å; V413-V451 HydrophobicContact CG2-CG1 3.94Å; V413-V451 HydrophobicContact CG2-CG2 4.3Å
452	V	91.1	Very high	84.2	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.7	157.6	-179.4	0	0	0	0	108	C370 T371 V373 V398 A408 D409 V410 V463 V467	C370-V452 CarbonylContact C-O 3.54Å; C370-V452 VanDerWaalsContact CA-O 3.31Å; C370-V452 WeakPolarHBondContact CA-O 3.35Å; T371-V452 PolarHBondContact N-O 2.64Å; T371-V452 PolarHBondContact O-N 2.84Å; V373-V452 HydrophobicContact CG1-CG2 3.86Å; V373-V452 HydrophobicContact CG2-CG2 4.39Å; V398-V452 HydrophobicContact CG1-CG2 4.39Å; A408-V452 HydrophobicContact CB-CG1 3.97Å; D409-V452 CarbonylContact O-C 3.55Å; D409-V452 VanDerWaalsContact O-CA 3.31Å; D409-V452 WeakPolarHBondContact O-CA 3.44Å; D409-V452 WeakPolarHBondContact O-CG1 3.41Å; V410-V452 HydrophobicContact CG2-CG2 4.16Å; V452-V463 HydrophobicContact CB-CG2 4.25Å; V452-V463 HydrophobicContact CG1-CG2 3.86Å; V452-V467 HydrophobicContact CB-CG1 4.32Å; V452-V467 HydrophobicContact CG1-CG1 3.73Å; V452-V467 HydrophobicContact CG2-CG1 4.31Å
453	Q	90.3	Very high	84.2	Confident	87 Å²	87	51.8 Å²	51.8	41%	0.407	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125	179	-176.4	170.4	-15.2	0	0	110.5	R369 A408 D409 L411	R369-Q453 CarbonylContact O-C 3.47Å; R369-Q453 WeakPolarHBondContact O-CA 3.39Å; A408-Q453 CarbonylContact C-O 3.54Å; A408-Q453 VanDerWaalsContact CA-O 3.29Å; A408-Q453 WeakPolarHBondContact CA-O 3.27Å; D409-Q453 PolarHBondContact N-O 2.83Å; D409-Q453 PolarHBondContact O-N 3.17Å; L411-Q453 HydrophobicContact CD1-CB 3.94Å
454	A	88	Confident	84.2	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	125	171.8	0	0	0	0	0	110.5	R369 A407 A408 V457 V463	R369-A454 PolarHBondContact O-N 3.24Å; A407-A454 CarbonylContact O-C 3.55Å; A407-A454 VanDerWaalsContact O-CA 3.24Å; A407-A454 WeakPolarHBondContact O-CA 3.43Å; A408-A454 HydrophobicContact CB-CB 4.19Å; A454-V457 HydrophobicContact CB-CG2 3.48Å; A454-V457 VanDerWaalsContact CB-CG2 3.48Å; A454-V463 HydrophobicContact CB-CB 4.13Å; A454-V463 HydrophobicContact CB-CG2 4.15Å
455	Q	80.6	Confident	84	Confident	99 Å²	99	47.5 Å²	47.5	46%	0.463	24%	0.244	S	C	.	.	S	Bend	trans	-67.5	-44.8	176.2	-61.6	-170.6	12	0	0	110.8	A407 D409	A407-Q455 PolarHBondContact O-N 2.87Å; D409-Q455 PolarHBondContact OD2-NE2 2.84Å
456	Y	71.5	Confident	83.7	Confident	175 Å²	175	47.5 Å²	47.5	69%	0.686	24%	0.241	S	C	*	.			trans	-121.3	126.4	-179.8	-61.4	-85.3	0	0	0	109.6
457	V	67.3	Low	83.5	Confident	29 Å²	29	47.6 Å²	47.6	18%	0.176	24%	0.242	C	C	.	.			trans	-131	116.2	174	174.5	0	0	0	0	107.4	R369 A454 T461	R369-V457 HydrophobicContact CB-CG2 4.34Å; R369-V457 HydrophobicContact CG-CB 4.08Å; R369-V457 HydrophobicContact CG-CG2 3.79Å; A454-V457 HydrophobicContact CB-CG2 3.48Å; A454-V457 VanDerWaalsContact CB-CG2 3.48Å; V457-T461 WeakPolarHBondContact CG1-O 3.25Å
458	G	68.9	Low	83.1	Confident	43 Å²	43	51.7 Å²	51.7	44%	0.443	26%	0.262	S	S	.	.			trans	-81	175.5	179.9	0	0	0	0	0	111.8	N460 T461	G458-N460 PolarHBondContact O-N 3.2Å; G458-N460 VanDerWaalsContact O-N 3.13Å; G458-T461 PolarHBondContact N-OG1 2.89Å; G458-T461 PolarHBondContact O-N 2.98Å
459	H	59.3	Low	82.8	Confident	189 Å²	189	51.9 Å²	51.9	88%	0.875	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	118.5	170.5	-47.3	-72.1	0	0	0	108.6
460	N	68.6	Low	82.6	Confident	167 Å²	167	56.3 Å²	56.3	89%	0.893	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	5.7	-177.7	-49	-19.8	0	0	0	118.1	G458	G458-N460 PolarHBondContact O-N 3.2Å; G458-N460 VanDerWaalsContact O-N 3.13Å
461	T	79.5	Confident	82.5	Confident	54 Å²	54	56.3 Å²	56.3	33%	0.331	28%	0.282	S	S	.	.			trans	-94.2	165.9	166.4	73.1	0	0	0	0	112.1	V457 G458	V457-T461 WeakPolarHBondContact CG1-O 3.25Å; G458-T461 PolarHBondContact N-OG1 2.89Å; G458-T461 PolarHBondContact O-N 2.98Å
462	T	85.4	Confident	82.4	Confident	26 Å²	26	56.2 Å²	56.2	16%	0.16	28%	0.281	C	S	.	.			trans	-142.7	163.4	175.9	67.8	0	0	0	0	111.2	N368 W464 D465	N368-T462 CarbonylContact O-C 3.56Å; N368-T462 WeakPolarHBondContact O-CA 3.19Å; T462-W464 PolarHBondContact O-N 3.23Å; T462-W464 VanDerWaalsContact O-N 3.08Å; T462-W464 PolarHBondContact OG1-N 3.06Å; T462-D465 WeakPolarHBondContact CA-OD2 3.29Å; T462-D465 PolarHBondContact N-OD2 2.88Å; T462-D465 WeakPolarHBondContact O-CB 3.49Å; T462-D465 PolarHBondContact O-N 2.83Å; T462-D465 VanDerWaalsContact O-OD2 3.13Å; T462-D465 PolarHBondContact OG1-OD2 2.77Å
463	V	87.4	Confident	82.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-55.5	-25.4	173.1	66.8	0	0	0	0	113.7	N368 T371 V452 A454 D465 H466	N368-V463 PolarHBondContact O-N 3.47Å; T371-V463 HydrophobicContact CG2-CG1 3.81Å; V452-V463 HydrophobicContact CB-CG2 4.25Å; V452-V463 HydrophobicContact CG1-CG2 3.86Å; A454-V463 HydrophobicContact CB-CB 4.13Å; A454-V463 HydrophobicContact CB-CG2 4.15Å; V463-D465 VanDerWaalsContact C-N 3.31Å; V463-D465 PolarHBondContact O-N 2.97Å; V463-H466 PolarHBondContact O-N 2.88Å
464	W	87.3	Confident	82.6	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.008	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-67.3	-30.7	177.3	-74.2	73.3	0	0	0	112.6	T462 H466 V467 R469 L528 P531 V561	T462-W464 PolarHBondContact O-N 3.23Å; T462-W464 VanDerWaalsContact O-N 3.08Å; T462-W464 PolarHBondContact OG1-N 3.06Å; W464-H466 PolarHBondContact O-N 2.71Å; W464-V467 PolarHBondContact O-N 2.82Å; W464-R469 HydrophobicContact CH2-CG 4.46Å; W464-R469 HydrophobicContact CZ3-CB 4.28Å; W464-R469 HydrophobicContact CZ3-CG 4.3Å; W464-L528 HydrophobicContact CH2-CD2 4.5Å; W464-L528 HydrophobicContact CZ3-CD2 4.18Å; W464-P531 HydrophobicContact CD2-CG 3.6Å; W464-P531 HydrophobicContact CE3-CG 4.1Å; W464-P531 HydrophobicContact CG-CG 3.82Å; W464-P531 HydrophobicContact CH2-CG 4.43Å; W464-P531 HydrophobicContact CZ2-CG 4.01Å; W464-P531 HydrophobicContact CZ3-CG 4.48Å; W464-V561 HydrophobicContact CH2-CG1 3.87Å; W464-V561 HydrophobicContact CZ2-CG1 4.44Å
465	D	85.9	Confident	82.9	Confident	67 Å²	67	52 Å²	52	36%	0.358	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-66.6	-20.5	178.2	-57.3	-63.7	0	0	0	112.4	K401 T462 V463	K401-D465 WeakPolarHBondContact CD-O 3.24Å; K401-D465 VanDerWaalsContact CE-O 3.3Å; K401-D465 WeakPolarHBondContact CE-O 3.33Å; K401-D465 PolarHBondContact NZ-O 3.4Å; T462-D465 WeakPolarHBondContact CA-OD2 3.29Å; T462-D465 PolarHBondContact N-OD2 2.88Å; T462-D465 WeakPolarHBondContact O-CB 3.49Å; T462-D465 PolarHBondContact O-N 2.83Å; T462-D465 VanDerWaalsContact O-OD2 3.13Å; T462-D465 PolarHBondContact OG1-OD2 2.77Å; V463-D465 VanDerWaalsContact C-N 3.31Å; V463-D465 PolarHBondContact O-N 2.97Å
466	H	85.9	Confident	83.4	Confident	29 Å²	29	47.3 Å²	47.3	13%	0.134	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-97.1	-6.4	-179.4	-61.1	-61.7	0	0	0	114.2	K401 S404 A408 V463 W464	K401-H466 PolarHBondContact N-O 3.5Å; S404-H466 WeakPolarHBondContact CB-ND1 3.48Å; S404-H466 PolarHBondContact OG-ND1 2.77Å; A408-H466 HydrophobicContact CB-CB 3.79Å; V463-H466 PolarHBondContact O-N 2.88Å; W464-H466 PolarHBondContact O-N 2.71Å
467	V	87.7	Confident	84.3	Confident	3 Å²	3	39 Å²	39	2%	0.018	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	157.2	-176.4	-61.4	0	0	0	0	113.9	V398 A399 V400 K401 V452 W464	V398-V467 HydrophobicContact CG1-CB 3.74Å; V398-V467 HydrophobicContact CG1-CG1 4.03Å; V398-V467 HydrophobicContact CG1-CG2 4.23Å; A399-V467 CarbonylContact O-C 3.6Å; A399-V467 WeakPolarHBondContact O-CA 3.49Å; V400-V467 HydrophobicContact CG2-CG1 4.47Å; K401-V467 WeakPolarHBondContact CE-O 3.4Å; V452-V467 HydrophobicContact CB-CG1 4.32Å; V452-V467 HydrophobicContact CG1-CG1 3.73Å; V452-V467 HydrophobicContact CG2-CG1 4.31Å; W464-V467 PolarHBondContact O-N 2.82Å
468	Q	86.7	Confident	85.2	Confident	112 Å²	112	38.9 Å²	38.9	52%	0.523	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	102.3	163.8	-169.3	178.7	30.3	0	0	108.2	V398 A399 V527	V398-Q468 WeakPolarHBondContact CA-O 3.26Å; A399-Q468 PolarHBondContact N-O 3.33Å; A399-Q468 PolarHBondContact O-N 3.19Å; Q468-V527 HydrophobicContact CG-CG1 3.63Å; Q468-V527 HydrophobicContact CG-CG2 4.45Å
469	R	87.4	Confident	85.9	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	136	-176.3	176.2	163.1	-172.9	168.9	12.9	111.6	T371 T372 V398 W464 V471 G493 V527 L528	T371-R469 PolarHBondContact OG1-NH1 2.96Å; T372-R469 PolarHBondContact O-NH1 3.37Å; T372-R469 PolarHBondContact O-NH2 3.32Å; V398-R469 HydrophobicContact CG1-CB 4.41Å; V398-R469 HydrophobicContact CG2-CB 4.01Å; V398-R469 HydrophobicContact CG2-CG 3.78Å; W464-R469 HydrophobicContact CH2-CG 4.46Å; W464-R469 HydrophobicContact CZ3-CB 4.28Å; W464-R469 HydrophobicContact CZ3-CG 4.3Å; R469-V471 HydrophobicContact CG-CG1 4.49Å; R469-G493 PolarHBondContact NE-O 2.99Å; R469-G493 PolarHBondContact NH2-O 2.75Å; R469-V527 WeakPolarHBondContact O-CA 3.19Å; R469-L528 PolarHBondContact O-N 3.39Å
470	K	89.7	Confident	87	Confident	93 Å²	93	36.2 Å²	36.2	40%	0.404	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	142.4	163	-61.6	175.4	-176.3	176.2	0	110.1	S397 F526 V527	S397-K470 WeakPolarHBondContact O-CB 3.33Å; S397-K470 PolarHBondContact O-N 3.06Å; K470-F526 CarbonylContact C-O 3.6Å; K470-F526 VanDerWaalsContact CA-O 3.24Å; K470-F526 WeakPolarHBondContact CA-O 3.21Å; K470-V527 HydrophobicContact CG-CG2 3.92Å
471	V	91.1	Very high	87.7	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.6	169.6	-64.7	0	0	0	0	109.3	R469 M491 Q525 F526 L528	R469-V471 HydrophobicContact CG-CG1 4.49Å; V471-M491 HydrophobicContact CG2-SD 4.28Å; V471-Q525 WeakPolarHBondContact O-CA 3.3Å; V471-F526 HydrophobicContact CG2-CD1 4.05Å; V471-F526 HydrophobicContact CG2-CD2 4.25Å; V471-F526 HydrophobicContact CG2-CE1 3.6Å; V471-F526 HydrophobicContact CG2-CE2 3.82Å; V471-F526 HydrophobicContact CG2-CG 4.36Å; V471-F526 HydrophobicContact CG2-CZ 3.46Å; V471-F526 VanDerWaalsContact CG2-CZ 3.46Å; V471-F526 PolarHBondContact N-O 2.88Å; V471-F526 PolarHBondContact O-N 3.23Å; V471-F526 VanDerWaalsContact O-N 3.16Å; V471-L528 HydrophobicContact CG1-CB 4.32Å; V471-L528 HydrophobicContact CG1-CD2 4.4Å; V471-L528 HydrophobicContact CG2-CB 4.09Å
472	S	91.4	Very high	87.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	132.9	-178	-52.6	0	0	0	0	110.3	M491 F492 H494 D495 H524	S472-M491 CarbonylContact O-C 3.6Å; S472-M491 WeakPolarHBondContact O-CA 3.13Å; S472-F492 PolarHBondContact N-O 2.74Å; S472-F492 PolarHBondContact O-N 2.83Å; S472-H494 WeakPolarHBondContact CB-O 3.23Å; S472-H494 PolarHBondContact OG-O 3.15Å; S472-D495 WeakPolarHBondContact OG-CA 3.43Å; S472-H524 CarbonylContact C-O 3.57Å; S472-H524 WeakPolarHBondContact CA-O 3.43Å
473	L	93.1	Very high	87.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	121.5	173.3	-156.6	72.2	0	0	0	109.6	V489 M491 K523 H524 I536 V588 V590 F601	L473-V489 HydrophobicContact CD1-CG1 3.8Å; L473-V489 HydrophobicContact CD2-CG1 3.75Å; L473-V489 HydrophobicContact CG-CG1 3.64Å; L473-M491 HydrophobicContact CD1-CB 3.57Å; L473-M491 HydrophobicContact CD1-CG 3.77Å; L473-M491 HydrophobicContact CD1-SD 4.34Å; L473-K523 CarbonylContact O-C 3.56Å; L473-K523 VanDerWaalsContact O-CA 3.27Å; L473-K523 WeakPolarHBondContact O-CA 3.46Å; L473-H524 PolarHBondContact N-O 3.11Å; L473-H524 PolarHBondContact O-N 3.44Å; L473-I536 HydrophobicContact CD1-CD1 3.83Å; L473-I536 HydrophobicContact CD2-CD1 4.27Å; L473-V588 HydrophobicContact CD2-CG1 3.72Å; L473-V590 HydrophobicContact CD2-CG2 3.74Å; L473-F601 HydrophobicContact CB-CE1 4.39Å; L473-F601 HydrophobicContact CB-CZ 4.33Å; L473-F601 HydrophobicContact CD2-CE1 3.89Å; L473-F601 HydrophobicContact CD2-CZ 4.09Å
474	G	92.6	Very high	87.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.7	177.5	0	0	0	0	0	111.6	Y476 V489 A490	G474-Y476 WeakPolarHBondContact O-CD2 3.41Å; G474-V489 WeakPolarHBondContact O-CA 3.44Å; G474-A490 PolarHBondContact N-O 3.36Å; G474-A490 PolarHBondContact O-N 2.85Å
475	V	93.3	Very high	87.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.6	174	-176	0	0	0	0	108.9	T487 W521 G522 V588 F601 V603	V475-T487 HydrophobicContact CG1-CG2 4.05Å; V475-W521 HydrophobicContact CG1-CE3 4.24Å; V475-W521 PolarHBondContact O-N 3.06Å; V475-G522 PolarHBondContact N-O 2.87Å; V475-V588 HydrophobicContact CG2-CG2 3.56Å; V475-F601 HydrophobicContact CG2-CE2 4.04Å; V475-F601 HydrophobicContact CG2-CZ 4.17Å; V475-V603 HydrophobicContact CB-CG2 4.33Å; V475-V603 HydrophobicContact CG2-CG2 3.96Å
476	Y	91.3	Very high	87.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	136.8	-176.4	-67	-92.8	0	0	0	111.2	G474 T487 V488 A490 F492 P498 L501 Q519 L520	G474-Y476 WeakPolarHBondContact O-CD2 3.41Å; Y476-T487 CarbonylContact O-C 3.58Å; Y476-T487 VanDerWaalsContact O-CA 3.31Å; Y476-T487 WeakPolarHBondContact O-CA 3.48Å; Y476-T487 WeakPolarHBondContact O-CG2 3.28Å; Y476-V488 WeakPolarHBondContact CB-O 3.04Å; Y476-V488 PolarHBondContact N-O 3.01Å; Y476-V488 PolarHBondContact O-N 2.98Å; Y476-A490 HydrophobicContact CD2-CB 4.14Å; Y476-A490 HydrophobicContact CE2-CB 3.99Å; Y476-F492 HydrophobicContact CE2-CE2 4.01Å; Y476-F492 AromaticContact CE2-CZ 3.96Å; Y476-F492 HydrophobicContact CE2-CZ 3.96Å; Y476-P498 WeakPolarHBondContact CE1-O 3.4Å; Y476-P498 WeakPolarHBondContact OH-CD 3.31Å; Y476-P498 PolarHBondContact OH-O 3.05Å; Y476-L501 HydrophobicContact CD1-CB 3.44Å; Y476-L501 VanDerWaalsContact CD1-CB 3.44Å; Y476-L501 HydrophobicContact CD1-CD2 4.44Å; Y476-L501 HydrophobicContact CD2-CB 4.33Å; Y476-L501 HydrophobicContact CD2-CD2 3.86Å; Y476-L501 HydrophobicContact CE1-CB 3.61Å; Y476-L501 HydrophobicContact CE2-CB 4.48Å; Y476-L501 HydrophobicContact CE2-CD2 4.21Å; Y476-L501 HydrophobicContact CG-CB 3.84Å; Y476-L501 HydrophobicContact CG-CD2 4Å; Y476-Q519 VanDerWaalsContact CA-O 3.3Å; Y476-Q519 WeakPolarHBondContact CA-O 3.39Å; Y476-L520 HydrophobicContact CD1-CB 4.08Å; Y476-L520 HydrophobicContact CD1-CD1 4.49Å; Y476-L520 HydrophobicContact CD2-CD1 4.45Å; Y476-L520 HydrophobicContact CE1-CB 3.67Å; Y476-L520 HydrophobicContact CE1-CD1 3.99Å; Y476-L520 HydrophobicContact CE1-CG 4.39Å; Y476-L520 HydrophobicContact CE2-CD1 3.93Å
477	G	89.8	Confident	87.5	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	-177.3	175	0	0	0	0	0	113	L518 Q519 W521	G477-L518 CarbonylContact O-C 3.51Å; G477-L518 WeakPolarHBondContact O-CA 3.42Å; G477-Q519 PolarHBondContact N-O 2.82Å; G477-Q519 PolarHBondContact O-N 2.92Å; G477-W521 VanDerWaalsContact CA-CE2 3.46Å; G477-W521 PolarHBondContact O-NE1 2.84Å
478	P	87.3	Confident	87.6	Confident	27 Å²	27	35 Å²	35	18%	0.175	17%	0.173	C	C	.	.			trans	-60.8	156.1	178	27.6	-37.1	0	0	0	111.7	H480 F485 W521 P606	P478-H480 WeakPolarHBondContact CB-O 3.31Å; P478-H480 WeakPolarHBondContact CG-O 3.26Å; P478-H480 PolarHBondContact O-N 2.83Å; P478-F485 HydrophobicContact CG-CB 3.89Å; P478-F485 HydrophobicContact CG-CD2 3.78Å; P478-F485 HydrophobicContact CG-CG 3.85Å; P478-W521 HydrophobicContact CG-CZ2 4.05Å; P478-W521 VanDerWaalsContact O-CZ2 3.28Å; P478-W521 WeakPolarHBondContact O-CZ2 3.35Å; P478-W521 PolarHBondContact O-NE1 2.81Å; P478-P606 WeakPolarHBondContact O-CG 3.4Å
479	K	82.8	Confident	87.9	Confident	117 Å²	117	29.7 Å²	29.7	51%	0.509	15%	0.148	S	C	.	.	S	Bend	trans	-61.2	-22.4	176.1	178.2	168.9	177.1	178.7	0	113.9	Q519 P606	K479-Q519 HydrophobicContact CB-CG 4.44Å; K479-Q519 VanDerWaalsContact CB-OE1 3.31Å; K479-Q519 VanDerWaalsContact CG-OE1 3.22Å; K479-P606 WeakPolarHBondContact O-CB 3.41Å
480	H	82.1	Confident	88	Confident	58 Å²	58	29.5 Å²	29.5	27%	0.269	15%	0.147	S	C	.	.	S	Bend	trans	-142.2	143.5	-179.9	-62.6	-63.5	0	0	0	109.6	P478 H482 Q607 P609	P478-H480 WeakPolarHBondContact CB-O 3.31Å; P478-H480 WeakPolarHBondContact CG-O 3.26Å; P478-H480 PolarHBondContact O-N 2.83Å; H480-H482 PolarHBondContact O-N 2.84Å; H480-Q607 PolarHBondContact ND1-O 3.19Å; H480-P609 HydrophobicContact CB-CB 4.04Å; H480-P609 HydrophobicContact CB-CG 4.43Å
481	I	83.4	Confident	88	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.			trans	-69.7	128.4	179.2	-61.5	162.1	0	0	0	110.7	F485 Y545 I581 S582 D583 F584 T605 P606 P609	I481-F485 HydrophobicContact CG2-CE1 3.77Å; I481-F485 HydrophobicContact CG2-CZ 4.36Å; I481-Y545 HydrophobicContact CG2-CE1 4.1Å; I481-I581 HydrophobicContact CB-CG2 3.97Å; I481-I581 HydrophobicContact CG2-CG2 3.43Å; I481-I581 VanDerWaalsContact CG2-CG2 3.43Å; I481-S582 VanDerWaalsContact CD1-O 3.29Å; I481-S582 WeakPolarHBondContact CD1-O 3.02Å; I481-D583 HydrophobicContact CD1-CB 4.15Å; I481-F584 HydrophobicContact CD1-CD1 4.11Å; I481-F584 HydrophobicContact CD1-CE1 4.1Å; I481-F584 HydrophobicContact CG2-CE1 4.34Å; I481-T605 VanDerWaalsContact CD1-OG1 3.26Å; I481-T605 WeakPolarHBondContact CD1-OG1 3.33Å; I481-P606 WeakPolarHBondContact CD1-O 3.3Å; I481-P606 WeakPolarHBondContact CG1-O 3.28Å; I481-P609 WeakPolarHBondContact O-CD 3.29Å
482	H	79.6	Confident	88	Confident	100 Å²	100	25.5 Å²	25.5	46%	0.463	13%	0.13	S	C	.	.			trans	-104.4	168.8	169.6	-88.6	-110.2	0	0	0	111.3	H480 S484 F485	H480-H482 PolarHBondContact O-N 2.84Å; H482-S484 WeakPolarHBondContact CB-O 3.49Å; H482-S484 PolarHBondContact O-N 2.82Å; H482-F485 HydrophobicContact CB-CD1 4.35Å; H482-F485 VanDerWaalsContact O-CD1 3.26Å; H482-F485 WeakPolarHBondContact O-CD1 3.46Å; H482-F485 WeakPolarHBondContact O-CE1 3.42Å
483	P	83.3	Confident	87.6	Confident	48 Å²	48	26 Å²	26	31%	0.312	14%	0.135	S	C	.	.	S	Bend	trans	-61.7	-27.2	171.9	-23.2	34.1	0	0	0	113.9	T574 S575 P578 I581	P483-T574 CarbonylContact O-C 3.51Å; P483-T574 WeakPolarHBondContact O-CA 3.49Å; P483-S575 PolarHBondContact O-N 3.19Å; P483-P578 HydrophobicContact CB-CB 3.88Å; P483-P578 HydrophobicContact CG-CB 4.03Å; P483-I581 HydrophobicContact CG-CD1 3.8Å
484	S	85.1	Confident	87.3	Confident	67 Å²	67	26.5 Å²	26.5	47%	0.469	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	136.6	171.4	178.6	0	0	0	0	108.7	H482 I573	H482-S484 WeakPolarHBondContact CB-O 3.49Å; H482-S484 PolarHBondContact O-N 2.82Å; S484-I573 WeakPolarHBondContact CA-O 3.27Å
485	F	86.1	Confident	86.8	Confident	17 Å²	17	28 Å²	28	8%	0.075	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	161.3	177.3	55.3	-84.8	0	0	0	112.6	P478 I481 H482 T487 W521 I573 F584	P478-F485 HydrophobicContact CG-CB 3.89Å; P478-F485 HydrophobicContact CG-CD2 3.78Å; P478-F485 HydrophobicContact CG-CG 3.85Å; I481-F485 HydrophobicContact CG2-CE1 3.77Å; I481-F485 HydrophobicContact CG2-CZ 4.36Å; H482-F485 HydrophobicContact CB-CD1 4.35Å; H482-F485 VanDerWaalsContact O-CD1 3.26Å; H482-F485 WeakPolarHBondContact O-CD1 3.46Å; H482-F485 WeakPolarHBondContact O-CE1 3.42Å; F485-T487 WeakPolarHBondContact CE2-OG1 3.05Å; F485-W521 HydrophobicContact CD2-CH2 4.27Å; F485-W521 AromaticContact CE2-CH2 3.53Å; F485-W521 HydrophobicContact CE2-CH2 3.53Å; F485-W521 HydrophobicContact CE2-CZ3 4.21Å; F485-W521 HydrophobicContact CZ-CH2 4.12Å; F485-I573 HydrophobicContact CD2-CB 4.35Å; F485-I573 HydrophobicContact CE1-CB 4.19Å; F485-I573 HydrophobicContact CE1-CG2 4.21Å; F485-I573 HydrophobicContact CE2-CB 3.8Å; F485-I573 HydrophobicContact CE2-CD1 3.87Å; F485-I573 HydrophobicContact CE2-CG1 4.15Å; F485-I573 HydrophobicContact CE2-CG2 4.35Å; F485-I573 HydrophobicContact CZ-CB 3.72Å; F485-I573 HydrophobicContact CZ-CD1 4.19Å; F485-I573 HydrophobicContact CZ-CG1 4.44Å; F485-I573 HydrophobicContact CZ-CG2 3.8Å; F485-I573 PolarHBondContact N-O 3.42Å; F485-I573 PolarHBondContact O-N 3.5Å; F485-F584 HydrophobicContact CZ-CZ 4.25Å
486	K	86.3	Confident	86.4	Confident	88 Å²	88	28.4 Å²	28.4	38%	0.383	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.5	170.3	-64.8	177.5	164.6	-170.8	0	109.7	D505 L570	K486-D505 IonicContact NZ-OD1 3.3Å; K486-D505 PolarHBondContact NZ-OD1 2.93Å; K486-D505 IonicContact NZ-OD2 2.87Å; K486-D505 PolarHBondContact NZ-OD2 3.02Å; K486-L570 HydrophobicContact CB-CD2 4.39Å; K486-L570 HydrophobicContact CD-CD1 4.17Å; K486-L570 HydrophobicContact CD-CD2 4.21Å; K486-L570 HydrophobicContact CG-CD2 4.1Å
487	T	88.6	Confident	86.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.1	168.7	-79.4	0	0	0	0	107.9	V475 Y476 F485 L538 F571 I573	V475-T487 HydrophobicContact CG1-CG2 4.05Å; Y476-T487 CarbonylContact O-C 3.58Å; Y476-T487 VanDerWaalsContact O-CA 3.31Å; Y476-T487 WeakPolarHBondContact O-CA 3.48Å; Y476-T487 WeakPolarHBondContact O-CG2 3.28Å; F485-T487 WeakPolarHBondContact CE2-OG1 3.05Å; T487-L538 HydrophobicContact CG2-CD2 3.92Å; T487-F571 PolarHBondContact N-O 3.44Å; T487-F571 PolarHBondContact O-N 2.74Å; T487-F571 VanDerWaalsContact O-O 3.13Å; T487-I573 HydrophobicContact CG2-CD1 4.47Å
488	V	89.9	Confident	85.8	Confident	4 Å²	4	29 Å²	29	2%	0.024	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.9	177.3	169.8	0	0	0	0	109.9	Y476 A490 L501 V503 L518 R568 L569 L570	Y476-V488 WeakPolarHBondContact CB-O 3.04Å; Y476-V488 PolarHBondContact N-O 3.01Å; Y476-V488 PolarHBondContact O-N 2.98Å; V488-A490 HydrophobicContact CG1-CB 4.45Å; V488-L501 HydrophobicContact CG1-CD2 3.87Å; V488-V503 HydrophobicContact CB-CG2 4.46Å; V488-V503 HydrophobicContact CG2-CG1 4.34Å; V488-V503 HydrophobicContact CG2-CG2 3.94Å; V488-L518 HydrophobicContact CB-CD1 3.95Å; V488-L518 HydrophobicContact CG2-CD1 3.81Å; V488-R568 HydrophobicContact CG1-CB 4.17Å; V488-L569 CarbonylContact C-O 3.56Å; V488-L569 VanDerWaalsContact CA-O 3.25Å; V488-L569 WeakPolarHBondContact CA-O 3.4Å; V488-L570 HydrophobicContact CG2-CB 4.34Å; V488-L570 HydrophobicContact CG2-CD1 4Å; V488-L570 HydrophobicContact CG2-CG 4.07Å
489	V	91.6	Very high	85.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	115.8	167.8	-175.8	0	0	0	0	107	L473 G474 I536 L538 L569 F571	L473-V489 HydrophobicContact CD1-CG1 3.8Å; L473-V489 HydrophobicContact CD2-CG1 3.75Å; L473-V489 HydrophobicContact CG-CG1 3.64Å; G474-V489 WeakPolarHBondContact O-CA 3.44Å; V489-I536 HydrophobicContact CG1-CG2 4.11Å; V489-L538 HydrophobicContact CG2-CD1 4.49Å; V489-L569 PolarHBondContact N-O 2.78Å; V489-L569 PolarHBondContact O-N 3.34Å; V489-F571 HydrophobicContact CB-CE2 4.06Å; V489-F571 HydrophobicContact CG2-CD2 3.91Å; V489-F571 HydrophobicContact CG2-CE2 3.7Å
490	A	90.8	Very high	85.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132.2	-178.3	0	0	0	0	0	110.7	G474 Y476 V488 F492 L501 V566 S567 R568	G474-A490 PolarHBondContact N-O 3.36Å; G474-A490 PolarHBondContact O-N 2.85Å; Y476-A490 HydrophobicContact CD2-CB 4.14Å; Y476-A490 HydrophobicContact CE2-CB 3.99Å; V488-A490 HydrophobicContact CG1-CB 4.45Å; A490-F492 HydrophobicContact CB-CE2 3.75Å; A490-F492 HydrophobicContact CB-CZ 3.75Å; A490-F492 WeakPolarHBondContact O-CE2 3.47Å; A490-L501 HydrophobicContact CB-CD2 3.98Å; A490-V566 HydrophobicContact CB-CG1 4.35Å; A490-S567 CarbonylContact C-O 3.6Å; A490-S567 WeakPolarHBondContact CA-O 3.27Å; A490-R568 HydrophobicContact CB-CG 4.34Å
491	M	89.8	Confident	85.3	Confident	7 Å²	7	27 Å²	27	3%	0.034	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	133.9	175.1	-161.5	172.6	74.3	0	0	110.9	V471 S472 L473 L534 I556 V561 V566 S567	V471-M491 HydrophobicContact CG2-SD 4.28Å; S472-M491 CarbonylContact O-C 3.6Å; S472-M491 WeakPolarHBondContact O-CA 3.13Å; L473-M491 HydrophobicContact CD1-CB 3.57Å; L473-M491 HydrophobicContact CD1-CG 3.77Å; L473-M491 HydrophobicContact CD1-SD 4.34Å; M491-L534 HydrophobicContact CE-CD1 4.01Å; M491-L534 HydrophobicContact SD-CD1 3.9Å; M491-I556 HydrophobicContact CB-CD1 3.55Å; M491-I556 HydrophobicContact CE-CD1 3.86Å; M491-I556 HydrophobicContact CE-CG2 3.98Å; M491-I556 HydrophobicContact CG-CD1 4.32Å; M491-I556 HydrophobicContact SD-CD1 3.88Å; M491-V561 HydrophobicContact CE-CB 4.4Å; M491-V561 HydrophobicContact CE-CG1 4.1Å; M491-V561 HydrophobicContact CE-CG2 3.59Å; M491-V566 WeakPolarHBondContact O-CA 3.42Å; M491-S567 PolarHBondContact N-O 2.84Å; M491-S567 PolarHBondContact O-N 2.88Å
492	F	89.4	Confident	84.7	Confident	2 Å²	2	29.6 Å²	29.6	1%	0.009	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140	-177.2	-51.3	-97.1	0	0	0	109.7	L359 S472 Y476 A490 H494 T497 P498 V566	L359-F492 HydrophobicContact CD1-CE1 4.2Å; S472-F492 PolarHBondContact N-O 2.74Å; S472-F492 PolarHBondContact O-N 2.83Å; Y476-F492 HydrophobicContact CE2-CE2 4.01Å; Y476-F492 AromaticContact CE2-CZ 3.96Å; Y476-F492 HydrophobicContact CE2-CZ 3.96Å; A490-F492 HydrophobicContact CB-CE2 3.75Å; A490-F492 HydrophobicContact CB-CZ 3.75Å; A490-F492 WeakPolarHBondContact O-CE2 3.47Å; F492-H494 PolarHBondContact O-N 2.75Å; F492-H494 VanDerWaalsContact O-N 3.13Å; F492-T497 HydrophobicContact CD2-CG2 3.81Å; F492-T497 HydrophobicContact CE2-CG2 4.08Å; F492-T497 HydrophobicContact CG-CG2 4.41Å; F492-P498 HydrophobicContact CE1-CG 4.47Å; F492-P498 HydrophobicContact CZ-CG 4.5Å; F492-V566 HydrophobicContact CD1-CB 4.34Å; F492-V566 HydrophobicContact CD1-CG1 3.7Å; F492-V566 HydrophobicContact CD1-CG2 3.64Å; F492-V566 HydrophobicContact CE1-CB 4.48Å; F492-V566 HydrophobicContact CE1-CG1 3.5Å; F492-V566 HydrophobicContact CE1-CG2 4.08Å; F492-V566 HydrophobicContact CG-CG1 4.44Å; F492-V566 HydrophobicContact CZ-CG1 4.11Å
493	G	84.4	Confident	84	Confident	11 Å²	11	25.9 Å²	25.9	11%	0.113	14%	0.141	C	C	.	.	S	Bend	trans	-73.3	5	177.5	0	0	0	0	0	115.3	R469	R469-G493 PolarHBondContact NE-O 2.99Å; R469-G493 PolarHBondContact NH2-O 2.75Å
494	H	85.3	Confident	82.7	Confident	10 Å²	10	28.9 Å²	28.9	5%	0.046	15%	0.154	C	C	.	.	S	Bend	trans	-153.9	171.7	-168.7	55.4	46.5	0	0	0	111	S472 F492 C496	S472-H494 WeakPolarHBondContact CB-O 3.23Å; S472-H494 PolarHBondContact OG-O 3.15Å; F492-H494 PolarHBondContact O-N 2.75Å; F492-H494 VanDerWaalsContact O-N 3.13Å; H494-C496 VanDerWaalsContact C-N 3.34Å; H494-C496 PolarHBondContact CE1-O 2.88Å; H494-C496 PolarHBondContact ND1-N 2.8Å; H494-C496 PolarHBondContact O-N 3.11Å
495	D	83.2	Confident	80.6	Confident	31 Å²	31	28.4 Å²	28.4	17%	0.166	15%	0.147	C	C	.	.	S	Bend	trans	-76.8	-11.7	179.9	-169	37.5	0	0	0	115.5	H335 S472 T497 K523 Q525	H335-D495 IonicContact CD2-OD2 3.87Å; S472-D495 WeakPolarHBondContact OG-CA 3.43Å; D495-T497 VanDerWaalsContact C-N 3.25Å; D495-T497 PolarHBondContact O-N 3.03Å; D495-T497 PolarHBondContact O-OG1 2.91Å; D495-K523 PolarHBondContact O-NZ 2.89Å; D495-K523 VanDerWaalsContact O-NZ 3.16Å; D495-K523 IonicContact OD1-NZ 3Å; D495-K523 PolarHBondContact OD1-NZ 2.9Å; D495-K523 IonicContact OD2-NZ 2.8Å; D495-Q525 PolarHBondContact OD1-NE2 3.11Å
496	C	84.1	Confident	78.4	Confident	9 Å²	9	33.6 Å²	33.6	6%	0.061	18%	0.179	C	C	.	.			trans	-73.4	74.8	-177.4	-65.4	0	0	0	0	112.5	T334 P375 H494	T334-C496 HydrophobicContact CG2-CB 4.06Å; P375-C496 HydrophobicContact CB-CB 4.49Å; P375-C496 HydrophobicContact CG-CB 3.82Å; H494-C496 VanDerWaalsContact C-N 3.34Å; H494-C496 PolarHBondContact CE1-O 2.88Å; H494-C496 PolarHBondContact ND1-N 2.8Å; H494-C496 PolarHBondContact O-N 3.11Å
497	T	85.5	Confident	75.9	Confident	6 Å²	6	33.2 Å²	33.2	4%	0.037	19%	0.185	C	C	.	.			trans	-89.5	109.1	174.6	54.3	0	0	0	0	109.7	F492 D495 K523	F492-T497 HydrophobicContact CD2-CG2 3.81Å; F492-T497 HydrophobicContact CE2-CG2 4.08Å; F492-T497 HydrophobicContact CG-CG2 4.41Å; D495-T497 VanDerWaalsContact C-N 3.25Å; D495-T497 PolarHBondContact O-N 3.03Å; D495-T497 PolarHBondContact O-OG1 2.91Å; T497-K523 HydrophobicContact CG2-CB 4.47Å; T497-K523 HydrophobicContact CG2-CD 3.9Å; T497-K523 WeakPolarHBondContact OG1-CD 3.22Å; T497-K523 PolarHBondContact OG1-NZ 2.94Å
498	P	83.9	Confident	73.3	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.039	22%	0.22	C	C	.	.			trans	-67.1	149.8	-177.9	30.9	-38.8	0	0	0	111.3	T316 L359 Y476 F492 T500	T316-P498 HydrophobicContact CG2-CB 4.1Å; L359-P498 HydrophobicContact CD1-CB 4.46Å; L359-P498 HydrophobicContact CD1-CG 3.7Å; Y476-P498 WeakPolarHBondContact CE1-O 3.4Å; Y476-P498 WeakPolarHBondContact OH-CD 3.31Å; Y476-P498 PolarHBondContact OH-O 3.05Å; F492-P498 HydrophobicContact CE1-CG 4.47Å; F492-P498 HydrophobicContact CZ-CG 4.5Å; P498-T500 WeakPolarHBondContact CB-O 3.27Å; P498-T500 PolarHBondContact O-N 3.43Å
499	K	83.9	Confident	70.2	Confident	117 Å²	117	50.7 Å²	50.7	51%	0.509	26%	0.257	S	S	.	.	S	Bend	trans	-67.3	-23.3	173.9	-81.8	-168.1	-172.4	133	0	114	D333 Q519 L520	D333-K499 HydrophobicContact CB-CG 4.41Å; D333-K499 VanDerWaalsContact OD1-CE 3.22Å; D333-K499 WeakPolarHBondContact OD1-CE 3.23Å; D333-K499 IonicContact OD1-NZ 3.68Å; D333-K499 PolarHBondContact OD1-NZ 2.85Å; D333-K499 WeakPolarHBondContact OD2-CD 3.35Å; D333-K499 WeakPolarHBondContact OD2-CE 3.41Å; D333-K499 WeakPolarHBondContact OD2-CG 3.43Å; D333-K499 IonicContact OD2-NZ 2.69Å; D333-K499 PolarHBondContact OD2-NZ 3.39Å; K499-Q519 WeakPolarHBondContact O-CA 3.48Å; K499-L520 PolarHBondContact O-N 3.2Å
500	T	81.3	Confident	67.4	Low	36 Å²	36	56.3 Å²	56.3	22%	0.221	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.4	179.2	-50.7	0	0	0	0	108	P498 A517 L518	P498-T500 WeakPolarHBondContact CB-O 3.27Å; P498-T500 PolarHBondContact O-N 3.43Å; T500-A517 HydrophobicContact CG2-CB 3.92Å; T500-L518 CarbonylContact C-O 3.58Å; T500-L518 VanDerWaalsContact CA-O 3.28Å; T500-L518 WeakPolarHBondContact CA-O 3.29Å
501	L	77	Confident	64.7	Low	8 Å²	8	59.3 Å²	59.3	4%	0.042	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122.8	171.7	-176.1	67.4	0	0	0	108.5	Y476 V488 A490 V503 L518	Y476-L501 HydrophobicContact CD1-CB 3.44Å; Y476-L501 VanDerWaalsContact CD1-CB 3.44Å; Y476-L501 HydrophobicContact CD1-CD2 4.44Å; Y476-L501 HydrophobicContact CD2-CB 4.33Å; Y476-L501 HydrophobicContact CD2-CD2 3.86Å; Y476-L501 HydrophobicContact CE1-CB 3.61Å; Y476-L501 HydrophobicContact CE2-CB 4.48Å; Y476-L501 HydrophobicContact CE2-CD2 4.21Å; Y476-L501 HydrophobicContact CG-CB 3.84Å; Y476-L501 HydrophobicContact CG-CD2 4Å; V488-L501 HydrophobicContact CG1-CD2 3.87Å; A490-L501 HydrophobicContact CB-CD2 3.98Å; L501-V503 HydrophobicContact CD2-CG2 4.27Å; L501-V503 HydrophobicContact CG-CG2 4.26Å; L501-L518 PolarHBondContact N-O 3.07Å; L501-L518 PolarHBondContact O-N 2.82Å
502	L	69.9	Low	62.3	Low	54 Å²	54	65 Å²	65	28%	0.283	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	124.7	168.5	-70.2	170	0	0	0	109	P313 P515 A517	P313-L502 VanDerWaalsContact CA-CD1 3.48Å; P313-L502 HydrophobicContact CB-CD1 3.61Å; L502-P515 HydrophobicContact CD2-CB 4.35Å; L502-A517 HydrophobicContact CD2-CB 3.82Å
503	V	64.3	Low	60.1	Low	22 Å²	22	69.6 Å²	69.6	13%	0.133	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	106.1	176	-176.5	0	0	0	0	107.8	V488 L501 V516 L518 L570	V488-V503 HydrophobicContact CB-CG2 4.46Å; V488-V503 HydrophobicContact CG2-CG1 4.34Å; V488-V503 HydrophobicContact CG2-CG2 3.94Å; L501-V503 HydrophobicContact CD2-CG2 4.27Å; L501-V503 HydrophobicContact CG-CG2 4.26Å; V503-V516 PolarHBondContact N-O 3.14Å; V503-V516 PolarHBondContact O-N 2.93Å; V503-V516 VanDerWaalsContact O-N 3.12Å; V503-L518 HydrophobicContact CG2-CD1 3.74Å; V503-L518 HydrophobicContact CG2-CG 4.13Å; V503-L570 HydrophobicContact CG1-CD1 4.43Å
504	N	56	Low	58.5	Low	112 Å²	112	73 Å²	73	60%	0.599	42%	0.417	S	S	*	.			trans	-72	139.3	151.1	-63.5	-2.7	0	0	0	106.4	V506 P515	N504-V506 WeakPolarHBondContact O-CG2 3.43Å; N504-V506 PolarHBondContact O-N 2.81Å; N504-P515 WeakPolarHBondContact OD1-CB 3.39Å
505	D	42.2	Very low	57.1	Low	57 Å²	57	76 Å²	76	31%	0.305	44%	0.438	S	S	.	.			trans	-70.2	99.4	173.4	-88.4	-38.7	0	0	0	109.5	K486 T507	K486-D505 IonicContact NZ-OD1 3.3Å; K486-D505 PolarHBondContact NZ-OD1 2.93Å; K486-D505 IonicContact NZ-OD2 2.87Å; K486-D505 PolarHBondContact NZ-OD2 3.02Å; D505-T507 PolarHBondContact O-N 2.95Å
506	V	38.1	Very low	56.3	Low	126 Å²	126	78.5 Å²	78.5	76%	0.764	45%	0.454	S	S	*	.			trans	-80.7	42.6	179.2	-160.2	0	0	0	0	111.1	N504	N504-V506 WeakPolarHBondContact O-CG2 3.43Å; N504-V506 PolarHBondContact O-N 2.81Å
507	T	34.3	Very low	55.9	Low	80 Å²	80	80.8 Å²	80.8	49%	0.491	47%	0.474	S	S	.	.	S	Bend	trans	-111.9	128.1	169.5	47.4	0	0	0	0	107.1	D505 Q509	D505-T507 PolarHBondContact O-N 2.95Å; T507-Q509 VanDerWaalsContact C-N 3.3Å; T507-Q509 PolarHBondContact O-N 2.9Å
508	W	33.9	Very low	55.8	Low	197 Å²	197	80.8 Å²	80.8	75%	0.746	47%	0.474	S	S	*	.	S	Bend	trans	-69.4	73.3	-167	-85.2	59.2	0	0	0	114	T73	T73-W508 HydrophobicContact CG2-CZ2 3.98Å; T73-W508 VanDerWaalsContact OG1-CH2 3.29Å; T73-W508 WeakPolarHBondContact OG1-CH2 3.43Å; T73-W508 VanDerWaalsContact OG1-CZ2 3.24Å; T73-W508 WeakPolarHBondContact OG1-CZ2 3.41Å
509	Q	26	Very low	56	Low	173 Å²	173	84.2 Å²	84.2	81%	0.808	49%	0.489	S	S	*	.			trans	-138.3	115.1	169.8	-69.5	-173.8	-15.7	0	0	109.8	T507 A511	T507-Q509 VanDerWaalsContact C-N 3.3Å; T507-Q509 PolarHBondContact O-N 2.9Å; Q509-A511 PolarHBondContact O-N 3.46Å
510	A	32.3	Very low	56.3	Low	118 Å²	118	80.9 Å²	80.9	98%	0.975	48%	0.476	S	S	*	.			trans	-81.1	74.9	-172.6	0	0	0	0	0	112.4
511	A	33.3	Very low	56.8	Low	63 Å²	63	80.9 Å²	80.9	52%	0.521	47%	0.473	S	S	.	.			trans	-141.4	86.5	-178.5	0	0	0	0	0	114	Q509 T513	Q509-A511 PolarHBondContact O-N 3.46Å; A511-T513 VanDerWaalsContact C-N 3.26Å; A511-T513 PolarHBondContact O-N 3.41Å
512	S	39.4	Very low	57.4	Low	128 Å²	128	81.4 Å²	81.4	90%	0.895	48%	0.479	S	S	*	.			trans	45.4	4.8	143.2	63.4	0	0	0	0	123
513	T	43.5	Very low	58.5	Low	98 Å²	98	83 Å²	83	60%	0.601	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-75.4	130.6	178.8	50.7	0	0	0	0	112.2	A511	A511-T513 VanDerWaalsContact C-N 3.26Å; A511-T513 PolarHBondContact O-N 3.41Å
514	P	50.2	Low	59.9	Low	81 Å²	81	84.5 Å²	84.5	53%	0.526	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-71	151.4	177.2	29.8	-35	0	0	0	112	V516	P514-V516 PolarHBondContact O-N 2.76Å
515	P	57.2	Low	61.6	Low	74 Å²	74	82.2 Å²	82.2	48%	0.481	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-60.2	129.1	-177.2	24	-34.8	0	0	0	112.4	L502 N504	L502-P515 HydrophobicContact CD2-CB 4.35Å; N504-P515 WeakPolarHBondContact OD1-CB 3.39Å
516	V	66	Low	64	Low	83 Å²	83	80.3 Å²	80.3	50%	0.503	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	122.2	179.3	-177.3	0	0	0	0	109.7	V503 P514 L518	V503-V516 PolarHBondContact N-O 3.14Å; V503-V516 PolarHBondContact O-N 2.93Å; V503-V516 VanDerWaalsContact O-N 3.12Å; P514-V516 PolarHBondContact O-N 2.76Å; V516-L518 HydrophobicContact CG1-CD2 3.79Å; V516-L518 HydrophobicContact CG1-CG 4.48Å; V516-L518 PolarHBondContact O-N 3.36Å
517	A	75.9	Confident	66.5	Low	57 Å²	57	77.3 Å²	77.3	47%	0.471	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	103.3	174	0	0	0	0	0	110.8	T500 L502	T500-A517 HydrophobicContact CG2-CB 3.92Å; L502-A517 HydrophobicContact CD2-CB 3.82Å
518	L	84.1	Confident	69.1	Low	7 Å²	7	73.6 Å²	73.6	4%	0.037	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	145.3	173.1	-56.9	-175.9	0	0	0	110.4	G477 V488 T500 L501 V503 V516	G477-L518 CarbonylContact O-C 3.51Å; G477-L518 WeakPolarHBondContact O-CA 3.42Å; V488-L518 HydrophobicContact CB-CD1 3.95Å; V488-L518 HydrophobicContact CG2-CD1 3.81Å; T500-L518 CarbonylContact C-O 3.58Å; T500-L518 VanDerWaalsContact CA-O 3.28Å; T500-L518 WeakPolarHBondContact CA-O 3.29Å; L501-L518 PolarHBondContact N-O 3.07Å; L501-L518 PolarHBondContact O-N 2.82Å; V503-L518 HydrophobicContact CG2-CD1 3.74Å; V503-L518 HydrophobicContact CG2-CG 4.13Å; V516-L518 HydrophobicContact CG1-CD2 3.79Å; V516-L518 HydrophobicContact CG1-CG 4.48Å; V516-L518 PolarHBondContact O-N 3.36Å
519	Q	87.7	Confident	71.5	Confident	78 Å²	78	67.4 Å²	67.4	36%	0.364	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	142.8	177.3	-58.1	-160.4	-58.6	0	0	111.1	Y476 G477 K479 K499 W521	Y476-Q519 VanDerWaalsContact CA-O 3.3Å; Y476-Q519 WeakPolarHBondContact CA-O 3.39Å; G477-Q519 PolarHBondContact N-O 2.82Å; G477-Q519 PolarHBondContact O-N 2.92Å; K479-Q519 HydrophobicContact CB-CG 4.44Å; K479-Q519 VanDerWaalsContact CB-OE1 3.31Å; K479-Q519 VanDerWaalsContact CG-OE1 3.22Å; K499-Q519 WeakPolarHBondContact O-CA 3.48Å; Q519-W521 VanDerWaalsContact O-CD1 3.23Å; Q519-W521 PolarHBondContact O-N 3.18Å
520	L	90.3	Very high	74.5	Confident	46 Å²	46	63.8 Å²	63.8	24%	0.241	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	116.8	172.6	-178.1	66.6	0	0	0	109.6	Y476 K499 G522 K523	Y476-L520 HydrophobicContact CD1-CB 4.08Å; Y476-L520 HydrophobicContact CD1-CD1 4.49Å; Y476-L520 HydrophobicContact CD2-CD1 4.45Å; Y476-L520 HydrophobicContact CE1-CB 3.67Å; Y476-L520 HydrophobicContact CE1-CD1 3.99Å; Y476-L520 HydrophobicContact CE1-CG 4.39Å; Y476-L520 HydrophobicContact CE2-CD1 3.93Å; K499-L520 PolarHBondContact O-N 3.2Å; L520-G522 WeakPolarHBondContact CD1-O 3.45Å; L520-K523 HydrophobicContact CD1-CB 4.41Å
521	W	91.4	Very high	77.1	Confident	37 Å²	37	59.6 Å²	59.6	14%	0.14	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-31.2	175.3	-64.6	-8.9	0	0	0	111.9	V475 G477 P478 F485 Q519 L586 V603 T605 P606	V475-W521 HydrophobicContact CG1-CE3 4.24Å; V475-W521 PolarHBondContact O-N 3.06Å; G477-W521 VanDerWaalsContact CA-CE2 3.46Å; G477-W521 PolarHBondContact O-NE1 2.84Å; P478-W521 HydrophobicContact CG-CZ2 4.05Å; P478-W521 VanDerWaalsContact O-CZ2 3.28Å; P478-W521 WeakPolarHBondContact O-CZ2 3.35Å; P478-W521 PolarHBondContact O-NE1 2.81Å; F485-W521 HydrophobicContact CD2-CH2 4.27Å; F485-W521 AromaticContact CE2-CH2 3.53Å; F485-W521 HydrophobicContact CE2-CH2 3.53Å; F485-W521 HydrophobicContact CE2-CZ3 4.21Å; F485-W521 HydrophobicContact CZ-CH2 4.12Å; Q519-W521 VanDerWaalsContact O-CD1 3.23Å; Q519-W521 PolarHBondContact O-N 3.18Å; W521-L586 HydrophobicContact CE3-CD1 4.14Å; W521-L586 HydrophobicContact CZ3-CD1 3.72Å; W521-V603 VanDerWaalsContact C-CG1 3.46Å; W521-V603 HydrophobicContact CB-CG1 3.54Å; W521-V603 WeakPolarHBondContact O-CG1 3.44Å; W521-T605 HydrophobicContact CE3-CG2 4.13Å; W521-T605 HydrophobicContact CH2-CG2 4.13Å; W521-T605 HydrophobicContact CZ3-CG2 3.68Å; W521-P606 VanDerWaalsContact CZ2-CD 3.48Å; W521-P606 HydrophobicContact CZ2-CG 3.83Å
522	G	90	Very high	79.8	Confident	18 Å²	18	58.2 Å²	58.2	19%	0.186	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	154.5	175.4	0	0	0	0	0	112.2	V475 L520	V475-G522 PolarHBondContact N-O 2.87Å; L520-G522 WeakPolarHBondContact CD1-O 3.45Å
523	K	92.3	Very high	82.3	Confident	89 Å²	89	54.5 Å²	54.5	39%	0.387	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	154.2	174.6	80	176.7	-173.4	165.5	0	112.2	L473 D495 T497 L520	L473-K523 CarbonylContact O-C 3.56Å; L473-K523 VanDerWaalsContact O-CA 3.27Å; L473-K523 WeakPolarHBondContact O-CA 3.46Å; D495-K523 PolarHBondContact O-NZ 2.89Å; D495-K523 VanDerWaalsContact O-NZ 3.16Å; D495-K523 IonicContact OD1-NZ 3Å; D495-K523 PolarHBondContact OD1-NZ 2.9Å; D495-K523 IonicContact OD2-NZ 2.8Å; T497-K523 HydrophobicContact CG2-CB 4.47Å; T497-K523 HydrophobicContact CG2-CD 3.9Å; T497-K523 WeakPolarHBondContact OG1-CD 3.22Å; T497-K523 PolarHBondContact OG1-NZ 2.94Å; L520-K523 HydrophobicContact CD1-CB 4.41Å
524	H	93.6	Very high	84.6	Confident	52 Å²	52	49.9 Å²	49.9	24%	0.241	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	147.8	175	179.7	77.1	0	0	0	110.1	S472 L473 T599 F601	S472-H524 CarbonylContact C-O 3.57Å; S472-H524 WeakPolarHBondContact CA-O 3.43Å; L473-H524 PolarHBondContact N-O 3.11Å; L473-H524 PolarHBondContact O-N 3.44Å; H524-T599 PolarHBondContact NE2-OG1 3.13Å; H524-F601 HydrophobicContact CB-CB 4.42Å; H524-F601 HydrophobicContact CB-CD1 3.47Å; H524-F601 VanDerWaalsContact CB-CD1 3.47Å; H524-F601 HydrophobicContact CB-CD2 3.82Å; H524-F601 HydrophobicContact CB-CE1 3.47Å; H524-F601 VanDerWaalsContact CB-CE1 3.47Å; H524-F601 HydrophobicContact CB-CE2 3.81Å; H524-F601 HydrophobicContact CB-CG 3.65Å; H524-F601 HydrophobicContact CB-CZ 3.64Å; H524-F601 AromaticContact CD2-CD1 3.72Å; H524-F601 AromaticContact CG-CD1 3.52Å; H524-F601 AromaticContact CG-CE1 3.92Å; H524-F601 AromaticContact CG-CG 3.84Å
525	Q	92.3	Very high	86.6	Confident	65 Å²	65	50.2 Å²	50.2	30%	0.304	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.3	173.2	-70.7	-175.5	2.2	0	0	109.9	V471 D495	V471-Q525 WeakPolarHBondContact O-CA 3.3Å; D495-Q525 PolarHBondContact OD1-NE2 3.11Å
526	F	92.6	Very high	88.2	Confident	16 Å²	16	46.9 Å²	46.9	7%	0.07	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	158	170.9	66.1	-78.2	0	0	0	110.7	K470 V471 L528 L534 V590 T599	K470-F526 CarbonylContact C-O 3.6Å; K470-F526 VanDerWaalsContact CA-O 3.24Å; K470-F526 WeakPolarHBondContact CA-O 3.21Å; V471-F526 HydrophobicContact CG2-CD1 4.05Å; V471-F526 HydrophobicContact CG2-CD2 4.25Å; V471-F526 HydrophobicContact CG2-CE1 3.6Å; V471-F526 HydrophobicContact CG2-CE2 3.82Å; V471-F526 HydrophobicContact CG2-CG 4.36Å; V471-F526 HydrophobicContact CG2-CZ 3.46Å; V471-F526 VanDerWaalsContact CG2-CZ 3.46Å; V471-F526 PolarHBondContact N-O 2.88Å; V471-F526 PolarHBondContact O-N 3.23Å; V471-F526 VanDerWaalsContact O-N 3.16Å; F526-L528 HydrophobicContact CE2-CD1 4.26Å; F526-L534 HydrophobicContact CZ-CD1 4.49Å; F526-V590 HydrophobicContact CE1-CG2 4.34Å; F526-V590 HydrophobicContact CE2-CG1 4.44Å; F526-V590 HydrophobicContact CZ-CG1 4Å; F526-V590 HydrophobicContact CZ-CG2 4.42Å; F526-T599 HydrophobicContact CB-CG2 4Å; F526-T599 HydrophobicContact CD1-CG2 3.59Å; F526-T599 HydrophobicContact CD2-CG2 4.13Å; F526-T599 HydrophobicContact CE1-CG2 4.01Å; F526-T599 HydrophobicContact CG-CG2 3.65Å; F526-T599 HydrophobicContact CZ-CG2 4.46Å
527	V	90.9	Very high	89.4	Confident	64 Å²	64	43.6 Å²	43.6	39%	0.388	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	133.1	175.3	175.3	0	0	0	0	109	Q468 R469 K470	Q468-V527 HydrophobicContact CG-CG1 3.63Å; Q468-V527 HydrophobicContact CG-CG2 4.45Å; R469-V527 WeakPolarHBondContact O-CA 3.19Å; K470-V527 HydrophobicContact CG-CG2 3.92Å
528	L	89.3	Confident	90.1	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.5	171.5	-172.2	73.8	0	0	0	108.7	W464 R469 V471 F526 F530 Q532 L534 V561 L598	W464-L528 HydrophobicContact CH2-CD2 4.5Å; W464-L528 HydrophobicContact CZ3-CD2 4.18Å; R469-L528 PolarHBondContact O-N 3.39Å; V471-L528 HydrophobicContact CG1-CB 4.32Å; V471-L528 HydrophobicContact CG1-CD2 4.4Å; V471-L528 HydrophobicContact CG2-CB 4.09Å; F526-L528 HydrophobicContact CE2-CD1 4.26Å; L528-F530 WeakPolarHBondContact CG-O 3.32Å; L528-Q532 HydrophobicContact CD1-CG 4.38Å; L528-L534 HydrophobicContact CD1-CD1 4.13Å; L528-L534 HydrophobicContact CD1-CD2 4.01Å; L528-L534 HydrophobicContact CD2-CD1 4.24Å; L528-V561 HydrophobicContact CD2-CG1 3.71Å; L528-L598 HydrophobicContact CD1-CD1 4.46Å
529	P	83.9	Confident	90.3	Very high	67 Å²	67	46.1 Å²	46.1	44%	0.435	23%	0.231	S	C	.	.	S	Bend	trans	-76.3	-32.8	-171.5	29	-34.4	0	0	0	113.6
530	F	87.6	Confident	90.3	Very high	97 Å²	97	43.9 Å²	43.9	43%	0.425	22%	0.224	S	C	.	.	S	Bend	trans	-154.5	162.8	178.6	53.5	-93.4	0	0	0	110.4	L528 Q532	L528-F530 WeakPolarHBondContact CG-O 3.32Å; F530-Q532 HydrophobicContact CD2-CB 4.02Å; F530-Q532 HydrophobicContact CE2-CB 3.78Å; F530-Q532 HydrophobicContact CE2-CG 4.31Å; F530-Q532 VanDerWaalsContact CZ-OE1 3.32Å; F530-Q532 PolarHBondContact O-N 3.12Å
531	P	87.9	Confident	90.1	Very high	30 Å²	30	46 Å²	46	20%	0.195	24%	0.236	C	C	.	.			trans	-70.4	116.8	176.9	-11.7	27.3	0	0	0	110.5	W464 G558 V561 K562	W464-P531 HydrophobicContact CD2-CG 3.6Å; W464-P531 HydrophobicContact CE3-CG 4.1Å; W464-P531 HydrophobicContact CG-CG 3.82Å; W464-P531 HydrophobicContact CH2-CG 4.43Å; W464-P531 HydrophobicContact CZ2-CG 4.01Å; W464-P531 HydrophobicContact CZ3-CG 4.48Å; P531-G558 WeakPolarHBondContact CB-O 3.2Å; P531-V561 HydrophobicContact CB-CB 4.41Å; P531-K562 HydrophobicContact CB-CB 3.83Å; P531-K562 HydrophobicContact CG-CB 3.97Å; P531-K562 HydrophobicContact CG-CG 4.18Å
532	Q	90.2	Very high	89.5	Confident	35 Å²	35	47.7 Å²	47.7	16%	0.164	25%	0.246	C	C	.	.			trans	-139.4	166.6	178.8	66.1	179	12.2	0	0	110.9	L528 F530 L534 G558	L528-Q532 HydrophobicContact CD1-CG 4.38Å; F530-Q532 HydrophobicContact CD2-CB 4.02Å; F530-Q532 HydrophobicContact CE2-CB 3.78Å; F530-Q532 HydrophobicContact CE2-CG 4.31Å; F530-Q532 VanDerWaalsContact CZ-OE1 3.32Å; F530-Q532 PolarHBondContact O-N 3.12Å; Q532-L534 HydrophobicContact CG-CD2 3.81Å; Q532-L534 HydrophobicContact CG-CG 4.42Å; Q532-G558 VanDerWaalsContact O-CA 3.22Å; Q532-G558 WeakPolarHBondContact O-CA 3.41Å; Q532-G558 PolarHBondContact O-N 2.68Å
533	D	91.5	Very high	88.9	Confident	50 Å²	50	52.4 Å²	52.4	27%	0.267	28%	0.276	S	S	.	.			trans	-68.1	132.4	170.7	-80.5	21.5	0	0	0	110.2	I555 I556 R557 G558	D533-I555 HydrophobicContact CB-CG2 4.41Å; D533-I556 WeakPolarHBondContact CA-O 3.47Å; D533-R557 VanDerWaalsContact OD1-CA 3.27Å; D533-R557 WeakPolarHBondContact OD1-CA 3.49Å; D533-R557 WeakPolarHBondContact OD2-CD 3.28Å; D533-R557 IonicContact OD2-CZ 2.65Å; D533-R557 IonicContact OD2-NE 2.67Å; D533-R557 IonicContact OD2-NH1 2.66Å; D533-R557 PolarHBondContact OD2-NH1 2.91Å; D533-G558 PolarHBondContact OD1-N 2.67Å
534	L	92	Very high	88.3	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	115.4	-174.6	-64.4	179.9	0	0	0	110.6	M491 F526 L528 Q532 I555 I556 V590 K591 L598	M491-L534 HydrophobicContact CE-CD1 4.01Å; M491-L534 HydrophobicContact SD-CD1 3.9Å; F526-L534 HydrophobicContact CZ-CD1 4.49Å; L528-L534 HydrophobicContact CD1-CD1 4.13Å; L528-L534 HydrophobicContact CD1-CD2 4.01Å; L528-L534 HydrophobicContact CD2-CD1 4.24Å; Q532-L534 HydrophobicContact CG-CD2 3.81Å; Q532-L534 HydrophobicContact CG-CG 4.42Å; L534-I555 CarbonylContact O-C 3.47Å; L534-I555 VanDerWaalsContact O-CA 3.31Å; L534-I555 WeakPolarHBondContact O-CA 3.33Å; L534-I556 PolarHBondContact N-O 3.27Å; L534-I556 PolarHBondContact O-N 2.94Å; L534-V590 HydrophobicContact CB-CG1 4.32Å; L534-V590 HydrophobicContact CD2-CG1 4.38Å; L534-K591 CarbonylContact C-O 3.53Å; L534-K591 WeakPolarHBondContact CA-O 3.45Å; L534-L598 HydrophobicContact CD2-CD1 3.36Å
535	Q	91.4	Very high	87.8	Confident	88 Å²	88	47.8 Å²	47.8	41%	0.411	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.9	176	-174.6	174.7	-1.6	0	0	110.5	G554 I555 K591	Q535-G554 CarbonylContact C-O 3.54Å; Q535-G554 WeakPolarHBondContact CA-O 3.24Å; Q535-I555 HydrophobicContact CB-CG1 4.3Å; Q535-I555 HydrophobicContact CG-CG1 4.21Å; Q535-K591 HydrophobicContact CB-CB 4.38Å; Q535-K591 PolarHBondContact N-O 3.13Å; Q535-K591 PolarHBondContact O-N 2.99Å
536	I	92.2	Very high	87.5	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	110	-177.4	-63.7	-177	0	0	0	109.3	L473 V489 G554 I556 L569 F571 V588 Q589 V590	L473-I536 HydrophobicContact CD1-CD1 3.83Å; L473-I536 HydrophobicContact CD2-CD1 4.27Å; V489-I536 HydrophobicContact CG1-CG2 4.11Å; I536-G554 PolarHBondContact N-O 3.45Å; I536-I556 HydrophobicContact CD1-CD1 3.54Å; I536-I556 HydrophobicContact CD1-CG1 4.15Å; I536-L569 HydrophobicContact CB-CD1 3.75Å; I536-L569 HydrophobicContact CD1-CD1 3.89Å; I536-L569 HydrophobicContact CG1-CD1 4.14Å; I536-L569 HydrophobicContact CG2-CD1 4.32Å; I536-F571 HydrophobicContact CG2-CZ 4.28Å; I536-F571 WeakPolarHBondContact O-CZ 3.32Å; I536-V588 HydrophobicContact CG2-CG1 4.12Å; I536-Q589 CarbonylContact C-O 3.56Å; I536-Q589 WeakPolarHBondContact CA-O 3.48Å; I536-V590 HydrophobicContact CG1-CG1 4.39Å; I536-V590 HydrophobicContact CG1-CG2 4.37Å
537	G	89.7	Confident	87.2	Confident	13 Å²	13	49.5 Å²	49.5	13%	0.134	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	138.4	169	0	0	0	0	0	111.5	V588 Q589	G537-V588 WeakPolarHBondContact O-CA 3.33Å; G537-Q589 PolarHBondContact N-O 2.59Å; G537-Q589 PolarHBondContact O-N 2.89Å
538	L	91.1	Very high	86.8	Confident	9 Å²	9	51.4 Å²	51.4	5%	0.047	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	121.7	172.2	-176.2	70.2	0	0	0	109	T487 V489 V547 F571 I573 L586 V588	T487-L538 HydrophobicContact CG2-CD2 3.92Å; V489-L538 HydrophobicContact CG2-CD1 4.49Å; L538-V547 HydrophobicContact CB-CG1 4.28Å; L538-V547 HydrophobicContact CD2-CG1 4.11Å; L538-V547 HydrophobicContact CG-CG1 4.25Å; L538-V547 WeakPolarHBondContact O-CG1 3.48Å; L538-F571 HydrophobicContact CB-CD1 3.78Å; L538-F571 HydrophobicContact CB-CD2 4.34Å; L538-F571 HydrophobicContact CB-CE1 3.77Å; L538-F571 HydrophobicContact CB-CE2 4.33Å; L538-F571 HydrophobicContact CB-CG 4.08Å; L538-F571 HydrophobicContact CB-CZ 4.05Å; L538-F571 HydrophobicContact CD2-CB 3.63Å; L538-F571 HydrophobicContact CD2-CD1 4.11Å; L538-F571 HydrophobicContact CD2-CD2 3.87Å; L538-F571 HydrophobicContact CD2-CG 3.6Å; L538-F571 HydrophobicContact CG-CG 4.49Å; L538-I573 HydrophobicContact CD2-CD1 4.24Å; L538-L586 HydrophobicContact CD1-CB 4.13Å; L538-L586 HydrophobicContact CD1-CD1 4.42Å; L538-L586 HydrophobicContact CD1-CD2 4.21Å; L538-L586 HydrophobicContact CG-CD2 4.19Å; L538-V588 HydrophobicContact CD1-CG2 3.86Å
539	Y	89.4	Confident	85.9	Confident	108 Å²	108	54.1 Å²	54.1	42%	0.424	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	135.4	-172.2	-52.7	-84	0	0	0	111.4	L586 R587 Q589	Y539-L586 CarbonylContact O-C 3.53Å; Y539-L586 WeakPolarHBondContact O-CA 3.44Å; Y539-R587 PolarHBondContact N-O 3.28Å; Y539-R587 PolarHBondContact O-N 3.1Å; Y539-Q589 HydrophobicContact CE2-CB 4.06Å; Y539-Q589 VanDerWaalsContact CE2-OE1 3.3Å
540	S	87.7	Confident	84.8	Confident	31 Å²	31	53.4 Å²	53.4	22%	0.217	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	136.2	168.1	178.6	0	0	0	0	110.3	M542 Y545	S540-M542 PolarHBondContact OG-N 3.42Å; S540-M542 PolarHBondContact OG-O 2.82Å; S540-Y545 VanDerWaalsContact CB-O 3.23Å; S540-Y545 WeakPolarHBondContact CB-O 3.33Å
541	N	84.7	Confident	82.9	Confident	91 Å²	91	58 Å²	58	49%	0.487	31%	0.313	S	S	.	.	S	Bend	trans	-81.8	-1.4	168.2	-158.2	86.7	0	0	0	112.8	T585	N541-T585 WeakPolarHBondContact CB-O 3.5Å; N541-T585 VanDerWaalsContact CB-OG1 3.32Å; N541-T585 WeakPolarHBondContact CB-OG1 3.35Å; N541-T585 PolarHBondContact N-O 3.02Å
542	M	80	Confident	81.2	Confident	73 Å²	73	59.7 Å²	59.7	36%	0.36	34%	0.335	S	S	.	.	S	Bend	trans	-121.1	119.7	-177.4	-70.4	-67.5	-78.2	0	0	110.1	S540 N544 Y545 F584	S540-M542 PolarHBondContact OG-N 3.42Å; S540-M542 PolarHBondContact OG-O 2.82Å; M542-N544 PolarHBondContact O-N 2.99Å; M542-N544 VanDerWaalsContact O-N 3.15Å; M542-Y545 HydrophobicContact CB-CD2 4.25Å; M542-Y545 PolarHBondContact O-N 2.86Å; M542-F584 HydrophobicContact CB-CB 4.06Å; M542-F584 HydrophobicContact CG-CB 3.55Å
543	S	75.8	Confident	79.6	Confident	116 Å²	116	62.7 Å²	62.7	81%	0.811	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-20.7	-174.6	54	0	0	0	0	114.2	Y545 H576	S543-Y545 PolarHBondContact O-N 2.92Å; S543-H576 PolarHBondContact O-CD2 3.24Å
544	N	79.7	Confident	78.8	Confident	39 Å²	39	60.9 Å²	60.9	21%	0.209	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-3.1	174.5	52.5	-70.8	0	0	0	114.5	M542 S575 H576	M542-N544 PolarHBondContact O-N 2.99Å; M542-N544 VanDerWaalsContact O-N 3.15Å; N544-S575 CarbonylContact O-C 3.59Å; N544-S575 WeakPolarHBondContact O-CA 3.25Å; N544-S575 PolarHBondContact O-OG 3.24Å; N544-H576 PolarHBondContact O-N 2.88Å
545	Y	84.2	Confident	78.6	Confident	6 Å²	6	63 Å²	63	2%	0.024	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	116.9	172.1	-67.3	-85.2	0	0	0	111.6	I481 S540 M542 S543 I573 I581 S582 F584	I481-Y545 HydrophobicContact CG2-CE1 4.1Å; S540-Y545 VanDerWaalsContact CB-O 3.23Å; S540-Y545 WeakPolarHBondContact CB-O 3.33Å; M542-Y545 HydrophobicContact CB-CD2 4.25Å; M542-Y545 PolarHBondContact O-N 2.86Å; S543-Y545 PolarHBondContact O-N 2.92Å; Y545-I573 HydrophobicContact CD1-CG2 4.3Å; Y545-I581 VanDerWaalsContact OH-CG2 3.22Å; Y545-I581 WeakPolarHBondContact OH-CG2 3.45Å; Y545-S582 PolarHBondContact OH-N 2.96Å; Y545-S582 PolarHBondContact OH-O 3.31Å; Y545-F584 AromaticContact CD1-CE1 3.85Å; Y545-F584 HydrophobicContact CD1-CE1 3.85Å; Y545-F584 AromaticContact CD1-CZ 3.97Å; Y545-F584 HydrophobicContact CD1-CZ 3.97Å; Y545-F584 AromaticContact CD2-CD1 3.65Å; Y545-F584 HydrophobicContact CD2-CD1 3.65Å; Y545-F584 HydrophobicContact CD2-CD2 4.21Å; Y545-F584 AromaticContact CD2-CE1 3.76Å; Y545-F584 HydrophobicContact CD2-CE1 3.76Å; Y545-F584 HydrophobicContact CD2-CE2 4.29Å; Y545-F584 AromaticContact CD2-CG 3.9Å; Y545-F584 HydrophobicContact CD2-CG 3.9Å; Y545-F584 HydrophobicContact CD2-CZ 4.09Å; Y545-F584 HydrophobicContact CE1-CD1 4.34Å; Y545-F584 AromaticContact CE1-CE1 3.76Å; Y545-F584 HydrophobicContact CE1-CE1 3.76Å; Y545-F584 HydrophobicContact CE1-CZ 4.33Å; Y545-F584 HydrophobicContact CE2-CB 4.49Å; Y545-F584 AromaticContact CE2-CD1 3.42Å; Y545-F584 HydrophobicContact CE2-CD1 3.42Å; Y545-F584 VanDerWaalsContact CE2-CD1 3.42Å; Y545-F584 AromaticContact CE2-CE1 3.69Å; Y545-F584 HydrophobicContact CE2-CE1 3.69Å; Y545-F584 HydrophobicContact CE2-CG 4.02Å; Y545-F584 HydrophobicContact CE2-CZ 4.46Å; Y545-F584 HydrophobicContact CG-CD1 4.22Å; Y545-F584 AromaticContact CG-CE1 3.85Å; Y545-F584 HydrophobicContact CG-CE1 3.85Å; Y545-F584 HydrophobicContact CG-CE2 4.19Å; Y545-F584 AromaticContact CG-CZ 3.83Å; Y545-F584 HydrophobicContact CG-CZ 3.83Å; Y545-F584 AromaticContact CZ-CD1 3.81Å; Y545-F584 AromaticContact CZ-CE1 3.69Å
546	Q	85.9	Confident	78.4	Confident	83 Å²	83	58.9 Å²	58.9	39%	0.388	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	132.9	170.4	-171.6	174.4	43.8	0	0	110.1	K548 I573 T574	Q546-K548 HydrophobicContact CG-CG 4.28Å; Q546-I573 WeakPolarHBondContact O-CA 3.33Å; Q546-T574 PolarHBondContact N-O 3.33Å; Q546-T574 PolarHBondContact O-N 2.94Å
547	V	86.9	Confident	78.2	Confident	33 Å²	33	64.2 Å²	64.2	20%	0.2	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.1	166.6	-174.4	0	0	0	0	108.1	L538 F571 I573 L586	L538-V547 HydrophobicContact CB-CG1 4.28Å; L538-V547 HydrophobicContact CD2-CG1 4.11Å; L538-V547 HydrophobicContact CG-CG1 4.25Å; L538-V547 WeakPolarHBondContact O-CG1 3.48Å; V547-F571 HydrophobicContact CG1-CB 4.17Å; V547-F571 HydrophobicContact CG1-CD1 4.1Å; V547-I573 HydrophobicContact CG1-CG1 4.33Å; V547-I573 HydrophobicContact CG2-CD1 4.31Å; V547-I573 HydrophobicContact CG2-CG1 4.21Å; V547-L586 HydrophobicContact CG2-CD2 4.18Å
548	K	81.1	Confident	78.1	Confident	104 Å²	104	64 Å²	64	45%	0.452	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	124.2	170.6	-61.8	-175.9	-178.1	-176.6	0	108.2	Q546 M572	Q546-K548 HydrophobicContact CG-CG 4.28Å; K548-M572 HydrophobicContact CB-CB 4.5Å; K548-M572 PolarHBondContact N-O 3.25Å; K548-M572 PolarHBondContact O-N 2.72Å
549	A	70.6	Confident	77.8	Confident	59 Å²	59	69.6 Å²	69.6	49%	0.488	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	149.2	164.2	0	0	0	0	0	109.1	F571	A549-F571 HydrophobicContact CB-CD1 4.31Å; A549-F571 HydrophobicContact CB-CE1 4.32Å
550	S	61	Low	77.7	Confident	52 Å²	52	67.5 Å²	67.5	36%	0.364	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-64.6	158	164.5	-172	0	0	0	0	110.2	G552 L570	S550-G552 CarbonylContact O-C 3.57Å; S550-G552 PolarHBondContact O-N 3.1Å; S550-L570 PolarHBondContact N-O 2.76Å
551	E	47.5	Very low	77.7	Confident	194 Å²	194	66.5 Å²	66.5	91%	0.907	37%	0.369	S	S	*	.	S	Bend	trans	-58.9	137.3	160	-67.4	176.9	160.4	0	0	108.6
552	G	53.7	Low	77.8	Confident	64 Å²	64	65.2 Å²	65.2	66%	0.66	36%	0.359	S	S	*	.	S	Bend	trans	90.7	80.1	-150.9	0	0	0	0	0	110.6	S550 G554	S550-G552 CarbonylContact O-C 3.57Å; S550-G552 PolarHBondContact O-N 3.1Å; G552-G554 PolarHBondContact O-N 3.45Å
553	T	56.1	Low	78	Confident	98 Å²	98	64.4 Å²	64.4	60%	0.601	36%	0.356	S	S	*	.			trans	-39	134.8	175.9	50.1	0	0	0	0	112	I555	T553-I555 PolarHBondContact O-N 2.86Å; T553-I555 WeakPolarHBondContact OG1-CD1 3.46Å
554	G	74.7	Confident	78	Confident	13 Å²	13	59.2 Å²	59.2	13%	0.134	32%	0.321	C	S	.	.	S	Bend	trans	-64.1	74.5	-177.8	0	0	0	0	0	113.5	Q535 I536 G552	Q535-G554 CarbonylContact C-O 3.54Å; Q535-G554 WeakPolarHBondContact CA-O 3.24Å; I536-G554 PolarHBondContact N-O 3.45Å; G552-G554 PolarHBondContact O-N 3.45Å
555	I	86.4	Confident	78.1	Confident	45 Å²	45	62 Å²	62	23%	0.231	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	123.7	-175.2	-59.5	177.5	0	0	0	107.2	D533 L534 Q535 T553	D533-I555 HydrophobicContact CB-CG2 4.41Å; L534-I555 CarbonylContact O-C 3.47Å; L534-I555 VanDerWaalsContact O-CA 3.31Å; L534-I555 WeakPolarHBondContact O-CA 3.33Å; Q535-I555 HydrophobicContact CB-CG1 4.3Å; Q535-I555 HydrophobicContact CG-CG1 4.21Å; T553-I555 PolarHBondContact O-N 2.86Å; T553-I555 WeakPolarHBondContact OG1-CD1 3.46Å
556	I	88.6	Confident	78.2	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	125.7	166.6	-57.9	173.9	0	0	0	106.9	M491 D533 L534 I536 Q560 V561 S567 L569	M491-I556 HydrophobicContact CB-CD1 3.55Å; M491-I556 HydrophobicContact CE-CD1 3.86Å; M491-I556 HydrophobicContact CE-CG2 3.98Å; M491-I556 HydrophobicContact CG-CD1 4.32Å; M491-I556 HydrophobicContact SD-CD1 3.88Å; D533-I556 WeakPolarHBondContact CA-O 3.47Å; L534-I556 PolarHBondContact N-O 3.27Å; L534-I556 PolarHBondContact O-N 2.94Å; I536-I556 HydrophobicContact CD1-CD1 3.54Å; I536-I556 HydrophobicContact CD1-CG1 4.15Å; I556-Q560 HydrophobicContact CG2-CB 4.24Å; I556-V561 HydrophobicContact CG2-CG2 3.76Å; I556-S567 WeakPolarHBondContact CG2-OG 3.35Å; I556-L569 HydrophobicContact CG1-CD1 4.04Å; I556-L569 HydrophobicContact CG1-CD2 4.45Å; I556-L569 HydrophobicContact CG1-CG 4.17Å
557	R	88.6	Confident	78.2	Confident	117 Å²	117	58.4 Å²	58.4	44%	0.442	32%	0.316	S	S	.	.			trans	-80.1	142.3	-179	-61.8	-64.6	-168.8	167.2	3.7	110.9	D533 F559 Q560 V561	D533-R557 VanDerWaalsContact OD1-CA 3.27Å; D533-R557 WeakPolarHBondContact OD1-CA 3.49Å; D533-R557 WeakPolarHBondContact OD2-CD 3.28Å; D533-R557 IonicContact OD2-CZ 2.65Å; D533-R557 IonicContact OD2-NE 2.67Å; D533-R557 IonicContact OD2-NH1 2.66Å; D533-R557 PolarHBondContact OD2-NH1 2.91Å; R557-F559 HydrophobicContact CB-CD1 3.53Å; R557-F559 HydrophobicContact CB-CE1 3.41Å; R557-F559 VanDerWaalsContact CB-CE1 3.41Å; R557-F559 HydrophobicContact CB-CG 4.47Å; R557-F559 HydrophobicContact CB-CZ 4.26Å; R557-F559 HydrophobicContact CG-CD1 4.38Å; R557-F559 HydrophobicContact CG-CE1 3.84Å; R557-F559 PolarHBondContact O-N 2.98Å; R557-F559 VanDerWaalsContact O-N 3.09Å; R557-Q560 HydrophobicContact CB-CG 4.25Å; R557-Q560 WeakPolarHBondContact O-CA 3.26Å; R557-Q560 VanDerWaalsContact O-CB 3.31Å; R557-Q560 WeakPolarHBondContact O-CB 3.47Å; R557-Q560 PolarHBondContact O-N 2.8Å; R557-V561 PolarHBondContact O-N 3.04Å
558	G	87	Confident	78.2	Confident	8 Å²	8	62 Å²	62	8%	0.082	33%	0.326	C	S	.	.	H	α-helix	trans	-56.4	-30.7	-177.2	0	0	0	0	0	113.9	P531 Q532 D533 V561 K562	P531-G558 WeakPolarHBondContact CB-O 3.2Å; Q532-G558 VanDerWaalsContact O-CA 3.22Å; Q532-G558 WeakPolarHBondContact O-CA 3.41Å; Q532-G558 PolarHBondContact O-N 2.68Å; D533-G558 PolarHBondContact OD1-N 2.67Å; G558-V561 PolarHBondContact O-N 3.33Å; G558-K562 WeakPolarHBondContact O-CB 3.22Å; G558-K562 PolarHBondContact O-N 2.95Å
559	F	85.1	Confident	78.5	Confident	128 Å²	128	58.3 Å²	58.3	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-66.5	-34.6	173.5	78	-98.1	0	0	0	113	R557 V561 K562 L563	R557-F559 HydrophobicContact CB-CD1 3.53Å; R557-F559 HydrophobicContact CB-CE1 3.41Å; R557-F559 VanDerWaalsContact CB-CE1 3.41Å; R557-F559 HydrophobicContact CB-CG 4.47Å; R557-F559 HydrophobicContact CB-CZ 4.26Å; R557-F559 HydrophobicContact CG-CD1 4.38Å; R557-F559 HydrophobicContact CG-CE1 3.84Å; R557-F559 PolarHBondContact O-N 2.98Å; R557-F559 VanDerWaalsContact O-N 3.09Å; F559-V561 VanDerWaalsContact C-N 3.34Å; F559-K562 PolarHBondContact O-N 3.17Å; F559-L563 HydrophobicContact CD2-CD1 4.34Å; F559-L563 WeakPolarHBondContact O-CB 3.05Å; F559-L563 VanDerWaalsContact O-CG 3.29Å; F559-L563 WeakPolarHBondContact O-CG 3.17Å; F559-L563 PolarHBondContact O-N 3.48Å
560	Q	86.1	Confident	79.3	Confident	64 Å²	64	57.8 Å²	57.8	30%	0.299	30%	0.3	S	S	.	.	H	α-helix	trans	-66.8	-40.2	176.4	-59.3	173	-48.7	0	0	110.4	I556 R557 L563 G564 K565	I556-Q560 HydrophobicContact CG2-CB 4.24Å; R557-Q560 HydrophobicContact CB-CG 4.25Å; R557-Q560 WeakPolarHBondContact O-CA 3.26Å; R557-Q560 VanDerWaalsContact O-CB 3.31Å; R557-Q560 WeakPolarHBondContact O-CB 3.47Å; R557-Q560 PolarHBondContact O-N 2.8Å; Q560-L563 PolarHBondContact O-N 2.8Å; Q560-G564 PolarHBondContact O-N 3.24Å; Q560-K565 PolarHBondContact O-N 2.78Å
561	V	87.6	Confident	80.5	Confident	9 Å²	9	55.7 Å²	55.7	6%	0.055	28%	0.284	C	S	.	.	H	α-helix	trans	-63.9	-44.5	173.9	-167.6	0	0	0	0	111.3	W464 M491 L528 P531 I556 R557 G558 F559 L563 G564	W464-V561 HydrophobicContact CH2-CG1 3.87Å; W464-V561 HydrophobicContact CZ2-CG1 4.44Å; M491-V561 HydrophobicContact CE-CB 4.4Å; M491-V561 HydrophobicContact CE-CG1 4.1Å; M491-V561 HydrophobicContact CE-CG2 3.59Å; L528-V561 HydrophobicContact CD2-CG1 3.71Å; P531-V561 HydrophobicContact CB-CB 4.41Å; I556-V561 HydrophobicContact CG2-CG2 3.76Å; R557-V561 PolarHBondContact O-N 3.04Å; G558-V561 PolarHBondContact O-N 3.33Å; F559-V561 VanDerWaalsContact C-N 3.34Å; V561-L563 VanDerWaalsContact C-N 3.32Å; V561-L563 PolarHBondContact O-N 3.4Å; V561-G564 PolarHBondContact O-N 3.12Å
562	K	86.8	Confident	82.4	Confident	65 Å²	65	50.5 Å²	50.5	28%	0.283	26%	0.261	S	S	.	.	H	α-helix	trans	-61.9	-37.3	178.3	-171.9	174.9	178.7	177.4	0	112.6	N368 P531 G558 F559 G564	N368-K562 WeakPolarHBondContact OD1-CE 3.43Å; N368-K562 PolarHBondContact OD1-NZ 3.47Å; P531-K562 HydrophobicContact CB-CB 3.83Å; P531-K562 HydrophobicContact CG-CB 3.97Å; P531-K562 HydrophobicContact CG-CG 4.18Å; G558-K562 WeakPolarHBondContact O-CB 3.22Å; G558-K562 PolarHBondContact O-N 2.95Å; F559-K562 PolarHBondContact O-N 3.17Å; K562-G564 PolarHBondContact O-N 2.89Å
563	L	83.6	Confident	84	Confident	55 Å²	55	47.5 Å²	47.5	29%	0.288	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-2.4	175.4	-69.3	176.8	0	0	0	114.1	L363 N366 F559 Q560 V561 K565	L363-L563 HydrophobicContact CD2-CD1 4.4Å; L363-L563 HydrophobicContact CD2-CD2 4.08Å; N366-L563 PolarHBondContact ND2-O 2.71Å; F559-L563 HydrophobicContact CD2-CD1 4.34Å; F559-L563 WeakPolarHBondContact O-CB 3.05Å; F559-L563 VanDerWaalsContact O-CG 3.29Å; F559-L563 WeakPolarHBondContact O-CG 3.17Å; F559-L563 PolarHBondContact O-N 3.48Å; Q560-L563 PolarHBondContact O-N 2.8Å; V561-L563 VanDerWaalsContact C-N 3.32Å; V561-L563 PolarHBondContact O-N 3.4Å; L563-K565 PolarHBondContact O-N 2.96Å; L563-K565 VanDerWaalsContact O-N 3.11Å
564	G	77.1	Confident	85.5	Confident	7 Å²	7	44.1 Å²	44.1	7%	0.072	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	2.9	-179.9	0	0	0	0	0	115.6	P361 Q560 V561 K562	P361-G564 WeakPolarHBondContact CD-O 3.46Å; Q560-G564 PolarHBondContact O-N 3.24Å; V561-G564 PolarHBondContact O-N 3.12Å; K562-G564 PolarHBondContact O-N 2.89Å
565	K	81.8	Confident	86.1	Confident	97 Å²	97	44.3 Å²	44.3	42%	0.422	21%	0.208	S	C	.	.			trans	-67.3	141.4	-176.7	-94.1	-175.6	172.3	176.4	0	112.5	Q560 L563 S567	Q560-K565 PolarHBondContact O-N 2.78Å; L563-K565 PolarHBondContact O-N 2.96Å; L563-K565 VanDerWaalsContact O-N 3.11Å; K565-S567 PolarHBondContact O-N 3.24Å; K565-S567 PolarHBondContact O-OG 3.21Å
566	V	85.6	Confident	85.9	Confident	5 Å²	5	48.1 Å²	48.1	3%	0.03	23%	0.225	C	C	.	.			trans	-70.2	102.7	177	-179.8	0	0	0	0	109.1	L359 D360 A490 M491 F492 R568	L359-V566 HydrophobicContact CB-CG2 3.82Å; L359-V566 VanDerWaalsContact O-CG2 3.27Å; L359-V566 WeakPolarHBondContact O-CG2 3.47Å; D360-V566 PolarHBondContact OD1-N 3.17Å; A490-V566 HydrophobicContact CB-CG1 4.35Å; M491-V566 WeakPolarHBondContact O-CA 3.42Å; F492-V566 HydrophobicContact CD1-CB 4.34Å; F492-V566 HydrophobicContact CD1-CG1 3.7Å; F492-V566 HydrophobicContact CD1-CG2 3.64Å; F492-V566 HydrophobicContact CE1-CB 4.48Å; F492-V566 HydrophobicContact CE1-CG1 3.5Å; F492-V566 HydrophobicContact CE1-CG2 4.08Å; F492-V566 HydrophobicContact CG-CG1 4.44Å; F492-V566 HydrophobicContact CZ-CG1 4.11Å; V566-R568 HydrophobicContact CG1-CG 4.09Å; V566-R568 PolarHBondContact O-NH1 3.4Å
567	S	86.9	Confident	85.5	Confident	10 Å²	10	51.2 Å²	51.2	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	120.1	-175.7	-62	0	0	0	0	109	A490 M491 I556 K565	A490-S567 CarbonylContact C-O 3.6Å; A490-S567 WeakPolarHBondContact CA-O 3.27Å; M491-S567 PolarHBondContact N-O 2.84Å; M491-S567 PolarHBondContact O-N 2.88Å; I556-S567 WeakPolarHBondContact CG2-OG 3.35Å; K565-S567 PolarHBondContact O-N 3.24Å; K565-S567 PolarHBondContact O-OG 3.21Å
568	R	86.6	Confident	84.7	Confident	109 Å²	109	49.8 Å²	49.8	41%	0.411	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	106.3	-167.2	-62.5	159.4	176.7	100.6	-13.6	109.3	D360 V488 A490 V566	D360-R568 IonicContact OD1-NH1 3.57Å; D360-R568 PolarHBondContact OD1-NH1 2.95Å; D360-R568 IonicContact OD2-CZ 3.2Å; D360-R568 IonicContact OD2-NH1 3.62Å; D360-R568 PolarHBondContact OD2-NH1 3.02Å; D360-R568 IonicContact OD2-NH2 3.13Å; D360-R568 PolarHBondContact OD2-NH2 3.02Å; V488-R568 HydrophobicContact CG1-CB 4.17Å; A490-R568 HydrophobicContact CB-CG 4.34Å; V566-R568 HydrophobicContact CG1-CG 4.09Å; V566-R568 PolarHBondContact O-NH1 3.4Å
569	L	87.6	Confident	83.7	Confident	26 Å²	26	54 Å²	54	14%	0.136	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137.1	178.4	-63.8	-178.6	0	0	0	111.1	V488 V489 I536 I556 F571	V488-L569 CarbonylContact C-O 3.56Å; V488-L569 VanDerWaalsContact CA-O 3.25Å; V488-L569 WeakPolarHBondContact CA-O 3.4Å; V489-L569 PolarHBondContact N-O 2.78Å; V489-L569 PolarHBondContact O-N 3.34Å; I536-L569 HydrophobicContact CB-CD1 3.75Å; I536-L569 HydrophobicContact CD1-CD1 3.89Å; I536-L569 HydrophobicContact CG1-CD1 4.14Å; I536-L569 HydrophobicContact CG2-CD1 4.32Å; I556-L569 HydrophobicContact CG1-CD1 4.04Å; I556-L569 HydrophobicContact CG1-CD2 4.45Å; I556-L569 HydrophobicContact CG1-CG 4.17Å; L569-F571 HydrophobicContact CB-CE2 3.85Å; L569-F571 HydrophobicContact CB-CZ 4.48Å
570	L	86.8	Confident	83.1	Confident	47 Å²	47	50.5 Å²	50.5	25%	0.246	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.7	-173.8	-163.7	144.5	0	0	0	112.1	K486 V488 V503 S550	K486-L570 HydrophobicContact CB-CD2 4.39Å; K486-L570 HydrophobicContact CD-CD1 4.17Å; K486-L570 HydrophobicContact CD-CD2 4.21Å; K486-L570 HydrophobicContact CG-CD2 4.1Å; V488-L570 HydrophobicContact CG2-CB 4.34Å; V488-L570 HydrophobicContact CG2-CD1 4Å; V488-L570 HydrophobicContact CG2-CG 4.07Å; V503-L570 HydrophobicContact CG1-CD1 4.43Å; S550-L570 PolarHBondContact N-O 2.76Å
571	F	87.3	Confident	82.7	Confident	8 Å²	8	49.6 Å²	49.6	4%	0.035	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	130.9	179.3	-62.1	-93.3	0	0	0	109.3	T487 V489 I536 L538 V547 A549 L569	T487-F571 PolarHBondContact N-O 3.44Å; T487-F571 PolarHBondContact O-N 2.74Å; T487-F571 VanDerWaalsContact O-O 3.13Å; V489-F571 HydrophobicContact CB-CE2 4.06Å; V489-F571 HydrophobicContact CG2-CD2 3.91Å; V489-F571 HydrophobicContact CG2-CE2 3.7Å; I536-F571 HydrophobicContact CG2-CZ 4.28Å; I536-F571 WeakPolarHBondContact O-CZ 3.32Å; L538-F571 HydrophobicContact CB-CD1 3.78Å; L538-F571 HydrophobicContact CB-CD2 4.34Å; L538-F571 HydrophobicContact CB-CE1 3.77Å; L538-F571 HydrophobicContact CB-CE2 4.33Å; L538-F571 HydrophobicContact CB-CG 4.08Å; L538-F571 HydrophobicContact CB-CZ 4.05Å; L538-F571 HydrophobicContact CD2-CB 3.63Å; L538-F571 HydrophobicContact CD2-CD1 4.11Å; L538-F571 HydrophobicContact CD2-CD2 3.87Å; L538-F571 HydrophobicContact CD2-CG 3.6Å; L538-F571 HydrophobicContact CG-CG 4.49Å; V547-F571 HydrophobicContact CG1-CB 4.17Å; V547-F571 HydrophobicContact CG1-CD1 4.1Å; A549-F571 HydrophobicContact CB-CD1 4.31Å; A549-F571 HydrophobicContact CB-CE1 4.32Å; L569-F571 HydrophobicContact CB-CE2 3.85Å; L569-F571 HydrophobicContact CB-CZ 4.48Å
572	M	85.9	Confident	82.4	Confident	86 Å²	86	51.2 Å²	51.2	42%	0.424	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.7	170.3	-169.5	-167.6	-58.3	0	0	108.8	K548 T574	K548-M572 HydrophobicContact CB-CB 4.5Å; K548-M572 PolarHBondContact N-O 3.25Å; K548-M572 PolarHBondContact O-N 2.72Å; M572-T574 HydrophobicContact CG-CG2 4.2Å; M572-T574 HydrophobicContact SD-CG2 3.99Å
573	I	88.8	Confident	82.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.8	176	-53.2	-173.9	0	0	0	108.8	S484 F485 T487 L538 Y545 Q546 V547 F584 L586	S484-I573 WeakPolarHBondContact CA-O 3.27Å; F485-I573 HydrophobicContact CD2-CB 4.35Å; F485-I573 HydrophobicContact CE1-CB 4.19Å; F485-I573 HydrophobicContact CE1-CG2 4.21Å; F485-I573 HydrophobicContact CE2-CB 3.8Å; F485-I573 HydrophobicContact CE2-CD1 3.87Å; F485-I573 HydrophobicContact CE2-CG1 4.15Å; F485-I573 HydrophobicContact CE2-CG2 4.35Å; F485-I573 HydrophobicContact CZ-CB 3.72Å; F485-I573 HydrophobicContact CZ-CD1 4.19Å; F485-I573 HydrophobicContact CZ-CG1 4.44Å; F485-I573 HydrophobicContact CZ-CG2 3.8Å; F485-I573 PolarHBondContact N-O 3.42Å; F485-I573 PolarHBondContact O-N 3.5Å; T487-I573 HydrophobicContact CG2-CD1 4.47Å; L538-I573 HydrophobicContact CD2-CD1 4.24Å; Y545-I573 HydrophobicContact CD1-CG2 4.3Å; Q546-I573 WeakPolarHBondContact O-CA 3.33Å; V547-I573 HydrophobicContact CG1-CG1 4.33Å; V547-I573 HydrophobicContact CG2-CD1 4.31Å; V547-I573 HydrophobicContact CG2-CG1 4.21Å; I573-F584 HydrophobicContact CG2-CZ 4.11Å; I573-L586 HydrophobicContact CD1-CD1 3.79Å; I573-L586 HydrophobicContact CD1-CD2 3.92Å; I573-L586 HydrophobicContact CD1-CG 4.49Å
574	T	87.1	Confident	82.4	Confident	28 Å²	28	48.5 Å²	48.5	17%	0.172	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	126	-175.1	53.2	0	0	0	0	111.1	P483 Q546 M572	P483-T574 CarbonylContact O-C 3.51Å; P483-T574 WeakPolarHBondContact O-CA 3.49Å; Q546-T574 PolarHBondContact N-O 3.33Å; Q546-T574 PolarHBondContact O-N 2.94Å; M572-T574 HydrophobicContact CG-CG2 4.2Å; M572-T574 HydrophobicContact SD-CG2 3.99Å
575	S	86	Confident	83	Confident	17 Å²	17	50.6 Å²	50.6	12%	0.119	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	135.2	171.3	-175.8	0	0	0	0	110.9	P483 N544 N577	P483-S575 PolarHBondContact O-N 3.19Å; N544-S575 CarbonylContact O-C 3.59Å; N544-S575 WeakPolarHBondContact O-CA 3.25Å; N544-S575 PolarHBondContact O-OG 3.24Å; S575-N577 PolarHBondContact O-N 2.89Å; S575-N577 VanDerWaalsContact OG-C 3.32Å; S575-N577 PolarHBondContact OG-N 3.03Å; S575-N577 VanDerWaalsContact OG-N 3.1Å; S575-N577 PolarHBondContact OG-O 2.72Å
576	H	83.1	Confident	83.4	Confident	124 Å²	124	46 Å²	46	57%	0.574	26%	0.255	S	S	*	.	S	Bend	trans	-70.8	-18.6	168.8	-70.7	-72	0	0	0	112.9	S543 N544	S543-H576 PolarHBondContact O-CD2 3.24Å; N544-H576 PolarHBondContact O-N 2.88Å
577	N	79.7	Confident	83.8	Confident	66 Å²	66	50.5 Å²	50.5	35%	0.353	27%	0.272	S	S	.	.			trans	-132.2	108	175.1	-173.3	-13.4	0	0	0	110.9	S575 S579 S580	S575-N577 PolarHBondContact O-N 2.89Å; S575-N577 VanDerWaalsContact OG-C 3.32Å; S575-N577 PolarHBondContact OG-N 3.03Å; S575-N577 VanDerWaalsContact OG-N 3.1Å; S575-N577 PolarHBondContact OG-O 2.72Å; N577-S579 PolarHBondContact O-N 3.2Å; N577-S579 WeakPolarHBondContact OD1-CB 3.4Å; N577-S579 PolarHBondContact OD1-N 3.06Å; N577-S579 PolarHBondContact OD1-OG 2.98Å; N577-S580 WeakPolarHBondContact CB-OG 3.44Å; N577-S580 VanDerWaalsContact CG-OG 3.28Å; N577-S580 PolarHBondContact ND2-OG 2.65Å
578	P	72.3	Confident	84.1	Confident	87 Å²	87	50 Å²	50	57%	0.565	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.5	-179	29.9	-35.7	0	0	0	113.6	P483	P483-P578 HydrophobicContact CB-CB 3.88Å; P483-P578 HydrophobicContact CG-CB 4.03Å
579	S	66.6	Low	84.4	Confident	95 Å²	95	46.1 Å²	46.1	66%	0.664	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-21.4	-178.3	72.6	0	0	0	0	114.2	N577	N577-S579 PolarHBondContact O-N 3.2Å; N577-S579 WeakPolarHBondContact OD1-CB 3.4Å; N577-S579 PolarHBondContact OD1-N 3.06Å; N577-S579 PolarHBondContact OD1-OG 2.98Å
580	S	71	Confident	84.7	Confident	56 Å²	56	44.9 Å²	44.9	39%	0.392	25%	0.248	S	C	.	.	S	Bend	trans	-120	52.6	-171.1	66.8	0	0	0	0	112.3	N577	N577-S580 WeakPolarHBondContact CB-OG 3.44Å; N577-S580 VanDerWaalsContact CG-OG 3.28Å; N577-S580 PolarHBondContact ND2-OG 2.65Å
581	I	79.2	Confident	85	Confident	45 Å²	45	44 Å²	44	23%	0.231	24%	0.242	C	C	.	.			trans	-72	130	178.1	-40.6	178.2	0	0	0	109.9	I481 P483 Y545 P608	I481-I581 HydrophobicContact CB-CG2 3.97Å; I481-I581 HydrophobicContact CG2-CG2 3.43Å; I481-I581 VanDerWaalsContact CG2-CG2 3.43Å; P483-I581 HydrophobicContact CG-CD1 3.8Å; Y545-I581 VanDerWaalsContact OH-CG2 3.22Å; Y545-I581 WeakPolarHBondContact OH-CG2 3.45Å; I581-P608 HydrophobicContact CB-CB 4.16Å; I581-P608 HydrophobicContact CG2-CB 3.82Å
582	S	79.8	Confident	85.1	Confident	42 Å²	42	44.7 Å²	44.7	29%	0.294	25%	0.247	S	C	.	.			trans	-137.9	164.2	175.1	59.8	0	0	0	0	110.1	I481 Y545	I481-S582 VanDerWaalsContact CD1-O 3.29Å; I481-S582 WeakPolarHBondContact CD1-O 3.02Å; Y545-S582 PolarHBondContact OH-N 2.96Å; Y545-S582 PolarHBondContact OH-O 3.31Å
583	D	83.7	Confident	85	Confident	56 Å²	56	44.6 Å²	44.6	30%	0.299	26%	0.26	S	S	.	.			trans	-72.6	150.5	166.2	57.6	-58	0	0	0	111.8	I481 Q604 T605	I481-D583 HydrophobicContact CD1-CB 4.15Å; D583-Q604 PolarHBondContact OD2-NE2 2.96Å; D583-T605 WeakPolarHBondContact CB-O 3.38Å
584	F	87.8	Confident	84.9	Confident	8 Å²	8	51.6 Å²	51.6	4%	0.035	30%	0.296	C	S	.	.			trans	-147.7	176.4	-176.2	63.3	-78.8	0	0	0	110.7	I481 F485 M542 Y545 I573 L586 T605	I481-F584 HydrophobicContact CD1-CD1 4.11Å; I481-F584 HydrophobicContact CD1-CE1 4.1Å; I481-F584 HydrophobicContact CG2-CE1 4.34Å; F485-F584 HydrophobicContact CZ-CZ 4.25Å; M542-F584 HydrophobicContact CB-CB 4.06Å; M542-F584 HydrophobicContact CG-CB 3.55Å; Y545-F584 AromaticContact CD1-CE1 3.85Å; Y545-F584 HydrophobicContact CD1-CE1 3.85Å; Y545-F584 AromaticContact CD1-CZ 3.97Å; Y545-F584 HydrophobicContact CD1-CZ 3.97Å; Y545-F584 AromaticContact CD2-CD1 3.65Å; Y545-F584 HydrophobicContact CD2-CD1 3.65Å; Y545-F584 HydrophobicContact CD2-CD2 4.21Å; Y545-F584 AromaticContact CD2-CE1 3.76Å; Y545-F584 HydrophobicContact CD2-CE1 3.76Å; Y545-F584 HydrophobicContact CD2-CE2 4.29Å; Y545-F584 AromaticContact CD2-CG 3.9Å; Y545-F584 HydrophobicContact CD2-CG 3.9Å; Y545-F584 HydrophobicContact CD2-CZ 4.09Å; Y545-F584 HydrophobicContact CE1-CD1 4.34Å; Y545-F584 AromaticContact CE1-CE1 3.76Å; Y545-F584 HydrophobicContact CE1-CE1 3.76Å; Y545-F584 HydrophobicContact CE1-CZ 4.33Å; Y545-F584 HydrophobicContact CE2-CB 4.49Å; Y545-F584 AromaticContact CE2-CD1 3.42Å; Y545-F584 HydrophobicContact CE2-CD1 3.42Å; Y545-F584 VanDerWaalsContact CE2-CD1 3.42Å; Y545-F584 AromaticContact CE2-CE1 3.69Å; Y545-F584 HydrophobicContact CE2-CE1 3.69Å; Y545-F584 HydrophobicContact CE2-CG 4.02Å; Y545-F584 HydrophobicContact CE2-CZ 4.46Å; Y545-F584 HydrophobicContact CG-CD1 4.22Å; Y545-F584 AromaticContact CG-CE1 3.85Å; Y545-F584 HydrophobicContact CG-CE1 3.85Å; Y545-F584 HydrophobicContact CG-CE2 4.19Å; Y545-F584 AromaticContact CG-CZ 3.83Å; Y545-F584 HydrophobicContact CG-CZ 3.83Å; Y545-F584 AromaticContact CZ-CD1 3.81Å; Y545-F584 AromaticContact CZ-CE1 3.69Å; I573-F584 HydrophobicContact CG2-CZ 4.11Å; F584-L586 HydrophobicContact CD2-CG 4.41Å; F584-L586 HydrophobicContact CE2-CD2 3.78Å; F584-L586 HydrophobicContact CE2-CG 3.84Å; F584-T605 HydrophobicContact CD1-CG2 4Å; F584-T605 HydrophobicContact CD2-CG2 4.22Å; F584-T605 HydrophobicContact CE1-CG2 3.79Å; F584-T605 HydrophobicContact CE2-CG2 4.03Å; F584-T605 HydrophobicContact CG-CG2 4.21Å; F584-T605 HydrophobicContact CZ-CG2 3.8Å; F584-T605 PolarHBondContact N-OG1 3.48Å; F584-T605 PolarHBondContact O-N 3.38Å; F584-T605 PolarHBondContact O-OG1 3.2Å
585	T	89.6	Confident	84.8	Confident	50 Å²	50	54.5 Å²	54.5	31%	0.307	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	133.9	175.3	47.1	0	0	0	0	111.3	N541 V603 Q604	N541-T585 WeakPolarHBondContact CB-O 3.5Å; N541-T585 VanDerWaalsContact CB-OG1 3.32Å; N541-T585 WeakPolarHBondContact CB-OG1 3.35Å; N541-T585 PolarHBondContact N-O 3.02Å; T585-V603 WeakPolarHBondContact CA-O 3.25Å; T585-Q604 HydrophobicContact CG2-CB 4.46Å
586	L	91.3	Very high	84.9	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	127.6	169.8	-77.1	169.6	0	0	0	109.3	W521 L538 Y539 V547 I573 F584 C602 V603 T605	W521-L586 HydrophobicContact CE3-CD1 4.14Å; W521-L586 HydrophobicContact CZ3-CD1 3.72Å; L538-L586 HydrophobicContact CD1-CB 4.13Å; L538-L586 HydrophobicContact CD1-CD1 4.42Å; L538-L586 HydrophobicContact CD1-CD2 4.21Å; L538-L586 HydrophobicContact CG-CD2 4.19Å; Y539-L586 CarbonylContact O-C 3.53Å; Y539-L586 WeakPolarHBondContact O-CA 3.44Å; V547-L586 HydrophobicContact CG2-CD2 4.18Å; I573-L586 HydrophobicContact CD1-CD1 3.79Å; I573-L586 HydrophobicContact CD1-CD2 3.92Å; I573-L586 HydrophobicContact CD1-CG 4.49Å; F584-L586 HydrophobicContact CD2-CG 4.41Å; F584-L586 HydrophobicContact CE2-CD2 3.78Å; F584-L586 HydrophobicContact CE2-CG 3.84Å; L586-C602 CarbonylContact O-C 3.21Å; L586-C602 VanDerWaalsContact O-CA 3.28Å; L586-C602 WeakPolarHBondContact O-CA 3.35Å; L586-V603 PolarHBondContact N-O 3.18Å; L586-V603 PolarHBondContact O-N 3.38Å; L586-T605 HydrophobicContact CD1-CG2 4Å; L586-T605 HydrophobicContact CG-CG2 4.22Å
587	R	92.4	Very high	85.3	Confident	100 Å²	100	55.6 Å²	55.6	38%	0.377	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.7	169.6	-170	-174.2	-53.5	-175.3	6.5	108.8	Y539 F601	Y539-R587 PolarHBondContact N-O 3.28Å; Y539-R587 PolarHBondContact O-N 3.1Å; R587-F601 WeakPolarHBondContact CA-O 3.46Å
588	V	93.8	Very high	85.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137	168.1	-168.4	0	0	0	0	108.2	L473 V475 I536 G537 L538 Q600 F601	L473-V588 HydrophobicContact CD2-CG1 3.72Å; V475-V588 HydrophobicContact CG2-CG2 3.56Å; I536-V588 HydrophobicContact CG2-CG1 4.12Å; G537-V588 WeakPolarHBondContact O-CA 3.33Å; L538-V588 HydrophobicContact CD1-CG2 3.86Å; V588-Q600 VanDerWaalsContact O-CA 3.24Å; V588-Q600 WeakPolarHBondContact O-CA 3.47Å; V588-F601 HydrophobicContact CB-CD1 4.12Å; V588-F601 HydrophobicContact CB-CE1 3.71Å; V588-F601 HydrophobicContact CB-CE2 4.25Å; V588-F601 HydrophobicContact CB-CZ 3.79Å; V588-F601 HydrophobicContact CG1-CE1 3.93Å; V588-F601 HydrophobicContact CG1-CZ 4.11Å; V588-F601 HydrophobicContact CG2-CD2 4.5Å; V588-F601 HydrophobicContact CG2-CE1 4.23Å; V588-F601 HydrophobicContact CG2-CE2 3.92Å; V588-F601 HydrophobicContact CG2-CZ 3.77Å; V588-F601 PolarHBondContact N-O 2.84Å; V588-F601 PolarHBondContact O-N 3.37Å
589	Q	93.4	Very high	86.8	Confident	27 Å²	27	52.4 Å²	52.4	13%	0.126	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	125.4	177.5	-172.5	-179.4	11.1	0	0	108.2	I536 G537 Y539 K591 I597	I536-Q589 CarbonylContact C-O 3.56Å; I536-Q589 WeakPolarHBondContact CA-O 3.48Å; G537-Q589 PolarHBondContact N-O 2.59Å; G537-Q589 PolarHBondContact O-N 2.89Å; Y539-Q589 HydrophobicContact CE2-CB 4.06Å; Y539-Q589 VanDerWaalsContact CE2-OE1 3.3Å; Q589-K591 HydrophobicContact CG-CG 4.29Å; Q589-K591 VanDerWaalsContact NE2-CE 3.35Å; Q589-I597 HydrophobicContact CG-CG2 4.01Å
590	V	93.8	Very high	88.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.3	174	-171.4	0	0	0	0	108.1	L473 F526 L534 I536 L598 T599	L473-V590 HydrophobicContact CD2-CG2 3.74Å; F526-V590 HydrophobicContact CE1-CG2 4.34Å; F526-V590 HydrophobicContact CE2-CG1 4.44Å; F526-V590 HydrophobicContact CZ-CG1 4Å; F526-V590 HydrophobicContact CZ-CG2 4.42Å; L534-V590 HydrophobicContact CB-CG1 4.32Å; L534-V590 HydrophobicContact CD2-CG1 4.38Å; I536-V590 HydrophobicContact CG1-CG1 4.39Å; I536-V590 HydrophobicContact CG1-CG2 4.37Å; V590-L598 HydrophobicContact CG1-CD1 4.46Å; V590-L598 PolarHBondContact O-N 2.87Å; V590-T599 HydrophobicContact CB-CG2 3.88Å; V590-T599 HydrophobicContact CG2-CG2 3.76Å; V590-T599 PolarHBondContact N-O 3.09Å; V590-T599 PolarHBondContact O-N 2.88Å
591	K	91.9	Very high	89.2	Confident	28 Å²	28	51.6 Å²	51.6	12%	0.122	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	159.2	176.9	-55.5	-178.4	176.6	-167.7	0	111	L534 Q535 Q589 D595 C596	L534-K591 CarbonylContact C-O 3.53Å; L534-K591 WeakPolarHBondContact CA-O 3.45Å; Q535-K591 HydrophobicContact CB-CB 4.38Å; Q535-K591 PolarHBondContact N-O 3.13Å; Q535-K591 PolarHBondContact O-N 2.99Å; Q589-K591 HydrophobicContact CG-CG 4.29Å; Q589-K591 VanDerWaalsContact NE2-CE 3.35Å; K591-D595 HydrophobicContact CD-CB 4.44Å; K591-D595 WeakPolarHBondContact CD-O 3.44Å; K591-D595 WeakPolarHBondContact CD-OD1 3.43Å; K591-D595 WeakPolarHBondContact CE-OD1 3.3Å; K591-D595 IonicContact NZ-OD1 2.8Å; K591-D595 PolarHBondContact NZ-OD1 2.68Å; K591-D595 IonicContact NZ-OD2 3.77Å; K591-D595 PolarHBondContact NZ-OD2 3.29Å; K591-C596 CarbonylContact C-O 3.57Å; K591-C596 WeakPolarHBondContact CA-O 3.46Å
592	D	89.8	Confident	89.9	Confident	24 Å²	24	53.3 Å²	53.3	13%	0.128	30%	0.296	C	S	.	.			trans	-85.7	-175	165.2	61.5	26.6	0	0	0	112.1	L594 D595 C596 L598	D592-L594 PolarHBondContact O-N 2.77Å; D592-L594 WeakPolarHBondContact OD1-CA 3.49Å; D592-L594 WeakPolarHBondContact OD1-CB 3.38Å; D592-L594 PolarHBondContact OD1-N 2.95Å; D592-D595 PolarHBondContact O-N 3.32Å; D592-D595 PolarHBondContact OD1-N 3.05Å; D592-C596 PolarHBondContact N-O 2.8Å; D592-C596 WeakPolarHBondContact OD1-CB 3.38Å; D592-C596 PolarHBondContact OD1-N 2.91Å; D592-C596 WeakPolarHBondContact OD2-CB 3.43Å; D592-L598 HydrophobicContact CB-CD1 4.16Å; D592-L598 HydrophobicContact CB-CD2 4.23Å; D592-L598 HydrophobicContact CB-CG 4.3Å
593	A	84.8	Confident	90.5	Very high	84 Å²	84	51.6 Å²	51.6	69%	0.694	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-3.2	176.9	0	0	0	0	0	114.6
594	L	86.8	Confident	90.7	Very high	147 Å²	147	54.9 Å²	54.9	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	13.5	175.3	-56.4	176.6	0	0	0	111.8	D592 C596	D592-L594 PolarHBondContact O-N 2.77Å; D592-L594 WeakPolarHBondContact OD1-CA 3.49Å; D592-L594 WeakPolarHBondContact OD1-CB 3.38Å; D592-L594 PolarHBondContact OD1-N 2.95Å; L594-C596 PolarHBondContact O-N 3Å
595	D	84.3	Confident	90.7	Very high	88 Å²	88	54.7 Å²	54.7	47%	0.471	30%	0.297	S	S	.	.	S	Bend	trans	63	8.9	-174.6	-155.4	66.7	0	0	0	114.5	K591 D592	K591-D595 HydrophobicContact CD-CB 4.44Å; K591-D595 WeakPolarHBondContact CD-O 3.44Å; K591-D595 WeakPolarHBondContact CD-OD1 3.43Å; K591-D595 WeakPolarHBondContact CE-OD1 3.3Å; K591-D595 IonicContact NZ-OD1 2.8Å; K591-D595 PolarHBondContact NZ-OD1 2.68Å; K591-D595 IonicContact NZ-OD2 3.77Å; K591-D595 PolarHBondContact NZ-OD2 3.29Å; D592-D595 PolarHBondContact O-N 3.32Å; D592-D595 PolarHBondContact OD1-N 3.05Å
596	C	88.5	Confident	90.5	Very high	73 Å²	73	53.9 Å²	53.9	49%	0.493	29%	0.293	S	S	.	.			trans	-76.7	135.5	179.7	-76.4	0	0	0	0	111.3	K591 D592 L594 L598	K591-C596 CarbonylContact C-O 3.57Å; K591-C596 WeakPolarHBondContact CA-O 3.46Å; D592-C596 PolarHBondContact N-O 2.8Å; D592-C596 WeakPolarHBondContact OD1-CB 3.38Å; D592-C596 PolarHBondContact OD1-N 2.91Å; D592-C596 WeakPolarHBondContact OD2-CB 3.43Å; L594-C596 PolarHBondContact O-N 3Å; C596-L598 PolarHBondContact O-N 3.33Å
597	I	90.9	Very high	89.8	Confident	92 Å²	92	60.7 Å²	60.7	47%	0.472	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	111.4	-172.7	-47.1	175.2	0	0	0	110.4	Q589	Q589-I597 HydrophobicContact CG-CG2 4.01Å
598	L	90.8	Very high	88.9	Confident	66 Å²	66	57.7 Å²	57.7	35%	0.346	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-38.1	176.2	-56	177.1	0	0	0	112	L528 L534 V590 D592 C596	L528-L598 HydrophobicContact CD1-CD1 4.46Å; L534-L598 HydrophobicContact CD2-CD1 3.36Å; V590-L598 HydrophobicContact CG1-CD1 4.46Å; V590-L598 PolarHBondContact O-N 2.87Å; D592-L598 HydrophobicContact CB-CD1 4.16Å; D592-L598 HydrophobicContact CB-CD2 4.23Å; D592-L598 HydrophobicContact CB-CG 4.3Å; C596-L598 PolarHBondContact O-N 3.33Å
599	T	93.5	Very high	87.5	Confident	20 Å²	20	60 Å²	60	12%	0.123	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	158.3	170.6	-174.9	0	0	0	0	111.8	H524 F526 V590	H524-T599 PolarHBondContact NE2-OG1 3.13Å; F526-T599 HydrophobicContact CB-CG2 4Å; F526-T599 HydrophobicContact CD1-CG2 3.59Å; F526-T599 HydrophobicContact CD2-CG2 4.13Å; F526-T599 HydrophobicContact CE1-CG2 4.01Å; F526-T599 HydrophobicContact CG-CG2 3.65Å; F526-T599 HydrophobicContact CZ-CG2 4.46Å; V590-T599 HydrophobicContact CB-CG2 3.88Å; V590-T599 HydrophobicContact CG2-CG2 3.76Å; V590-T599 PolarHBondContact N-O 3.09Å; V590-T599 PolarHBondContact O-N 2.88Å
600	Q	93.3	Very high	85.8	Confident	108 Å²	108	62.4 Å²	62.4	51%	0.505	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	144.8	167.5	58.5	174.7	-8.7	0	0	110.6	V588	V588-Q600 VanDerWaalsContact O-CA 3.24Å; V588-Q600 WeakPolarHBondContact O-CA 3.47Å
601	F	94.9	Very high	83.7	Confident	25 Å²	25	71.7 Å²	71.7	11%	0.11	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	163	175.1	64.3	-81.3	0	0	0	111.4	L473 V475 H524 R587 V588 V603	L473-F601 HydrophobicContact CB-CE1 4.39Å; L473-F601 HydrophobicContact CB-CZ 4.33Å; L473-F601 HydrophobicContact CD2-CE1 3.89Å; L473-F601 HydrophobicContact CD2-CZ 4.09Å; V475-F601 HydrophobicContact CG2-CE2 4.04Å; V475-F601 HydrophobicContact CG2-CZ 4.17Å; H524-F601 HydrophobicContact CB-CB 4.42Å; H524-F601 HydrophobicContact CB-CD1 3.47Å; H524-F601 VanDerWaalsContact CB-CD1 3.47Å; H524-F601 HydrophobicContact CB-CD2 3.82Å; H524-F601 HydrophobicContact CB-CE1 3.47Å; H524-F601 VanDerWaalsContact CB-CE1 3.47Å; H524-F601 HydrophobicContact CB-CE2 3.81Å; H524-F601 HydrophobicContact CB-CG 3.65Å; H524-F601 HydrophobicContact CB-CZ 3.64Å; H524-F601 AromaticContact CD2-CD1 3.72Å; H524-F601 AromaticContact CG-CD1 3.52Å; H524-F601 AromaticContact CG-CE1 3.92Å; H524-F601 AromaticContact CG-CG 3.84Å; R587-F601 WeakPolarHBondContact CA-O 3.46Å; V588-F601 HydrophobicContact CB-CD1 4.12Å; V588-F601 HydrophobicContact CB-CE1 3.71Å; V588-F601 HydrophobicContact CB-CE2 4.25Å; V588-F601 HydrophobicContact CB-CZ 3.79Å; V588-F601 HydrophobicContact CG1-CE1 3.93Å; V588-F601 HydrophobicContact CG1-CZ 4.11Å; V588-F601 HydrophobicContact CG2-CD2 4.5Å; V588-F601 HydrophobicContact CG2-CE1 4.23Å; V588-F601 HydrophobicContact CG2-CE2 3.92Å; V588-F601 HydrophobicContact CG2-CZ 3.77Å; V588-F601 PolarHBondContact N-O 2.84Å; V588-F601 PolarHBondContact O-N 3.37Å; F601-V603 HydrophobicContact CD2-CG2 3.78Å; F601-V603 HydrophobicContact CE2-CG2 3.61Å
602	C	92.6	Very high	81.1	Confident	81 Å²	81	78 Å²	78	55%	0.547	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	145.8	178	-68	0	0	0	0	111.2	L586	L586-C602 CarbonylContact O-C 3.21Å; L586-C602 VanDerWaalsContact O-CA 3.28Å; L586-C602 WeakPolarHBondContact O-CA 3.35Å
603	V	92.3	Very high	78.5	Confident	7 Å²	7	79.3 Å²	79.3	4%	0.042	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131.6	177.6	179.9	0	0	0	0	108.9	V475 W521 T585 L586 F601	V475-V603 HydrophobicContact CB-CG2 4.33Å; V475-V603 HydrophobicContact CG2-CG2 3.96Å; W521-V603 VanDerWaalsContact C-CG1 3.46Å; W521-V603 HydrophobicContact CB-CG1 3.54Å; W521-V603 WeakPolarHBondContact O-CG1 3.44Å; T585-V603 WeakPolarHBondContact CA-O 3.25Å; L586-V603 PolarHBondContact N-O 3.18Å; L586-V603 PolarHBondContact O-N 3.38Å; F601-V603 HydrophobicContact CD2-CG2 3.78Å; F601-V603 HydrophobicContact CE2-CG2 3.61Å
604	Q	89.3	Confident	76.2	Confident	125 Å²	125	77.5 Å²	77.5	58%	0.584	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.1	172.6	-173.4	175.1	0.2	0	0	109.8	D583 T585	D583-Q604 PolarHBondContact OD2-NE2 2.96Å; T585-Q604 HydrophobicContact CG2-CB 4.46Å
605	T	87.3	Confident	73.7	Confident	3 Å²	3	81.6 Å²	81.6	2%	0.018	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-73.2	147.7	175.1	57.5	0	0	0	0	111.2	I481 W521 D583 F584 L586	I481-T605 VanDerWaalsContact CD1-OG1 3.26Å; I481-T605 WeakPolarHBondContact CD1-OG1 3.33Å; W521-T605 HydrophobicContact CE3-CG2 4.13Å; W521-T605 HydrophobicContact CH2-CG2 4.13Å; W521-T605 HydrophobicContact CZ3-CG2 3.68Å; D583-T605 WeakPolarHBondContact CB-O 3.38Å; F584-T605 HydrophobicContact CD1-CG2 4Å; F584-T605 HydrophobicContact CD2-CG2 4.22Å; F584-T605 HydrophobicContact CE1-CG2 3.79Å; F584-T605 HydrophobicContact CE2-CG2 4.03Å; F584-T605 HydrophobicContact CG-CG2 4.21Å; F584-T605 HydrophobicContact CZ-CG2 3.8Å; F584-T605 PolarHBondContact N-OG1 3.48Å; F584-T605 PolarHBondContact O-N 3.38Å; F584-T605 PolarHBondContact O-OG1 3.2Å; L586-T605 HydrophobicContact CD1-CG2 4Å; L586-T605 HydrophobicContact CG-CG2 4.22Å
606	P	84.8	Confident	71.2	Confident	34 Å²	34	83.8 Å²	83.8	22%	0.221	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-66.4	156.3	178.1	30.3	-36.9	0	0	0	111.8	P478 K479 I481 W521	P478-P606 WeakPolarHBondContact O-CG 3.4Å; K479-P606 WeakPolarHBondContact O-CB 3.41Å; I481-P606 WeakPolarHBondContact CD1-O 3.3Å; I481-P606 WeakPolarHBondContact CG1-O 3.28Å; W521-P606 VanDerWaalsContact CZ2-CD 3.48Å; W521-P606 HydrophobicContact CZ2-CG 3.83Å
607	Q	76.4	Confident	68.4	Low	142 Å²	142	84.5 Å²	84.5	66%	0.664	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-60.2	145.8	-177.6	-71.9	-178.7	-13	0	0	113.1	H480	H480-Q607 PolarHBondContact ND1-O 3.19Å
608	P	72.9	Confident	65.4	Low	37 Å²	37	83 Å²	83	24%	0.24	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-57.3	156.5	176	25.5	-35.5	0	0	0	111.6	I581	I581-P608 HydrophobicContact CB-CB 4.16Å; I581-P608 HydrophobicContact CG2-CB 3.82Å
609	P	65.6	Low	62.7	Low	50 Å²	50	89.5 Å²	89.5	33%	0.325	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-61.6	135.2	-176.3	26.3	-33.6	0	0	0	109.9	H480 I481 K611	H480-P609 HydrophobicContact CB-CB 4.04Å; H480-P609 HydrophobicContact CB-CG 4.43Å; I481-P609 WeakPolarHBondContact O-CD 3.29Å; P609-K611 PolarHBondContact O-N 2.96Å
610	P	57	Low	60	Low	76 Å²	76	93.5 Å²	93.5	49%	0.494	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-59.3	126	178.8	24.3	-33.2	0	0	0	109.5	T612 A614	P610-T612 PolarHBondContact O-N 3.3Å; P610-A614 HydrophobicContact CG-CB 4.43Å
611	K	49.7	Very low	57.4	Low	196 Å²	196	100 Å²	100	85%	0.852	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-48.4	134.9	-173.3	-67.8	-172.6	176.7	-174.4	0	111	P609 G613	P609-K611 PolarHBondContact O-N 2.96Å; K611-G613 PolarHBondContact O-N 3.4Å; K611-G613 VanDerWaalsContact O-N 3.11Å
612	T	38.4	Very low	55	Low	160 Å²	160	101.1 Å²	101.1	98%	0.982	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	110.1	-155.1	-36.8	0	0	0	0	113.7	P610	P610-T612 PolarHBondContact O-N 3.3Å
613	G	34.8	Very low	53	Low	51 Å²	51	98.7 Å²	98.7	53%	0.526	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	179.8	-48.5	178.4	0	0	0	0	0	111	K611 R615	K611-G613 PolarHBondContact O-N 3.4Å; K611-G613 VanDerWaalsContact O-N 3.11Å; G613-R615 PolarHBondContact O-N 3.34Å
614	A	36.9	Very low	50.9	Low	47 Å²	47	102 Å²	102	39%	0.388	52%	0.523	S	S	.	.			trans	-71.7	78.1	179.5	0	0	0	0	0	113.7	P610 I616	P610-A614 HydrophobicContact CG-CB 4.43Å; A614-I616 PolarHBondContact O-N 3.46Å
615	R	33.6	Very low	48.9	Very low	232 Å²	232	98.8 Å²	98.8	88%	0.875	51%	0.507	S	S	*	.			trans	-62.6	117.1	160.2	-88	-175.1	168.7	179.2	-2.9	109.3	G613 T617	G613-R615 PolarHBondContact O-N 3.34Å; R615-T617 VanDerWaalsContact C-N 3.29Å; R615-T617 PolarHBondContact O-N 3.4Å
616	I	32.3	Very low	46.8	Very low	135 Å²	135	107.9 Å²	107.9	69%	0.692	54%	0.541	S	S	*	.			trans	-74.2	83.2	176.5	-53.3	174.8	0	0	0	109.6	A614	A614-I616 PolarHBondContact O-N 3.46Å
617	T	29	Very low	44.6	Very low	87 Å²	87	109.7 Å²	109.7	53%	0.534	55%	0.546	S	S	.	.			trans	-72.7	133	149.1	43.4	0	0	0	0	107.6	R615 R620	R615-T617 VanDerWaalsContact C-N 3.29Å; R615-T617 PolarHBondContact O-N 3.4Å; T617-R620 VanDerWaalsContact OG1-CD 3.23Å; T617-R620 WeakPolarHBondContact OG1-CD 3.22Å
618	G	27.4	Very low	43	Very low	60 Å²	60	103.3 Å²	103.3	62%	0.619	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	136.4	-162.7	0	0	0	0	0	114.8	R620	G618-R620 WeakPolarHBondContact O-CG 3.4Å; G618-R620 PolarHBondContact O-N 3.49Å
619	Q	35.3	Very low	41.2	Very low	204 Å²	204	107.6 Å²	107.6	95%	0.953	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	28.7	58.2	173	-77.2	-169.6	-23.3	0	0	116.6
620	R	36.4	Very low	39.9	Very low	104 Å²	104	113.8 Å²	113.8	39%	0.392	56%	0.56	S	S	.	*			trans	-98.2	100	173.5	-77.7	149.4	176.8	-109.7	-20.4	111.3	T617 G618 F622 E686	T617-R620 VanDerWaalsContact OG1-CD 3.23Å; T617-R620 WeakPolarHBondContact OG1-CD 3.22Å; G618-R620 WeakPolarHBondContact O-CG 3.4Å; G618-R620 PolarHBondContact O-N 3.49Å; R620-F622 HydrophobicContact CB-CB 4.46Å; R620-F622 HydrophobicContact CB-CD1 4.36Å; R620-F622 HydrophobicContact CB-CD2 3.88Å; R620-F622 HydrophobicContact CB-CE2 4.23Å; R620-F622 HydrophobicContact CB-CG 3.96Å; R620-F622 HydrophobicContact CG-CD2 3.9Å; R620-F622 HydrophobicContact CG-CE1 4.31Å; R620-F622 HydrophobicContact CG-CE2 3.71Å; R620-F622 HydrophobicContact CG-CG 4.3Å; R620-F622 HydrophobicContact CG-CZ 3.91Å; R620-F622 PolarHBondContact O-N 3.34Å; R620-E686 IonicContact CZ-OE1 3.35Å; R620-E686 IonicContact NH1-OE1 2.83Å; R620-E686 PolarHBondContact NH1-OE1 2.93Å; R620-E686 IonicContact NH2-OE1 2.76Å; R620-E686 PolarHBondContact NH2-OE1 2.85Å
621	R	38.9	Very low	39.1	Very low	245 Å²	245	114 Å²	114	93%	0.925	56%	0.556	S	S	*	*			trans	-73.4	48	158.9	-72	-172.6	176.9	179.2	-0	110.6
622	F	43	Very low	38.3	Very low	47 Å²	47	109.6 Å²	109.6	21%	0.206	55%	0.546	C	S	.	.			trans	-80.5	131.4	173.1	-69.1	-15.9	0	0	0	109	R620 K624 E686 R908 D943	R620-F622 HydrophobicContact CB-CB 4.46Å; R620-F622 HydrophobicContact CB-CD1 4.36Å; R620-F622 HydrophobicContact CB-CD2 3.88Å; R620-F622 HydrophobicContact CB-CE2 4.23Å; R620-F622 HydrophobicContact CB-CG 3.96Å; R620-F622 HydrophobicContact CG-CD2 3.9Å; R620-F622 HydrophobicContact CG-CE1 4.31Å; R620-F622 HydrophobicContact CG-CE2 3.71Å; R620-F622 HydrophobicContact CG-CG 4.3Å; R620-F622 HydrophobicContact CG-CZ 3.91Å; R620-F622 PolarHBondContact O-N 3.34Å; F622-K624 PolarHBondContact O-N 2.87Å; F622-E686 WeakPolarHBondContact CZ-OE2 3.09Å; F622-R908 VanDerWaalsContact CE1-NH1 3.29Å; F622-D943 VanDerWaalsContact CD1-OD2 3.31Å; F622-D943 WeakPolarHBondContact CD1-OD2 3.37Å; F622-D943 VanDerWaalsContact CE1-OD2 3.24Å; F622-D943 WeakPolarHBondContact CE1-OD2 3.31Å
623	L	51.3	Low	38.2	Very low	31 Å²	31	106.6 Å²	106.6	16%	0.162	52%	0.523	C	S	.	.			trans	-48.8	96.4	178.6	-79.5	152.7	0	0	0	111.3	I631 Q831 Y907	L623-I631 HydrophobicContact CD2-CD1 3.69Å; L623-Q831 HydrophobicContact CD1-CB 4.32Å; L623-Y907 HydrophobicContact CB-CD2 4.38Å; L623-Y907 WeakPolarHBondContact O-CD2 3.27Å
624	K	48	Very low	38	Very low	76 Å²	76	107.3 Å²	107.3	33%	0.33	52%	0.52	S	S	.	.	B	Isolated β-bridge	trans	-73.2	143.9	176.2	-58	-166.7	-167.1	83.6	0	109.7	F622 R626 E627 D905	F622-K624 PolarHBondContact O-N 2.87Å; K624-R626 PolarHBondContact O-N 2.85Å; K624-R626 VanDerWaalsContact O-N 3.14Å; K624-E627 HydrophobicContact CB-CB 4.06Å; K624-E627 HydrophobicContact CB-CG 3.89Å; K624-E627 HydrophobicContact CG-CG 4.35Å; K624-E627 WeakPolarHBondContact CG-OE2 3.21Å; K624-E627 PolarHBondContact N-OE2 3.28Å; K624-E627 IonicContact NZ-OE1 2.69Å; K624-E627 PolarHBondContact NZ-OE1 3.01Å; K624-E627 IonicContact NZ-OE2 2.73Å; K624-E627 PolarHBondContact O-N 3.21Å; K624-D905 CarbonylContact C-O 3.59Å; K624-D905 WeakPolarHBondContact CA-O 3.43Å
625	K	47.5	Very low	37.8	Very low	57 Å²	57	110.3 Å²	110.3	25%	0.248	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-31.7	176.1	-177.1	165.5	176.5	163	0	112.6	A900 D905	K625-A900 VanDerWaalsContact NZ-C 3.27Å; K625-A900 PolarHBondContact NZ-O 3.4Å; K625-D905 PolarHBondContact N-O 3.11Å
626	R	43.1	Very low	37.8	Very low	194 Å²	194	106.4 Å²	106.4	73%	0.732	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-6.2	174.6	-59.2	-172.3	-173.1	-153.2	1.7	115.2	K624	K624-R626 PolarHBondContact O-N 2.85Å; K624-R626 VanDerWaalsContact O-N 3.14Å
627	E	39.7	Very low	37.9	Very low	72 Å²	72	101.2 Å²	101.2	34%	0.336	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-25.3	175.9	-81.1	167.6	-177.3	0	0	111.7	K624 D629 K630 I631	K624-E627 HydrophobicContact CB-CB 4.06Å; K624-E627 HydrophobicContact CB-CG 3.89Å; K624-E627 HydrophobicContact CG-CG 4.35Å; K624-E627 WeakPolarHBondContact CG-OE2 3.21Å; K624-E627 PolarHBondContact N-OE2 3.28Å; K624-E627 IonicContact NZ-OE1 2.69Å; K624-E627 PolarHBondContact NZ-OE1 3.01Å; K624-E627 IonicContact NZ-OE2 2.73Å; K624-E627 PolarHBondContact O-N 3.21Å; E627-D629 VanDerWaalsContact C-N 3.32Å; E627-D629 PolarHBondContact O-N 3.4Å; E627-K630 CarbonylContact O-C 3.42Å; E627-K630 VanDerWaalsContact O-C 3.27Å; E627-K630 VanDerWaalsContact O-CA 3.25Å; E627-K630 WeakPolarHBondContact O-CA 3.23Å; E627-K630 WeakPolarHBondContact O-CB 3.28Å; E627-K630 PolarHBondContact O-N 3.21Å; E627-I631 WeakPolarHBondContact O-CG1 3.24Å; E627-I631 PolarHBondContact O-N 3.06Å
628	V	41.7	Very low	38.4	Very low	9 Å²	9	101.5 Å²	101.5	6%	0.055	51%	0.51	C	S	.	.	G	3₁₀ helix	trans	-63	-35.1	179.9	-179.6	0	0	0	0	112.7	K630 I631 K836 Y907	V628-K630 PolarHBondContact O-N 2.88Å; V628-K630 VanDerWaalsContact O-N 3.1Å; V628-I631 HydrophobicContact CG2-CD1 4.27Å; V628-I631 CarbonylContact O-C 3.56Å; V628-I631 WeakPolarHBondContact O-CA 3.37Å; V628-I631 PolarHBondContact O-N 2.76Å; V628-K836 HydrophobicContact CG1-CD 4.3Å; V628-Y907 HydrophobicContact CG2-CE2 4.06Å; V628-Y907 VanDerWaalsContact CG2-OH 3.28Å; V628-Y907 WeakPolarHBondContact CG2-OH 3.45Å
629	D	36.1	Very low	38.9	Very low	127 Å²	127	104.9 Å²	104.9	68%	0.679	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-67.3	-8	171.6	-54.5	-29	0	0	0	113	E627	E627-D629 VanDerWaalsContact C-N 3.32Å; E627-D629 PolarHBondContact O-N 3.4Å
630	K	37.6	Very low	39.2	Very low	180 Å²	180	98.5 Å²	98.5	78%	0.783	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-111.3	1.4	169	-61.7	-171.3	176.5	-171.3	0	113.4	E627 V628 V632	E627-K630 CarbonylContact O-C 3.42Å; E627-K630 VanDerWaalsContact O-C 3.27Å; E627-K630 VanDerWaalsContact O-CA 3.25Å; E627-K630 WeakPolarHBondContact O-CA 3.23Å; E627-K630 WeakPolarHBondContact O-CB 3.28Å; E627-K630 PolarHBondContact O-N 3.21Å; V628-K630 PolarHBondContact O-N 2.88Å; V628-K630 VanDerWaalsContact O-N 3.1Å; K630-V632 PolarHBondContact O-N 3.02Å
631	I	40.8	Very low	40.1	Very low	80 Å²	80	103.5 Å²	103.5	41%	0.41	52%	0.521	S	S	.	.			trans	-90.6	38.7	160.5	-42.5	173.6	0	0	0	109	L623 E627 V628 L633	L623-I631 HydrophobicContact CD2-CD1 3.69Å; E627-I631 WeakPolarHBondContact O-CG1 3.24Å; E627-I631 PolarHBondContact O-N 3.06Å; V628-I631 HydrophobicContact CG2-CD1 4.27Å; V628-I631 CarbonylContact O-C 3.56Å; V628-I631 WeakPolarHBondContact O-CA 3.37Å; V628-I631 PolarHBondContact O-N 2.76Å; I631-L633 VanDerWaalsContact C-N 3.29Å; I631-L633 PolarHBondContact O-N 2.95Å; I631-L633 VanDerWaalsContact O-N 3.09Å
632	V	33.4	Very low	41	Very low	104 Å²	104	95.2 Å²	95.2	63%	0.63	49%	0.493	S	S	*	.			trans	-57.5	107.3	137.3	176.3	0	0	0	0	105	K630 S634	K630-V632 PolarHBondContact O-N 3.02Å; V632-S634 PolarHBondContact O-N 3.03Å
633	L	36.3	Very low	42.3	Very low	96 Å²	96	95.8 Å²	95.8	50%	0.503	50%	0.502	S	S	.	.			trans	-49.6	117.3	162.5	-78.9	166	0	0	0	105.9	I631 A637	I631-L633 VanDerWaalsContact C-N 3.29Å; I631-L633 PolarHBondContact O-N 2.95Å; I631-L633 VanDerWaalsContact O-N 3.09Å; L633-A637 HydrophobicContact CD2-CB 4.41Å
634	S	29.2	Very low	43.4	Very low	67 Å²	67	102.9 Å²	102.9	47%	0.469	53%	0.531	S	S	.	.			trans	-52.9	139.8	-179	54.4	0	0	0	0	108.2	V632 L636 A637	V632-S634 PolarHBondContact O-N 3.03Å; S634-L636 PolarHBondContact O-N 2.88Å; S634-A637 VanDerWaalsContact O-CB 3.3Å; S634-A637 WeakPolarHBondContact O-CB 3.31Å; S634-A637 PolarHBondContact O-N 3.17Å
635	P	34.1	Very low	45.1	Very low	109 Å²	109	101.3 Å²	101.3	71%	0.708	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-55.3	-23.7	-174.7	-30.5	36.8	0	0	0	113.9	A637 V638	P635-A637 VanDerWaalsContact C-N 3.29Å; P635-A637 PolarHBondContact O-N 2.89Å; P635-V638 WeakPolarHBondContact O-CG2 3.37Å; P635-V638 PolarHBondContact O-N 3.03Å
636	L	31.8	Very low	46.9	Very low	150 Å²	150	103.1 Å²	103.1	79%	0.785	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-67.4	-18.4	172.8	-62.1	169	0	0	0	114.8	S634 T639	S634-L636 PolarHBondContact O-N 2.88Å; L636-T639 PolarHBondContact O-OG1 2.85Å; L636-T639 VanDerWaalsContact O-OG1 3.14Å
637	A	35.4	Very low	48.9	Very low	26 Å²	26	98 Å²	98	22%	0.215	52%	0.52	C	S	.	.	G	3₁₀ helix	trans	-83	-14.9	178.7	0	0	0	0	0	113.5	L633 S634 P635 T639 S640	L633-A637 HydrophobicContact CD2-CB 4.41Å; S634-A637 VanDerWaalsContact O-CB 3.3Å; S634-A637 WeakPolarHBondContact O-CB 3.31Å; S634-A637 PolarHBondContact O-N 3.17Å; P635-A637 VanDerWaalsContact C-N 3.29Å; P635-A637 PolarHBondContact O-N 2.89Å; A637-T639 PolarHBondContact O-N 2.71Å; A637-S640 PolarHBondContact O-N 3.4Å; A637-S640 VanDerWaalsContact O-N 3.11Å; A637-S640 PolarHBondContact O-OG 3.25Å
638	V	39.9	Very low	51.1	Low	94 Å²	94	97.6 Å²	97.6	57%	0.57	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-64.7	-18	179.9	-177.8	0	0	0	0	112.3	P635	P635-V638 WeakPolarHBondContact O-CG2 3.37Å; P635-V638 PolarHBondContact O-N 3.03Å
639	T	37.7	Very low	53.1	Low	130 Å²	130	100.6 Å²	100.6	80%	0.798	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-89.9	-9.6	177.1	59	0	0	0	0	114	L636 A637	L636-T639 PolarHBondContact O-OG1 2.85Å; L636-T639 VanDerWaalsContact O-OG1 3.14Å; A637-T639 PolarHBondContact O-N 2.71Å
640	S	41.8	Very low	55.3	Low	71 Å²	71	95 Å²	95	50%	0.497	51%	0.507	S	S	.	.	S	Bend	trans	-86.7	128.3	-178.5	68.6	0	0	0	0	111.6	A637 H642	A637-S640 PolarHBondContact O-N 3.4Å; A637-S640 VanDerWaalsContact O-N 3.11Å; A637-S640 PolarHBondContact O-OG 3.25Å; S640-H642 PolarHBondContact O-N 3.11Å; S640-H642 VanDerWaalsContact O-N 3.11Å
641	K	54.6	Low	56.8	Low	208 Å²	208	91.2 Å²	91.2	90%	0.904	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-56.9	117.3	175.9	-68.2	175.7	-179.9	173.3	0	109.3
642	H	59	Low	58.4	Low	71 Å²	71	92.5 Å²	92.5	33%	0.329	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-52.1	138.7	-178.9	-64.7	-77.6	0	0	0	111.8	S640 K644 A768	S640-H642 PolarHBondContact O-N 3.11Å; S640-H642 VanDerWaalsContact O-N 3.11Å; H642-K644 PolarHBondContact O-N 2.87Å; H642-A768 WeakPolarHBondContact CD2-CB 3.33Å
643	P	69	Low	60.8	Low	60 Å²	60	88.5 Å²	88.5	39%	0.39	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-64.5	120.4	-178.3	28.1	-35	0	0	0	109.5	F645 D829 F950	P643-F645 PolarHBondContact O-N 2.86Å; P643-D829 HydrophobicContact CG-CB 3.94Å; P643-F950 HydrophobicContact CB-CD1 3.88Å; P643-F950 HydrophobicContact CB-CE1 4.35Å; P643-F950 HydrophobicContact CG-CD1 4.3Å; P643-F950 HydrophobicContact CG-CE1 4.46Å; P643-F950 WeakPolarHBondContact O-CE1 3.46Å
644	K	74.7	Confident	63.1	Low	180 Å²	180	86.7 Å²	86.7	78%	0.783	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-75.9	126	178.1	-67.1	-168.3	176.2	-169.9	0	109.9	H642 Q646	H642-K644 PolarHBondContact O-N 2.87Å; K644-Q646 WeakPolarHBondContact O-CG 3.35Å; K644-Q646 PolarHBondContact O-N 3.37Å
645	F	84.6	Confident	66	Low	43 Å²	43	84.3 Å²	84.3	19%	0.189	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-56.3	128.2	170.1	-177.6	-83.6	0	0	0	110.4	P643 T735 L738 K827 L945 A949 F950	P643-F645 PolarHBondContact O-N 2.86Å; F645-T735 HydrophobicContact CE1-CG2 4.22Å; F645-L738 HydrophobicContact CE1-CD2 4.45Å; F645-L738 HydrophobicContact CE2-CD2 4.04Å; F645-L738 HydrophobicContact CZ-CD2 3.82Å; F645-K827 HydrophobicContact CB-CB 4.03Å; F645-K827 HydrophobicContact CB-CG 4.03Å; F645-K827 HydrophobicContact CD1-CG 4.46Å; F645-K827 HydrophobicContact CD2-CG 4.2Å; F645-K827 HydrophobicContact CG-CB 4.44Å; F645-K827 HydrophobicContact CG-CG 3.99Å; F645-L945 HydrophobicContact CE2-CD1 4.16Å; F645-A949 HydrophobicContact CD2-CB 3.67Å; F645-A949 HydrophobicContact CE2-CB 3.59Å; F645-A949 HydrophobicContact CG-CB 4.43Å; F645-A949 HydrophobicContact CZ-CB 4.29Å; F645-F950 HydrophobicContact CB-CE1 4.01Å; F645-F950 HydrophobicContact CB-CZ 4.19Å; F645-F950 HydrophobicContact CD2-CZ 4.03Å
646	Q	84.3	Confident	68.6	Low	95 Å²	95	79.1 Å²	79.1	44%	0.444	42%	0.417	S	S	.	.			trans	-116.9	135.3	178.4	-51	-170.2	17	0	0	109.6	K644 R648 T734 A949	K644-Q646 WeakPolarHBondContact O-CG 3.35Å; K644-Q646 PolarHBondContact O-N 3.37Å; Q646-R648 HydrophobicContact CB-CG 4.31Å; Q646-T734 PolarHBondContact O-OG1 2.88Å; Q646-A949 PolarHBondContact N-O 3Å
647	D	85.7	Confident	71.4	Confident	85 Å²	85	76.8 Å²	76.8	46%	0.455	40%	0.401	S	S	.	.			trans	-82	122.1	173.8	-160.4	25.8	0	0	0	111.6	T734 T735	D647-T734 VanDerWaalsContact CA-OG1 3.31Å; D647-T734 WeakPolarHBondContact CA-OG1 3.44Å; D647-T734 PolarHBondContact OD1-N 3.07Å; D647-T734 PolarHBondContact OD1-OG1 2.94Å; D647-T735 HydrophobicContact CB-CG2 3.82Å; D647-T735 WeakPolarHBondContact OD1-CG2 3.41Å; D647-T735 PolarHBondContact OD1-N 3.14Å; D647-T735 PolarHBondContact OD1-OG1 2.85Å; D647-T735 WeakPolarHBondContact OD2-CB 3.25Å; D647-T735 WeakPolarHBondContact OD2-CG2 3.29Å; D647-T735 PolarHBondContact OD2-OG1 2.97Å
648	R	85.3	Confident	74.1	Confident	65 Å²	65	75.6 Å²	75.6	25%	0.245	39%	0.391	C	S	.	.			trans	-147.1	158.8	-173.8	-62.7	179.2	176.4	-176.3	0.4	110.2	Q646 T733 T734 C951	Q646-R648 HydrophobicContact CB-CG 4.31Å; R648-T733 CarbonylContact O-C 3.6Å; R648-T733 VanDerWaalsContact O-CA 3.28Å; R648-T733 WeakPolarHBondContact O-CA 3.49Å; R648-T734 PolarHBondContact N-OG1 2.8Å; R648-T734 PolarHBondContact O-N 2.59Å; R648-T734 PolarHBondContact O-OG1 2.72Å; R648-C951 PolarHBondContact NH1-O 3.42Å
649	C	82.8	Confident	76.6	Confident	72 Å²	72	75.4 Å²	75.4	49%	0.486	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-66.9	136.6	167	-65.1	0	0	0	0	110.5	T651	C649-T651 PolarHBondContact O-N 3Å
650	V	83.2	Confident	79.1	Confident	10 Å²	10	75.3 Å²	75.3	6%	0.061	37%	0.374	C	S	.	.			trans	-73.2	107.1	176.9	179.4	0	0	0	0	109	L653 L732 T734 L737 T944 A948	V650-L653 HydrophobicContact CB-CD1 4.36Å; V650-L653 HydrophobicContact CG1-CD1 4.42Å; V650-L653 HydrophobicContact CG1-CD2 3.83Å; V650-L653 HydrophobicContact CG1-CG 4.06Å; V650-L653 WeakPolarHBondContact O-CD1 3.39Å; V650-L653 WeakPolarHBondContact O-CG 3.35Å; V650-L732 HydrophobicContact CB-CD2 4.23Å; V650-L732 HydrophobicContact CB-CG 4.19Å; V650-L732 HydrophobicContact CG2-CD2 4.25Å; V650-L732 HydrophobicContact CG2-CG 3.94Å; V650-L732 WeakPolarHBondContact CG2-O 3.43Å; V650-L732 PolarHBondContact N-O 3.07Å; V650-T734 HydrophobicContact CG2-CG2 4.08Å; V650-L737 HydrophobicContact CG2-CD2 4.1Å; V650-T944 HydrophobicContact CG1-CG2 3.83Å; V650-A948 HydrophobicContact CB-CB 4.34Å; V650-A948 HydrophobicContact CG1-CB 4.25Å; V650-A948 HydrophobicContact CG2-CB 3.97Å
651	T	70.1	Confident	81.4	Confident	99 Å²	99	75.1 Å²	75.1	61%	0.607	37%	0.37	S	S	*	.			trans	-80.5	174.6	176.3	58.1	0	0	0	0	111.6	C649 L653	C649-T651 PolarHBondContact O-N 3Å; T651-L653 PolarHBondContact O-N 3.25Å; T651-L653 VanDerWaalsContact O-N 3.1Å
652	N	73.4	Confident	83	Confident	108 Å²	108	66.5 Å²	66.5	58%	0.578	34%	0.335	S	S	*	.	S	Bend	trans	60.1	13.6	179.9	-74.8	-67.2	0	0	0	117	K721	N652-K721 PolarHBondContact OD1-NZ 3.48Å
653	L	82.9	Confident	84.2	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.099	35%	0.352	C	S	.	.			trans	-60	141	169.2	-62.8	172.1	0	0	0	110.9	V650 T651 F655 A681 L683 L732	V650-L653 HydrophobicContact CB-CD1 4.36Å; V650-L653 HydrophobicContact CG1-CD1 4.42Å; V650-L653 HydrophobicContact CG1-CD2 3.83Å; V650-L653 HydrophobicContact CG1-CG 4.06Å; V650-L653 WeakPolarHBondContact O-CD1 3.39Å; V650-L653 WeakPolarHBondContact O-CG 3.35Å; T651-L653 PolarHBondContact O-N 3.25Å; T651-L653 VanDerWaalsContact O-N 3.1Å; L653-F655 HydrophobicContact CB-CE2 4.46Å; L653-F655 HydrophobicContact CB-CZ 4.36Å; L653-A681 HydrophobicContact CB-CB 4.42Å; L653-A681 HydrophobicContact CD1-CB 4.09Å; L653-L683 HydrophobicContact CD2-CB 4.46Å; L653-L683 HydrophobicContact CD2-CD1 4.5Å; L653-L683 HydrophobicContact CD2-CG 3.97Å; L653-L732 HydrophobicContact CD1-CB 4.32Å; L653-L732 HydrophobicContact CD1-CD2 4.16Å; L653-L732 HydrophobicContact CD2-CD2 4.29Å
654	K	86.4	Confident	84.6	Confident	59 Å²	59	69.7 Å²	69.7	26%	0.257	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	144.4	166.4	-71.7	-164.3	-178	-175.2	0	110	A681 L682 E685 V718 G720 K721	K654-A681 CarbonylContact O-C 3.6Å; K654-L682 PolarHBondContact N-O 3.49Å; K654-L682 PolarHBondContact O-N 3.37Å; K654-E685 HydrophobicContact CD-CG 4.18Å; K654-E685 WeakPolarHBondContact CE-OE1 3.48Å; K654-E685 IonicContact NZ-OE1 2.94Å; K654-E685 PolarHBondContact NZ-OE1 3.39Å; K654-E685 IonicContact NZ-OE2 3.55Å; K654-E685 PolarHBondContact NZ-OE2 3.38Å; K654-V718 HydrophobicContact CD-CG1 4.47Å; K654-G720 CarbonylContact C-O 3.52Å; K654-G720 VanDerWaalsContact CA-O 3.26Å; K654-G720 WeakPolarHBondContact CA-O 3.47Å; K654-K721 HydrophobicContact CG-CG 4.48Å
655	F	89	Confident	83.9	Confident	16 Å²	16	70.4 Å²	70.4	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	151.2	178.3	-62.5	-88.1	0	0	0	111.1	L653 V679 I680 A681 L719 G720 V722 K723 P724 W727	L653-F655 HydrophobicContact CB-CE2 4.46Å; L653-F655 HydrophobicContact CB-CZ 4.36Å; F655-V679 HydrophobicContact CB-CG1 4.37Å; F655-V679 HydrophobicContact CD1-CG1 4.15Å; F655-I680 WeakPolarHBondContact CA-O 3.35Å; F655-A681 HydrophobicContact CD1-CB 4.21Å; F655-A681 HydrophobicContact CE1-CB 3.99Å; F655-L719 PolarHBondContact O-N 3.26Å; F655-G720 PolarHBondContact N-O 3.37Å; F655-V722 VanDerWaalsContact CD2-O 3.28Å; F655-V722 WeakPolarHBondContact CD2-O 3.21Å; F655-K723 HydrophobicContact CE1-CG 4.13Å; F655-K723 HydrophobicContact CE2-CB 3.95Å; F655-K723 HydrophobicContact CE2-CG 4.33Å; F655-K723 HydrophobicContact CZ-CB 3.95Å; F655-K723 HydrophobicContact CZ-CG 3.81Å; F655-P724 HydrophobicContact CB-CG 3.89Å; F655-P724 VanDerWaalsContact CG-CD 3.43Å; F655-P724 HydrophobicContact CG-CG 4.23Å; F655-W727 AromaticContact CD1-CE3 3.99Å; F655-W727 HydrophobicContact CD1-CE3 3.99Å; F655-W727 AromaticContact CD1-CZ3 3.76Å; F655-W727 HydrophobicContact CD1-CZ3 3.76Å; F655-W727 AromaticContact CE1-CE3 3.82Å; F655-W727 HydrophobicContact CE1-CE3 3.82Å; F655-W727 HydrophobicContact CE1-CH2 4.27Å; F655-W727 AromaticContact CE1-CZ3 3.68Å; F655-W727 HydrophobicContact CE1-CZ3 3.68Å
656	G	89.2	Confident	82.9	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.6	177.1	0	0	0	0	0	112.6	V679 I680 L717	G656-V679 CarbonylContact O-C 3.53Å; G656-V679 WeakPolarHBondContact O-CA 3.43Å; G656-I680 PolarHBondContact N-O 2.97Å; G656-I680 WeakPolarHBondContact O-CG2 3.29Å; G656-I680 PolarHBondContact O-N 2.88Å; G656-L717 CarbonylContact C-O 3.56Å; G656-L717 WeakPolarHBondContact CA-O 3.45Å
657	K	90.9	Very high	81.8	Confident	101 Å²	101	79.7 Å²	79.7	44%	0.439	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	132.3	174.5	-164	167.2	-172.5	168.7	0	110.5	I659 G677 L717 L719	K657-I659 PolarHBondContact O-N 3.19Å; K657-G677 VanDerWaalsContact CE-O 3.29Å; K657-G677 WeakPolarHBondContact CE-O 3.35Å; K657-L717 PolarHBondContact N-O 3.09Å; K657-L717 PolarHBondContact O-N 3.47Å; K657-L719 HydrophobicContact CB-CD1 4.21Å; K657-L719 HydrophobicContact CB-CD2 4.26Å; K657-L719 HydrophobicContact CB-CG 4.38Å
658	L	91.3	Very high	81.1	Confident	1 Å²	1	78 Å²	78	1%	0.005	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	112.7	-175.8	-68.5	155.9	0	0	0	110	Y674 K675 K676 G677 D678 I680 Y704 V711 N715 V716	L658-Y674 HydrophobicContact CB-CD2 4.29Å; L658-Y674 HydrophobicContact CD1-CD2 4.32Å; L658-Y674 HydrophobicContact CD1-CG 4.18Å; L658-Y674 HydrophobicContact CD2-CD1 4.49Å; L658-Y674 HydrophobicContact CD2-CD2 3.7Å; L658-Y674 HydrophobicContact CD2-CE2 3.95Å; L658-Y674 HydrophobicContact CD2-CG 3.99Å; L658-Y674 HydrophobicContact CG-CD2 4.32Å; L658-K675 WeakPolarHBondContact CB-O 3.4Å; L658-K676 CarbonylContact O-C 3.58Å; L658-K676 WeakPolarHBondContact O-CA 3.49Å; L658-G677 PolarHBondContact O-N 3.38Å; L658-D678 WeakPolarHBondContact CB-O 3.45Å; L658-D678 HydrophobicContact CD1-CB 3.78Å; L658-D678 PolarHBondContact N-O 2.91Å; L658-I680 HydrophobicContact CD1-CB 3.99Å; L658-I680 HydrophobicContact CD1-CG2 4.22Å; L658-I680 HydrophobicContact CD2-CB 4.47Å; L658-I680 HydrophobicContact CD2-CG2 3.94Å; L658-I680 HydrophobicContact CG-CB 4.3Å; L658-I680 HydrophobicContact CG-CG2 3.95Å; L658-Y704 HydrophobicContact CD1-CD2 4.32Å; L658-Y704 HydrophobicContact CD1-CE2 4.28Å; L658-V711 HydrophobicContact CD2-CG1 3.92Å; L658-N715 WeakPolarHBondContact CA-O 3.48Å; L658-V716 HydrophobicContact CD2-CG2 4.17Å
659	I	91.8	Very high	80.4	Confident	91 Å²	91	79.1 Å²	79.1	47%	0.467	40%	0.397	S	S	.	.			trans	-86.3	-7.7	-171.2	72.1	169.7	0	0	0	114	K657 K676 K714 N715 L717	K657-I659 PolarHBondContact O-N 3.19Å; I659-K676 WeakPolarHBondContact O-CG 3.34Å; I659-K714 WeakPolarHBondContact CD1-O 3.45Å; I659-N715 PolarHBondContact N-O 3.34Å; I659-L717 HydrophobicContact CG2-CB 3.91Å
660	K	90.9	Very high	80.5	Confident	127 Å²	127	76.3 Å²	76.3	55%	0.552	38%	0.376	S	S	*	.	S	Bend	trans	-146.3	134.1	-178.2	175.2	163	-176.8	163.7	0	111.7	V662 Y674	K660-V662 HydrophobicContact CG-CG2 4.49Å; K660-Y674 WeakPolarHBondContact O-CD2 3.28Å; K660-Y674 WeakPolarHBondContact O-CE2 3.19Å
661	T	89.9	Confident	80.6	Confident	68 Å²	68	77.3 Å²	77.3	42%	0.417	38%	0.381	S	S	.	.			trans	-66.2	132.4	169.1	-57.1	0	0	0	0	110.7	I663 Y674 K676	T661-I663 HydrophobicContact CG2-CD1 4.11Å; T661-I663 HydrophobicContact CG2-CG1 4.11Å; T661-Y674 CarbonylContact C-O 3.54Å; T661-Y674 WeakPolarHBondContact CA-O 3.31Å; T661-K676 PolarHBondContact OG1-N 2.95Å
662	V	88.4	Confident	81.5	Confident	26 Å²	26	73.1 Å²	73.1	16%	0.158	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-133.4	108.4	172.6	177	0	0	0	0	108.9	K660 R664 E673 Y674	K660-V662 HydrophobicContact CG-CG2 4.49Å; V662-R664 HydrophobicContact CG1-CG 4.4Å; V662-E673 CarbonylContact O-C 3.2Å; V662-E673 VanDerWaalsContact O-CA 3.24Å; V662-E673 WeakPolarHBondContact O-CA 3.38Å; V662-Y674 HydrophobicContact CB-CD2 4.24Å; V662-Y674 HydrophobicContact CB-CE1 4.16Å; V662-Y674 HydrophobicContact CB-CE2 3.74Å; V662-Y674 HydrophobicContact CG2-CD2 4.46Å; V662-Y674 HydrophobicContact CG2-CE2 3.59Å; V662-Y674 WeakPolarHBondContact CG2-OH 3.41Å; V662-Y674 PolarHBondContact N-O 3.06Å; V662-Y674 PolarHBondContact O-N 2.69Å
663	I	84.4	Confident	82.2	Confident	135 Å²	135	71.2 Å²	71.2	69%	0.692	34%	0.343	S	S	*	.			trans	-112.7	146.4	169.5	-60.4	167.1	0	0	0	106.6	T661	T661-I663 HydrophobicContact CG2-CD1 4.11Å; T661-I663 HydrophobicContact CG2-CG1 4.11Å
664	R	76.6	Confident	82.6	Confident	63 Å²	63	70.6 Å²	70.6	24%	0.238	34%	0.339	C	S	.	.			trans	-123.3	131.7	-175.4	-58.1	170.6	-175.5	-80.2	-2.7	110.2	V662 H666 L671 L672 E673	V662-R664 HydrophobicContact CG1-CG 4.4Å; R664-H666 VanDerWaalsContact C-N 3.25Å; R664-H666 PolarHBondContact O-N 3.11Å; R664-L671 PolarHBondContact NE-O 2.8Å; R664-L672 PolarHBondContact NE-O 3.26Å; R664-L672 PolarHBondContact NH2-O 3.12Å; R664-E673 HydrophobicContact CB-CG 4.2Å; R664-E673 HydrophobicContact CG-CG 3.88Å
665	Q	59.7	Low	82.7	Confident	196 Å²	196	74.1 Å²	74.1	92%	0.916	35%	0.354	S	S	*	.	S	Bend	trans	-62.1	-36.4	171.7	-68.4	167.4	-28.6	0	0	111.6
666	H	64.7	Low	82.8	Confident	157 Å²	157	80.4 Å²	80.4	73%	0.727	38%	0.382	S	S	*	.	S	Bend	trans	-108.2	109.5	178.4	-68.6	79.3	0	0	0	110	R664 N668	R664-H666 VanDerWaalsContact C-N 3.25Å; R664-H666 PolarHBondContact O-N 3.11Å; H666-N668 PolarHBondContact O-N 3.18Å
667	K	61.5	Low	82.6	Confident	176 Å²	176	82.1 Å²	82.1	77%	0.765	40%	0.399	S	S	*	.			trans	-60.3	122	177	-67.1	177.3	-179	172.9	0	110.2	K930	K667-K930 PolarHBondContact O-NZ 3.33Å
668	N	70.1	Confident	82.5	Confident	49 Å²	49	79.1 Å²	79.1	26%	0.262	39%	0.388	S	S	.	.			trans	-120.7	118.1	177.4	-172.8	-9.4	0	0	0	109.8	H666 Y670 L671 K930	H666-N668 PolarHBondContact O-N 3.18Å; N668-Y670 PolarHBondContact O-N 2.93Å; N668-L671 HydrophobicContact CB-CB 4.19Å; N668-L671 HydrophobicContact CB-CD1 4.31Å; N668-L671 HydrophobicContact CB-CG 4.28Å; N668-L671 WeakPolarHBondContact ND2-CD1 3.46Å; N668-L671 PolarHBondContact O-N 3.44Å; N668-K930 WeakPolarHBondContact OD1-CD 3.45Å
669	T	71.8	Confident	82.4	Confident	89 Å²	89	80 Å²	80	55%	0.546	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-32.9	-169.6	-37.8	0	0	0	0	114.5
670	Y	83.6	Confident	82.3	Confident	12 Å²	12	75.6 Å²	75.6	5%	0.047	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.9	7.9	-175.7	-53.7	-71.6	0	0	0	114.3	N668 L710 P744 K930	N668-Y670 PolarHBondContact O-N 2.93Å; Y670-L710 WeakPolarHBondContact O-CB 3.49Å; Y670-L710 PolarHBondContact O-N 3.45Å; Y670-P744 WeakPolarHBondContact OH-CD 3.36Å; Y670-K930 HydrophobicContact CD2-CB 4.39Å; Y670-K930 VanDerWaalsContact CD2-O 3.25Å; Y670-K930 WeakPolarHBondContact CD2-O 3.26Å; Y670-K930 HydrophobicContact CE2-CB 4.45Å; Y670-K930 VanDerWaalsContact CE2-O 3.3Å; Y670-K930 WeakPolarHBondContact CE2-O 3.48Å
671	L	86.8	Confident	82.3	Confident	32 Å²	32	69.6 Å²	69.6	17%	0.168	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-114.4	109.3	174	-60.5	-175.5	0	0	0	109.5	R664 N668 W699 L710	R664-L671 PolarHBondContact NE-O 2.8Å; N668-L671 HydrophobicContact CB-CB 4.19Å; N668-L671 HydrophobicContact CB-CD1 4.31Å; N668-L671 HydrophobicContact CB-CG 4.28Å; N668-L671 WeakPolarHBondContact ND2-CD1 3.46Å; N668-L671 PolarHBondContact O-N 3.44Å; L671-W699 HydrophobicContact CD2-CE3 4.48Å; L671-W699 HydrophobicContact CD2-CZ3 4.28Å; L671-L710 HydrophobicContact CD2-CB 4Å; L671-L710 HydrophobicContact CD2-CD1 4.12Å
672	L	87.4	Confident	82.3	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.058	33%	0.326	C	S	.	.			trans	-66.2	155	-174.4	-66.6	172.5	0	0	0	112.4	R664 Y674 I680 G702 K707 L710 V711	R664-L672 PolarHBondContact NE-O 3.26Å; R664-L672 PolarHBondContact NH2-O 3.12Å; L672-Y674 HydrophobicContact CB-CD1 4.11Å; L672-Y674 HydrophobicContact CB-CE1 4.43Å; L672-Y674 WeakPolarHBondContact O-CE1 3.46Å; L672-I680 HydrophobicContact CD1-CD1 4Å; L672-G702 WeakPolarHBondContact CD1-O 3.37Å; L672-K707 HydrophobicContact CD2-CB 3.75Å; L672-L710 PolarHBondContact N-O 2.92Å; L672-V711 HydrophobicContact CB-CG2 3.97Å; L672-V711 HydrophobicContact CD1-CG2 3.88Å; L672-V711 HydrophobicContact CG-CG2 4.46Å
673	E	89.4	Confident	82.1	Confident	67 Å²	67	66 Å²	66	31%	0.313	32%	0.322	S	S	.	.			trans	-118.3	136.1	173.5	-71.6	163.6	-156.4	0	0	107.2	V662 R664 Y704	V662-E673 CarbonylContact O-C 3.2Å; V662-E673 VanDerWaalsContact O-CA 3.24Å; V662-E673 WeakPolarHBondContact O-CA 3.38Å; R664-E673 HydrophobicContact CB-CG 4.2Å; R664-E673 HydrophobicContact CG-CG 3.88Å; E673-Y704 WeakPolarHBondContact O-CD1 3.48Å; E673-Y704 WeakPolarHBondContact O-CE1 3.41Å
674	Y	89.9	Confident	81.9	Confident	6 Å²	6	61 Å²	61	2%	0.024	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-163.6	158.4	-165.8	46	-95.9	0	0	0	111.9	L658 K660 T661 V662 L672 V711 N715	L658-Y674 HydrophobicContact CB-CD2 4.29Å; L658-Y674 HydrophobicContact CD1-CD2 4.32Å; L658-Y674 HydrophobicContact CD1-CG 4.18Å; L658-Y674 HydrophobicContact CD2-CD1 4.49Å; L658-Y674 HydrophobicContact CD2-CD2 3.7Å; L658-Y674 HydrophobicContact CD2-CE2 3.95Å; L658-Y674 HydrophobicContact CD2-CG 3.99Å; L658-Y674 HydrophobicContact CG-CD2 4.32Å; K660-Y674 WeakPolarHBondContact O-CD2 3.28Å; K660-Y674 WeakPolarHBondContact O-CE2 3.19Å; T661-Y674 CarbonylContact C-O 3.54Å; T661-Y674 WeakPolarHBondContact CA-O 3.31Å; V662-Y674 HydrophobicContact CB-CD2 4.24Å; V662-Y674 HydrophobicContact CB-CE1 4.16Å; V662-Y674 HydrophobicContact CB-CE2 3.74Å; V662-Y674 HydrophobicContact CG2-CD2 4.46Å; V662-Y674 HydrophobicContact CG2-CE2 3.59Å; V662-Y674 WeakPolarHBondContact CG2-OH 3.41Å; V662-Y674 PolarHBondContact N-O 3.06Å; V662-Y674 PolarHBondContact O-N 2.69Å; L672-Y674 HydrophobicContact CB-CD1 4.11Å; L672-Y674 HydrophobicContact CB-CE1 4.43Å; L672-Y674 WeakPolarHBondContact O-CE1 3.46Å; Y674-V711 HydrophobicContact CD1-CG2 4.14Å; Y674-V711 HydrophobicContact CE1-CB 4.35Å; Y674-V711 HydrophobicContact CE1-CG1 3.85Å; Y674-V711 HydrophobicContact CE1-CG2 3.82Å; Y674-V711 HydrophobicContact CE2-CG1 4.48Å; Y674-N715 HydrophobicContact CE2-CB 4.32Å; Y674-N715 PolarHBondContact OH-ND2 3.48Å
675	K	89.2	Confident	81.9	Confident	133 Å²	133	64.2 Å²	64.2	58%	0.578	32%	0.317	S	S	*	.			trans	-102.2	160.4	177.9	-46.8	175.9	-178.3	175.9	0	111.2	L658 D678	L658-K675 WeakPolarHBondContact CB-O 3.4Å; K675-D678 WeakPolarHBondContact CA-OD2 3.27Å; K675-D678 WeakPolarHBondContact CB-OD2 3.43Å; K675-D678 PolarHBondContact N-OD2 3.27Å
676	K	90.3	Very high	82.9	Confident	149 Å²	149	57 Å²	57	65%	0.648	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	131.3	170.2	176.8	-179.1	177.9	-166.6	0	109.1	L658 I659 T661	L658-K676 CarbonylContact O-C 3.58Å; L658-K676 WeakPolarHBondContact O-CA 3.49Å; I659-K676 WeakPolarHBondContact O-CG 3.34Å; T661-K676 PolarHBondContact OG1-N 2.95Å
677	G	85.1	Confident	84	Confident	35 Å²	35	53.6 Å²	53.6	36%	0.361	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.5	-30.4	178.3	0	0	0	0	0	113.4	K657 L658	K657-G677 VanDerWaalsContact CE-O 3.29Å; K657-G677 WeakPolarHBondContact CE-O 3.35Å; L658-G677 PolarHBondContact O-N 3.38Å
678	D	89.7	Confident	85.2	Confident	39 Å²	39	45.4 Å²	45.4	21%	0.209	23%	0.231	C	C	.	.			trans	-62.5	156.1	-176.5	-55.9	-24	0	0	0	113	L658 K675 Y704	L658-D678 WeakPolarHBondContact CB-O 3.45Å; L658-D678 HydrophobicContact CD1-CB 3.78Å; L658-D678 PolarHBondContact N-O 2.91Å; K675-D678 WeakPolarHBondContact CA-OD2 3.27Å; K675-D678 WeakPolarHBondContact CB-OD2 3.43Å; K675-D678 PolarHBondContact N-OD2 3.27Å; D678-Y704 HydrophobicContact CB-CE2 3.96Å; D678-Y704 PolarHBondContact OD2-OH 3.48Å
679	V	88.9	Confident	86	Confident	18 Å²	18	48.7 Å²	48.7	11%	0.109	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	142.7	172.9	179.9	0	0	0	0	110.2	F655 G656 P724 Y726 W727	F655-V679 HydrophobicContact CB-CG1 4.37Å; F655-V679 HydrophobicContact CD1-CG1 4.15Å; G656-V679 CarbonylContact O-C 3.53Å; G656-V679 WeakPolarHBondContact O-CA 3.43Å; V679-P724 HydrophobicContact CG1-CB 4.34Å; V679-P724 HydrophobicContact CG1-CG 3.81Å; V679-P724 HydrophobicContact CG2-CB 4.13Å; V679-P724 HydrophobicContact CG2-CG 4.31Å; V679-Y726 WeakPolarHBondContact CG2-O 3.3Å; V679-W727 HydrophobicContact CB-CE3 4.43Å; V679-W727 HydrophobicContact CG1-CE3 3.84Å; V679-W727 HydrophobicContact CG1-CZ3 4Å
680	I	90.3	Very high	86.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	143.6	172.2	-172.9	166.5	0	0	0	110.5	F655 G656 L658 L672 L682 Y703 V711 V716	F655-I680 WeakPolarHBondContact CA-O 3.35Å; G656-I680 PolarHBondContact N-O 2.97Å; G656-I680 WeakPolarHBondContact O-CG2 3.29Å; G656-I680 PolarHBondContact O-N 2.88Å; L658-I680 HydrophobicContact CD1-CB 3.99Å; L658-I680 HydrophobicContact CD1-CG2 4.22Å; L658-I680 HydrophobicContact CD2-CB 4.47Å; L658-I680 HydrophobicContact CD2-CG2 3.94Å; L658-I680 HydrophobicContact CG-CB 4.3Å; L658-I680 HydrophobicContact CG-CG2 3.95Å; L672-I680 HydrophobicContact CD1-CD1 4Å; I680-L682 HydrophobicContact CG1-CD2 4.48Å; I680-L682 HydrophobicContact CG2-CD2 4.07Å; I680-Y703 WeakPolarHBondContact CG1-O 3.49Å; I680-V711 HydrophobicContact CD1-CB 4.35Å; I680-V711 HydrophobicContact CD1-CG2 3.44Å; I680-V711 VanDerWaalsContact CD1-CG2 3.44Å; I680-V716 HydrophobicContact CG2-CG1 4.17Å
681	A	89.6	Confident	85.7	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.9	167.5	0	0	0	0	0	110	L653 K654 F655 G702 Y703 W727	L653-A681 HydrophobicContact CB-CB 4.42Å; L653-A681 HydrophobicContact CD1-CB 4.09Å; K654-A681 CarbonylContact O-C 3.6Å; F655-A681 HydrophobicContact CD1-CB 4.21Å; F655-A681 HydrophobicContact CE1-CB 3.99Å; A681-G702 CarbonylContact O-C 3.49Å; A681-G702 WeakPolarHBondContact O-CA 3.2Å; A681-Y703 PolarHBondContact N-O 3.39Å; A681-Y703 PolarHBondContact O-N 3.06Å; A681-W727 HydrophobicContact CB-CH2 3.48Å; A681-W727 VanDerWaalsContact CB-CH2 3.48Å; A681-W727 HydrophobicContact CB-CZ2 4.46Å; A681-W727 HydrophobicContact CB-CZ3 3.91Å
682	L	90.4	Very high	84.7	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.8	178.1	-52.6	-179.2	0	0	0	108.3	K654 I680 Y700 I701 V716 V718	K654-L682 PolarHBondContact N-O 3.49Å; K654-L682 PolarHBondContact O-N 3.37Å; I680-L682 HydrophobicContact CG1-CD2 4.48Å; I680-L682 HydrophobicContact CG2-CD2 4.07Å; L682-Y700 HydrophobicContact CD1-CD2 4.28Å; L682-Y700 HydrophobicContact CD1-CG 4.3Å; L682-Y700 HydrophobicContact CD2-CG 4.49Å; L682-I701 WeakPolarHBondContact CA-O 3.24Å; L682-V716 HydrophobicContact CD1-CG1 4.28Å; L682-V718 HydrophobicContact CD1-CG2 4.09Å
683	L	85.8	Confident	83.4	Confident	14 Å²	14	58 Å²	58	7%	0.073	28%	0.278	C	S	.	.	S	Bend	trans	-84.2	-18.4	-174.9	-76.2	77.1	0	0	0	113.1	L653 I701 L708 L732 L737 T944	L653-L683 HydrophobicContact CD2-CB 4.46Å; L653-L683 HydrophobicContact CD2-CD1 4.5Å; L653-L683 HydrophobicContact CD2-CG 3.97Å; L683-I701 HydrophobicContact CB-CG2 4.49Å; L683-I701 PolarHBondContact N-O 3.18Å; L683-L708 HydrophobicContact CD1-CD1 3.6Å; L683-L708 HydrophobicContact CD2-CD1 3.56Å; L683-L708 HydrophobicContact CG-CD1 4.23Å; L683-L732 HydrophobicContact CD1-CD2 4.12Å; L683-L732 HydrophobicContact CD2-CD2 4.02Å; L683-L732 HydrophobicContact CG-CD2 4.06Å; L683-L737 HydrophobicContact CD2-CD1 3.5Å; L683-L737 VanDerWaalsContact CD2-CD1 3.5Å; L683-L737 HydrophobicContact CD2-CD2 4.43Å; L683-T944 PolarHBondContact O-OG1 2.87Å
684	S	80.1	Confident	81.9	Confident	29 Å²	29	62.5 Å²	62.5	20%	0.203	30%	0.304	C	S	.	.			trans	-153.1	150.1	179.3	-175.9	0	0	0	0	110.3	E686	S684-E686 VanDerWaalsContact C-N 3.26Å; S684-E686 WeakPolarHBondContact OG-CB 3.28Å; S684-E686 WeakPolarHBondContact OG-CG 3.22Å; S684-E686 PolarHBondContact OG-N 3.34Å; S684-E686 VanDerWaalsContact OG-N 3.07Å
685	E	75.9	Confident	81	Confident	131 Å²	131	72 Å²	72	61%	0.612	34%	0.339	S	S	*	.	S	Bend	trans	-77.6	-16.5	169.1	-50.1	-160.7	-134.9	0	0	111.9	K654 K687	K654-E685 HydrophobicContact CD-CG 4.18Å; K654-E685 WeakPolarHBondContact CE-OE1 3.48Å; K654-E685 IonicContact NZ-OE1 2.94Å; K654-E685 PolarHBondContact NZ-OE1 3.39Å; K654-E685 IonicContact NZ-OE2 3.55Å; K654-E685 PolarHBondContact NZ-OE2 3.38Å; E685-K687 PolarHBondContact O-N 3.22Å
686	E	81.2	Confident	80.6	Confident	43 Å²	43	69 Å²	69	20%	0.201	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-67.6	124.6	179.8	-57.3	-152.1	106.9	0	0	110.8	R620 F622 S684 R908	R620-E686 IonicContact CZ-OE1 3.35Å; R620-E686 IonicContact NH1-OE1 2.83Å; R620-E686 PolarHBondContact NH1-OE1 2.93Å; R620-E686 IonicContact NH2-OE1 2.76Å; R620-E686 PolarHBondContact NH2-OE1 2.85Å; F622-E686 WeakPolarHBondContact CZ-OE2 3.09Å; S684-E686 VanDerWaalsContact C-N 3.26Å; S684-E686 WeakPolarHBondContact OG-CB 3.28Å; S684-E686 WeakPolarHBondContact OG-CG 3.22Å; S684-E686 PolarHBondContact OG-N 3.34Å; S684-E686 VanDerWaalsContact OG-N 3.07Å; E686-R908 IonicContact OE2-NH1 2.74Å; E686-R908 PolarHBondContact OE2-NH1 3.01Å
687	K	87.2	Confident	80.4	Confident	87 Å²	87	65.8 Å²	65.8	38%	0.378	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-94.1	117.9	179.4	-61.8	178.3	-174.6	172.9	0	110.6	E685 E698 W699 Y700 A713	E685-K687 PolarHBondContact O-N 3.22Å; K687-E698 HydrophobicContact CB-CB 4.27Å; K687-E698 HydrophobicContact CD-CB 4Å; K687-E698 HydrophobicContact CD-CG 4.29Å; K687-E698 WeakPolarHBondContact CD-OE2 3.39Å; K687-E698 IonicContact NZ-OE2 2.84Å; K687-E698 PolarHBondContact NZ-OE2 2.89Å; K687-W699 CarbonylContact C-O 3.55Å; K687-W699 WeakPolarHBondContact CA-O 3.41Å; K687-Y700 HydrophobicContact CD-CE1 4.21Å; K687-Y700 VanDerWaalsContact CE-OH 3.32Å; K687-Y700 WeakPolarHBondContact CE-OH 3.29Å; K687-Y700 HydrophobicContact CG-CD1 3.9Å; K687-Y700 HydrophobicContact CG-CE1 3.51Å; K687-A713 HydrophobicContact CD-CB 4.35Å
688	I	87.4	Confident	80.6	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.021	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	139.2	171.8	-64.2	175.2	0	0	0	109.3	L690 E698 W699 I701 L710 L936 N940	I688-L690 HydrophobicContact CG2-CD1 4.31Å; I688-L690 HydrophobicContact CG2-CD2 3.74Å; I688-L690 HydrophobicContact CG2-CG 3.86Å; I688-E698 CarbonylContact O-C 3.57Å; I688-E698 WeakPolarHBondContact O-CA 3.26Å; I688-W699 PolarHBondContact N-O 3.4Å; I688-W699 PolarHBondContact O-N 2.92Å; I688-I701 HydrophobicContact CD1-CD1 3.8Å; I688-I701 HydrophobicContact CD1-CG1 3.78Å; I688-L710 HydrophobicContact CD1-CD2 4.03Å; I688-L936 HydrophobicContact CD1-CG 4.21Å; I688-L936 HydrophobicContact CG2-CD2 3.61Å; I688-L936 HydrophobicContact CG2-CG 4.26Å; I688-N940 HydrophobicContact CD1-CB 4.5Å
689	K	85.2	Confident	80.7	Confident	117 Å²	117	67.2 Å²	67.2	51%	0.509	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.9	-178.9	-69.4	174.7	-177	170.7	0	110	T696 K697 Q912	K689-T696 HydrophobicContact CB-CG2 4.02Å; K689-K697 WeakPolarHBondContact CA-O 3.34Å; K689-Q912 PolarHBondContact O-NE2 3.37Å; K689-Q912 PolarHBondContact O-OE1 2.94Å
690	L	80.1	Confident	80.8	Confident	14 Å²	14	68 Å²	68	7%	0.073	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	147.2	-177.6	-54	174.4	0	0	0	110.9	I688 G692 T696 K697 W699 L710 T933 L936	I688-L690 HydrophobicContact CG2-CD1 4.31Å; I688-L690 HydrophobicContact CG2-CD2 3.74Å; I688-L690 HydrophobicContact CG2-CG 3.86Å; L690-G692 PolarHBondContact O-N 3.46Å; L690-T696 WeakPolarHBondContact O-CA 3.46Å; L690-K697 PolarHBondContact N-O 3.07Å; L690-K697 PolarHBondContact O-N 3.04Å; L690-W699 HydrophobicContact CD1-CG 4.36Å; L690-L710 HydrophobicContact CD1-CD1 3.52Å; L690-T933 HydrophobicContact CD1-CG2 4.26Å; L690-L936 HydrophobicContact CD2-CD2 4.17Å
691	R	70.2	Confident	80.9	Confident	117 Å²	117	68 Å²	68	44%	0.442	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	112.3	179.2	-157.5	177.9	-177.5	-172.5	1.9	110.2	D919	R691-D919 HydrophobicContact CB-CB 3.77Å; R691-D919 VanDerWaalsContact CB-CG 3.48Å; R691-D919 WeakPolarHBondContact CB-OD2 3.46Å; R691-D919 VanDerWaalsContact CD-O 3.26Å; R691-D919 WeakPolarHBondContact CD-O 3.42Å; R691-D919 PolarHBondContact N-OD2 3.01Å; R691-D919 PolarHBondContact NH1-O 2.84Å
692	G	64.9	Low	80.9	Confident	15 Å²	15	68 Å²	68	16%	0.155	32%	0.315	C	S	.	.			trans	-73.5	172.5	161.8	0	0	0	0	0	110.8	L690 L694 R695	L690-G692 PolarHBondContact O-N 3.46Å; G692-L694 PolarHBondContact O-N 2.94Å; G692-R695 VanDerWaalsContact CA-O 3.31Å; G692-R695 WeakPolarHBondContact CA-O 3.13Å; G692-R695 PolarHBondContact N-O 3.28Å; G692-R695 PolarHBondContact O-N 3.12Å
693	Q	60.3	Low	80.9	Confident	194 Å²	194	68 Å²	68	91%	0.907	31%	0.314	S	S	*	.	S	Bend	trans	-44.9	-34.3	-175.1	-71.1	160.4	-58.5	0	0	115.5
694	L	58.5	Low	81.1	Confident	162 Å²	162	67.9 Å²	67.9	85%	0.848	31%	0.313	S	S	*	.	S	Bend	trans	-130.6	-16	-179.2	-65.5	173	0	0	0	115.1	G692	G692-L694 PolarHBondContact O-N 2.94Å
695	R	71.8	Confident	81.2	Confident	204 Å²	204	71.5 Å²	71.5	77%	0.77	33%	0.327	S	S	*	.	S	Bend	trans	-151.1	149.3	-176.2	-65.9	-171.8	-177.2	179.3	1.6	110.7	G692	G692-R695 VanDerWaalsContact CA-O 3.31Å; G692-R695 WeakPolarHBondContact CA-O 3.13Å; G692-R695 PolarHBondContact N-O 3.28Å; G692-R695 PolarHBondContact O-N 3.12Å
696	T	80.1	Confident	81.6	Confident	71 Å²	71	66.2 Å²	66.2	44%	0.436	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	139	168	-47.6	0	0	0	0	110.4	K689 L690	K689-T696 HydrophobicContact CB-CG2 4.02Å; L690-T696 WeakPolarHBondContact O-CA 3.46Å
697	K	85.6	Confident	81.8	Confident	82 Å²	82	70.5 Å²	70.5	36%	0.357	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.5	-177.9	-75.1	178.6	170.5	-170.9	0	110	K689 L690 W699	K689-K697 WeakPolarHBondContact CA-O 3.34Å; L690-K697 PolarHBondContact N-O 3.07Å; L690-K697 PolarHBondContact O-N 3.04Å; K697-W699 HydrophobicContact CB-CZ2 4.29Å; K697-W699 HydrophobicContact CD-CZ2 4.24Å; K697-W699 PolarHBondContact O-NE1 3.34Å
698	E	89.9	Confident	81.9	Confident	77 Å²	77	66.8 Å²	66.8	36%	0.36	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	141	175	-59	-171.1	143.8	0	0	111	K687 I688 A713	K687-E698 HydrophobicContact CB-CB 4.27Å; K687-E698 HydrophobicContact CD-CB 4Å; K687-E698 HydrophobicContact CD-CG 4.29Å; K687-E698 WeakPolarHBondContact CD-OE2 3.39Å; K687-E698 IonicContact NZ-OE2 2.84Å; K687-E698 PolarHBondContact NZ-OE2 2.89Å; I688-E698 CarbonylContact O-C 3.57Å; I688-E698 WeakPolarHBondContact O-CA 3.26Å; E698-A713 HydrophobicContact CB-CB 3.86Å; E698-A713 PolarHBondContact O-N 3.21Å
699	W	90.6	Very high	82	Confident	27 Å²	27	66.6 Å²	66.6	10%	0.102	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	135	-178.3	-53	79.5	0	0	0	110.4	L671 K687 I688 L690 K697 L710 V711 H712	L671-W699 HydrophobicContact CD2-CE3 4.48Å; L671-W699 HydrophobicContact CD2-CZ3 4.28Å; K687-W699 CarbonylContact C-O 3.55Å; K687-W699 WeakPolarHBondContact CA-O 3.41Å; I688-W699 PolarHBondContact N-O 3.4Å; I688-W699 PolarHBondContact O-N 2.92Å; L690-W699 HydrophobicContact CD1-CG 4.36Å; K697-W699 HydrophobicContact CB-CZ2 4.29Å; K697-W699 HydrophobicContact CD-CZ2 4.24Å; K697-W699 PolarHBondContact O-NE1 3.34Å; W699-L710 HydrophobicContact CB-CB 4.22Å; W699-L710 HydrophobicContact CB-CD2 4.16Å; W699-L710 HydrophobicContact CE3-CB 4.15Å; W699-V711 CarbonylContact C-O 3.55Å; W699-V711 VanDerWaalsContact CA-O 3.23Å; W699-V711 WeakPolarHBondContact CA-O 3.46Å; W699-H712 HydrophobicContact CD2-CB 4.42Å; W699-H712 HydrophobicContact CE3-CB 3.9Å; W699-H712 VanDerWaalsContact CE3-N 3.29Å; W699-H712 HydrophobicContact CH2-CB 4.19Å; W699-H712 HydrophobicContact CZ3-CB 3.77Å
700	Y	91.8	Very high	82.3	Confident	33 Å²	33	61 Å²	61	13%	0.129	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	150.3	166.1	-62.3	-65.8	0	0	0	110	L682 K687 L710 V711 A713 V716 V718	L682-Y700 HydrophobicContact CD1-CD2 4.28Å; L682-Y700 HydrophobicContact CD1-CG 4.3Å; L682-Y700 HydrophobicContact CD2-CG 4.49Å; K687-Y700 HydrophobicContact CD-CE1 4.21Å; K687-Y700 VanDerWaalsContact CE-OH 3.32Å; K687-Y700 WeakPolarHBondContact CE-OH 3.29Å; K687-Y700 HydrophobicContact CG-CD1 3.9Å; K687-Y700 HydrophobicContact CG-CE1 3.51Å; Y700-L710 WeakPolarHBondContact O-CA 3.24Å; Y700-V711 PolarHBondContact N-O 3.02Å; Y700-V711 PolarHBondContact O-N 3.29Å; Y700-A713 HydrophobicContact CD2-CB 4.06Å; Y700-A713 HydrophobicContact CE2-CB 3.74Å; Y700-V716 HydrophobicContact CD2-CB 4.38Å; Y700-V716 HydrophobicContact CD2-CG2 4.28Å; Y700-V716 HydrophobicContact CE2-CB 4.41Å; Y700-V718 HydrophobicContact CE2-CG2 4.5Å
701	I	92	Very high	82.8	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	118.2	161.7	-54.3	175.3	0	0	0	107.8	L682 L683 I688 L708 L710 V937 N940	L682-I701 WeakPolarHBondContact CA-O 3.24Å; L683-I701 HydrophobicContact CB-CG2 4.49Å; L683-I701 PolarHBondContact N-O 3.18Å; I688-I701 HydrophobicContact CD1-CD1 3.8Å; I688-I701 HydrophobicContact CD1-CG1 3.78Å; I701-L708 HydrophobicContact CG2-CD1 3.77Å; I701-L708 HydrophobicContact CG2-CG 4.23Å; I701-L710 HydrophobicContact CG1-CD2 4.06Å; I701-V937 HydrophobicContact CD1-CG1 4.34Å; I701-V937 HydrophobicContact CD1-CG2 4.45Å; I701-V937 HydrophobicContact CG1-CG2 4.43Å; I701-V937 HydrophobicContact CG2-CG1 4.17Å; I701-N940 HydrophobicContact CD1-CB 3.44Å; I701-N940 VanDerWaalsContact CD1-CB 3.44Å
702	G	90.7	Very high	83.7	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	161.5	176.9	0	0	0	0	0	113	L672 A681 G709	L672-G702 WeakPolarHBondContact CD1-O 3.37Å; A681-G702 CarbonylContact O-C 3.49Å; A681-G702 WeakPolarHBondContact O-CA 3.2Å; G702-G709 PolarHBondContact N-O 2.98Å; G702-G709 PolarHBondContact O-N 3.49Å
703	Y	90.6	Very high	85	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.016	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.7	174.8	173.3	-95	0	0	0	109.8	I680 A681 K707 W727 P730 L732	I680-Y703 WeakPolarHBondContact CG1-O 3.49Å; A681-Y703 PolarHBondContact N-O 3.39Å; A681-Y703 PolarHBondContact O-N 3.06Å; Y703-K707 WeakPolarHBondContact CA-O 3.26Å; Y703-W727 HydrophobicContact CD1-CH2 4.48Å; Y703-W727 HydrophobicContact CD1-CZ2 4.29Å; Y703-W727 HydrophobicContact CE1-CZ2 4.39Å; Y703-P730 WeakPolarHBondContact CE1-O 3.5Å; Y703-P730 PolarHBondContact OH-O 3.31Å; Y703-L732 HydrophobicContact CD1-CB 3.99Å; Y703-L732 HydrophobicContact CD1-CD1 4.49Å; Y703-L732 HydrophobicContact CD2-CD1 3.8Å; Y703-L732 HydrophobicContact CE1-CB 3.92Å; Y703-L732 HydrophobicContact CE1-CD1 4.44Å; Y703-L732 HydrophobicContact CE2-CD1 3.74Å; Y703-L732 HydrophobicContact CG-CB 4.4Å; Y703-L732 HydrophobicContact CG-CD1 4.15Å; Y703-L732 HydrophobicContact CG-CD2 4.29Å
704	Y	88.4	Confident	86.3	Confident	12 Å²	12	55 Å²	55	5%	0.047	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	130.2	-173.2	176.8	-100.9	0	0	0	109.5	L658 E673 D678 G706 K707	L658-Y704 HydrophobicContact CD1-CD2 4.32Å; L658-Y704 HydrophobicContact CD1-CE2 4.28Å; E673-Y704 WeakPolarHBondContact O-CD1 3.48Å; E673-Y704 WeakPolarHBondContact O-CE1 3.41Å; D678-Y704 HydrophobicContact CB-CE2 3.96Å; D678-Y704 PolarHBondContact OD2-OH 3.48Å; Y704-G706 VanDerWaalsContact C-N 3.35Å; Y704-G706 PolarHBondContact O-N 3.07Å; Y704-K707 PolarHBondContact N-O 3.37Å; Y704-K707 PolarHBondContact O-N 3.03Å
705	Q	83.7	Confident	87.9	Confident	105 Å²	105	48.3 Å²	48.3	49%	0.491	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	52	177.9	-64.2	-175.1	-13.7	0	0	114.1	K707	Q705-K707 VanDerWaalsContact C-N 3.26Å; Q705-K707 PolarHBondContact O-N 3.08Å
706	G	82.8	Confident	88.8	Confident	21 Å²	21	39.3 Å²	39.3	22%	0.216	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.7	8.4	177.6	0	0	0	0	0	115.5	Y704 Q740	Y704-G706 VanDerWaalsContact C-N 3.35Å; Y704-G706 PolarHBondContact O-N 3.07Å; G706-Q740 PolarHBondContact O-NE2 3.47Å
707	K	86.8	Confident	89.3	Confident	132 Å²	132	40.7 Å²	40.7	57%	0.574	19%	0.194	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.6	-177.6	-65.6	167.9	-172.8	161	0	111.2	L672 Y703 Y704 Q705	L672-K707 HydrophobicContact CD2-CB 3.75Å; Y703-K707 WeakPolarHBondContact CA-O 3.26Å; Y704-K707 PolarHBondContact N-O 3.37Å; Y704-K707 PolarHBondContact O-N 3.03Å; Q705-K707 VanDerWaalsContact C-N 3.26Å; Q705-K707 PolarHBondContact O-N 3.08Å
708	L	89.2	Confident	89.4	Confident	9 Å²	9	39.9 Å²	39.9	5%	0.047	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.4	169.8	-172.3	70.2	0	0	0	109.6	L683 I701 L737 Q740 I741 V937	L683-L708 HydrophobicContact CD1-CD1 3.6Å; L683-L708 HydrophobicContact CD2-CD1 3.56Å; L683-L708 HydrophobicContact CG-CD1 4.23Å; I701-L708 HydrophobicContact CG2-CD1 3.77Å; I701-L708 HydrophobicContact CG2-CG 4.23Å; L708-L737 HydrophobicContact CD2-CD1 4.04Å; L708-Q740 HydrophobicContact CB-CB 3.79Å; L708-Q740 HydrophobicContact CB-CG 4.39Å; L708-Q740 HydrophobicContact CD2-CB 4.22Å; L708-I741 HydrophobicContact CD2-CG2 3.48Å; L708-I741 VanDerWaalsContact CD2-CG2 3.48Å; L708-V937 HydrophobicContact CD2-CG1 3.81Å; L708-V937 HydrophobicContact CG-CG1 4.26Å
709	G	89.3	Confident	89.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176	-166.8	175.1	0	0	0	0	0	113.7	G702	G702-G709 PolarHBondContact N-O 2.98Å; G702-G709 PolarHBondContact O-N 3.49Å
710	L	90.6	Very high	88.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133	-169.8	-62.9	165.9	0	0	0	112.3	Y670 L671 L672 I688 L690 W699 Y700 I701 T933 V937	Y670-L710 WeakPolarHBondContact O-CB 3.49Å; Y670-L710 PolarHBondContact O-N 3.45Å; L671-L710 HydrophobicContact CD2-CB 4Å; L671-L710 HydrophobicContact CD2-CD1 4.12Å; L672-L710 PolarHBondContact N-O 2.92Å; I688-L710 HydrophobicContact CD1-CD2 4.03Å; L690-L710 HydrophobicContact CD1-CD1 3.52Å; W699-L710 HydrophobicContact CB-CB 4.22Å; W699-L710 HydrophobicContact CB-CD2 4.16Å; W699-L710 HydrophobicContact CE3-CB 4.15Å; Y700-L710 WeakPolarHBondContact O-CA 3.24Å; I701-L710 HydrophobicContact CG1-CD2 4.06Å; L710-T933 HydrophobicContact CD1-CG2 3.44Å; L710-T933 VanDerWaalsContact CD1-CG2 3.44Å; L710-V937 HydrophobicContact CD2-CG2 4.07Å; L710-V937 HydrophobicContact CG-CG2 4.18Å
711	V	90.6	Very high	87.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.3	172	180	0	0	0	0	110.1	L658 L672 Y674 I680 W699 Y700 A713 V716	L658-V711 HydrophobicContact CD2-CG1 3.92Å; L672-V711 HydrophobicContact CB-CG2 3.97Å; L672-V711 HydrophobicContact CD1-CG2 3.88Å; L672-V711 HydrophobicContact CG-CG2 4.46Å; Y674-V711 HydrophobicContact CD1-CG2 4.14Å; Y674-V711 HydrophobicContact CE1-CB 4.35Å; Y674-V711 HydrophobicContact CE1-CG1 3.85Å; Y674-V711 HydrophobicContact CE1-CG2 3.82Å; Y674-V711 HydrophobicContact CE2-CG1 4.48Å; I680-V711 HydrophobicContact CD1-CB 4.35Å; I680-V711 HydrophobicContact CD1-CG2 3.44Å; I680-V711 VanDerWaalsContact CD1-CG2 3.44Å; W699-V711 CarbonylContact C-O 3.55Å; W699-V711 VanDerWaalsContact CA-O 3.23Å; W699-V711 WeakPolarHBondContact CA-O 3.46Å; Y700-V711 PolarHBondContact N-O 3.02Å; Y700-V711 PolarHBondContact O-N 3.29Å; V711-A713 PolarHBondContact O-N 3.1Å; V711-V716 HydrophobicContact CB-CG2 4.23Å; V711-V716 HydrophobicContact CG1-CG2 3.37Å
712	H	90.4	Very high	87	Confident	27 Å²	27	50 Å²	50	13%	0.125	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	127.6	-178.3	-179.4	-114.6	0	0	0	110.4	W699 K714 N715	W699-H712 HydrophobicContact CD2-CB 4.42Å; W699-H712 HydrophobicContact CE3-CB 3.9Å; W699-H712 VanDerWaalsContact CE3-N 3.29Å; W699-H712 HydrophobicContact CH2-CB 4.19Å; W699-H712 HydrophobicContact CZ3-CB 3.77Å; H712-K714 VanDerWaalsContact C-N 3.26Å; H712-K714 PolarHBondContact O-N 3.18Å; H712-K714 VanDerWaalsContact O-N 3.14Å; H712-N715 HydrophobicContact CB-CB 4.39Å; H712-N715 PolarHBondContact ND1-OD1 2.94Å; H712-N715 WeakPolarHBondContact O-CA 3.28Å; H712-N715 WeakPolarHBondContact O-CB 3.5Å; H712-N715 PolarHBondContact O-N 3.45Å
713	A	90.4	Very high	86.2	Confident	11 Å²	11	54.7 Å²	54.7	9%	0.091	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-59.9	-33.5	-168.9	0	0	0	0	0	113.5	K687 E698 Y700 V711 N715 V716	K687-A713 HydrophobicContact CD-CB 4.35Å; E698-A713 HydrophobicContact CB-CB 3.86Å; E698-A713 PolarHBondContact O-N 3.21Å; Y700-A713 HydrophobicContact CD2-CB 4.06Å; Y700-A713 HydrophobicContact CE2-CB 3.74Å; V711-A713 PolarHBondContact O-N 3.1Å; A713-N715 PolarHBondContact O-N 2.89Å; A713-V716 PolarHBondContact O-N 3.15Å
714	K	89.3	Confident	85.2	Confident	174 Å²	174	56 Å²	56	76%	0.757	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-73.9	-1.8	175.1	-55.9	-163.2	174.2	-160.3	0	114.7	I659 H712	I659-K714 WeakPolarHBondContact CD1-O 3.45Å; H712-K714 VanDerWaalsContact C-N 3.26Å; H712-K714 PolarHBondContact O-N 3.18Å; H712-K714 VanDerWaalsContact O-N 3.14Å
715	N	91.1	Very high	84.1	Confident	22 Å²	22	63.1 Å²	63.1	12%	0.118	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-101.6	-0.6	178.1	-61.9	18.7	0	0	0	112.2	L658 I659 Y674 H712 A713	L658-N715 WeakPolarHBondContact CA-O 3.48Å; I659-N715 PolarHBondContact N-O 3.34Å; Y674-N715 HydrophobicContact CE2-CB 4.32Å; Y674-N715 PolarHBondContact OH-ND2 3.48Å; H712-N715 HydrophobicContact CB-CB 4.39Å; H712-N715 PolarHBondContact ND1-OD1 2.94Å; H712-N715 WeakPolarHBondContact O-CA 3.28Å; H712-N715 WeakPolarHBondContact O-CB 3.5Å; H712-N715 PolarHBondContact O-N 3.45Å; A713-N715 PolarHBondContact O-N 2.89Å
716	V	91.3	Very high	83.1	Confident	15 Å²	15	67.1 Å²	67.1	9%	0.091	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126.6	-178	-168.4	0	0	0	0	109.9	L658 I680 L682 Y700 V711 A713	L658-V716 HydrophobicContact CD2-CG2 4.17Å; I680-V716 HydrophobicContact CG2-CG1 4.17Å; L682-V716 HydrophobicContact CD1-CG1 4.28Å; Y700-V716 HydrophobicContact CD2-CB 4.38Å; Y700-V716 HydrophobicContact CD2-CG2 4.28Å; Y700-V716 HydrophobicContact CE2-CB 4.41Å; V711-V716 HydrophobicContact CB-CG2 4.23Å; V711-V716 HydrophobicContact CG1-CG2 3.37Å; A713-V716 PolarHBondContact O-N 3.15Å
717	L	90.2	Very high	82.5	Confident	101 Å²	101	68.3 Å²	68.3	53%	0.529	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	112.4	162.8	177.8	66.3	0	0	0	107.6	G656 K657 I659	G656-L717 CarbonylContact C-O 3.56Å; G656-L717 WeakPolarHBondContact CA-O 3.45Å; K657-L717 PolarHBondContact N-O 3.09Å; K657-L717 PolarHBondContact O-N 3.47Å; I659-L717 HydrophobicContact CG2-CB 3.91Å
718	V	88.9	Confident	81.1	Confident	64 Å²	64	66 Å²	66	39%	0.388	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	130.7	179.8	-176.5	0	0	0	0	109.3	K654 L682 Y700	K654-V718 HydrophobicContact CD-CG1 4.47Å; L682-V718 HydrophobicContact CD1-CG2 4.09Å; Y700-V718 HydrophobicContact CE2-CG2 4.5Å
719	L	81.9	Confident	80	Confident	91 Å²	91	67.2 Å²	67.2	48%	0.476	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-26.2	-175.5	-60.5	179.1	0	0	0	113.5	F655 K657 P724	F655-L719 PolarHBondContact O-N 3.26Å; K657-L719 HydrophobicContact CB-CD1 4.21Å; K657-L719 HydrophobicContact CB-CD2 4.26Å; K657-L719 HydrophobicContact CB-CG 4.38Å; L719-P724 HydrophobicContact CD1-CG 4.02Å
720	G	81	Confident	79.4	Confident	24 Å²	24	71 Å²	71	25%	0.247	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.3	-159.2	-178.5	0	0	0	0	0	113	K654 F655	K654-G720 CarbonylContact C-O 3.52Å; K654-G720 VanDerWaalsContact CA-O 3.26Å; K654-G720 WeakPolarHBondContact CA-O 3.47Å; F655-G720 PolarHBondContact N-O 3.37Å
721	K	77.5	Confident	78.9	Confident	113 Å²	113	74.4 Å²	74.4	49%	0.491	39%	0.393	S	S	.	.	S	Bend	trans	-86.8	-21.4	175.3	-73.4	-169.2	178.2	-168.1	0	114	N652 K654 K723	N652-K721 PolarHBondContact OD1-NZ 3.48Å; K654-K721 HydrophobicContact CG-CG 4.48Å; K721-K723 PolarHBondContact O-N 3.15Å
722	V	72.5	Confident	78.6	Confident	123 Å²	123	74.7 Å²	74.7	75%	0.745	40%	0.395	S	S	*	.	S	Bend	trans	-67	129	-175.7	-176.6	0	0	0	0	110.2	F655 P724	F655-V722 VanDerWaalsContact CD2-O 3.28Å; F655-V722 WeakPolarHBondContact CD2-O 3.21Å; V722-P724 VanDerWaalsContact O-CD 3.24Å; V722-P724 WeakPolarHBondContact O-CD 3.26Å
723	K	73	Confident	78.5	Confident	100 Å²	100	74.9 Å²	74.9	44%	0.435	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-69	117	176.5	-170.9	178.8	-172	-177.3	0	109.5	F655 K721 D731	F655-K723 HydrophobicContact CE1-CG 4.13Å; F655-K723 HydrophobicContact CE2-CB 3.95Å; F655-K723 HydrophobicContact CE2-CG 4.33Å; F655-K723 HydrophobicContact CZ-CB 3.95Å; F655-K723 HydrophobicContact CZ-CG 3.81Å; K721-K723 PolarHBondContact O-N 3.15Å; K723-D731 IonicContact NZ-OD1 3.49Å; K723-D731 PolarHBondContact NZ-OD1 2.79Å; K723-D731 IonicContact NZ-OD2 2.72Å; K723-D731 PolarHBondContact NZ-OD2 3.18Å
724	P	70.6	Confident	78.4	Confident	31 Å²	31	74.4 Å²	74.4	20%	0.201	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-69.1	145.3	-178.5	-23.3	37	0	0	0	112.2	F655 V679 L719 V722 Y726	F655-P724 HydrophobicContact CB-CG 3.89Å; F655-P724 VanDerWaalsContact CG-CD 3.43Å; F655-P724 HydrophobicContact CG-CG 4.23Å; V679-P724 HydrophobicContact CG1-CB 4.34Å; V679-P724 HydrophobicContact CG1-CG 3.81Å; V679-P724 HydrophobicContact CG2-CB 4.13Å; V679-P724 HydrophobicContact CG2-CG 4.31Å; L719-P724 HydrophobicContact CD1-CG 4.02Å; V722-P724 VanDerWaalsContact O-CD 3.24Å; V722-P724 WeakPolarHBondContact O-CD 3.26Å; P724-Y726 PolarHBondContact O-N 3.19Å; P724-Y726 VanDerWaalsContact O-N 3.15Å
725	I	65.1	Low	78.4	Confident	161 Å²	161	68.7 Å²	68.7	83%	0.826	37%	0.374	S	S	*	.	S	Bend	trans	-53.2	-37.4	-178.8	-58.3	170.1	0	0	0	112	W727	I725-W727 PolarHBondContact O-N 2.92Å
726	Y	62.6	Low	78.2	Confident	189 Å²	189	72.3 Å²	72.3	74%	0.741	39%	0.391	S	S	*	.			trans	-96	76.5	179.4	-57.9	-75.9	0	0	0	111.6	V679 P724	V679-Y726 WeakPolarHBondContact CG2-O 3.3Å; P724-Y726 PolarHBondContact O-N 3.19Å; P724-Y726 VanDerWaalsContact O-N 3.15Å
727	W	69.8	Low	78.1	Confident	47 Å²	47	71.6 Å²	71.6	18%	0.178	39%	0.387	C	S	.	.			trans	-99.9	109.4	176.1	178.3	-103.4	0	0	0	111.8	F655 V679 A681 Y703 I725 G729 D731	F655-W727 AromaticContact CD1-CE3 3.99Å; F655-W727 HydrophobicContact CD1-CE3 3.99Å; F655-W727 AromaticContact CD1-CZ3 3.76Å; F655-W727 HydrophobicContact CD1-CZ3 3.76Å; F655-W727 AromaticContact CE1-CE3 3.82Å; F655-W727 HydrophobicContact CE1-CE3 3.82Å; F655-W727 HydrophobicContact CE1-CH2 4.27Å; F655-W727 AromaticContact CE1-CZ3 3.68Å; F655-W727 HydrophobicContact CE1-CZ3 3.68Å; V679-W727 HydrophobicContact CB-CE3 4.43Å; V679-W727 HydrophobicContact CG1-CE3 3.84Å; V679-W727 HydrophobicContact CG1-CZ3 4Å; A681-W727 HydrophobicContact CB-CH2 3.48Å; A681-W727 VanDerWaalsContact CB-CH2 3.48Å; A681-W727 HydrophobicContact CB-CZ2 4.46Å; A681-W727 HydrophobicContact CB-CZ3 3.91Å; Y703-W727 HydrophobicContact CD1-CH2 4.48Å; Y703-W727 HydrophobicContact CD1-CZ2 4.29Å; Y703-W727 HydrophobicContact CE1-CZ2 4.39Å; I725-W727 PolarHBondContact O-N 2.92Å; W727-G729 PolarHBondContact NE1-O 2.65Å; W727-G729 PolarHBondContact O-N 3.22Å; W727-D731 PolarHBondContact NE1-OD1 2.86Å
728	C	57.5	Low	78.1	Confident	84 Å²	84	67.1 Å²	67.1	57%	0.568	36%	0.363	S	S	*	.			trans	-100.8	75.9	-174	-65.5	0	0	0	0	113
729	G	65.8	Low	78.1	Confident	34 Å²	34	66.2 Å²	66.2	35%	0.351	36%	0.356	S	S	.	.	S	Bend	trans	168.6	172.3	171.5	0	0	0	0	0	113.2	W727	W727-G729 PolarHBondContact NE1-O 2.65Å; W727-G729 PolarHBondContact O-N 3.22Å
730	P	76.9	Confident	78.4	Confident	80 Å²	80	63.4 Å²	63.4	52%	0.519	34%	0.341	S	S	.	.			trans	-61.3	150.5	168.1	27.9	-34.1	0	0	0	110.4	Y703	Y703-P730 WeakPolarHBondContact CE1-O 3.5Å; Y703-P730 PolarHBondContact OH-O 3.31Å
731	D	80.7	Confident	78.8	Confident	71 Å²	71	62.4 Å²	62.4	38%	0.38	33%	0.33	S	S	.	.			trans	-72.3	148.8	174.3	-84.2	-4	0	0	0	111.5	K723 W727 T733	K723-D731 IonicContact NZ-OD1 3.49Å; K723-D731 PolarHBondContact NZ-OD1 2.79Å; K723-D731 IonicContact NZ-OD2 2.72Å; K723-D731 PolarHBondContact NZ-OD2 3.18Å; W727-D731 PolarHBondContact NE1-OD1 2.86Å; D731-T733 PolarHBondContact O-N 2.85Å; D731-T733 VanDerWaalsContact O-N 3.15Å
732	L	84.6	Confident	79.4	Confident	6 Å²	6	57 Å²	57	3%	0.031	31%	0.306	C	S	.	.			trans	-78.3	99.5	-178.5	179.6	59.4	0	0	0	110.5	V650 L653 L683 Y703 L737	V650-L732 HydrophobicContact CB-CD2 4.23Å; V650-L732 HydrophobicContact CB-CG 4.19Å; V650-L732 HydrophobicContact CG2-CD2 4.25Å; V650-L732 HydrophobicContact CG2-CG 3.94Å; V650-L732 WeakPolarHBondContact CG2-O 3.43Å; V650-L732 PolarHBondContact N-O 3.07Å; L653-L732 HydrophobicContact CD1-CB 4.32Å; L653-L732 HydrophobicContact CD1-CD2 4.16Å; L653-L732 HydrophobicContact CD2-CD2 4.29Å; L683-L732 HydrophobicContact CD1-CD2 4.12Å; L683-L732 HydrophobicContact CD2-CD2 4.02Å; L683-L732 HydrophobicContact CG-CD2 4.06Å; Y703-L732 HydrophobicContact CD1-CB 3.99Å; Y703-L732 HydrophobicContact CD1-CD1 4.49Å; Y703-L732 HydrophobicContact CD2-CD1 3.8Å; Y703-L732 HydrophobicContact CE1-CB 3.92Å; Y703-L732 HydrophobicContact CE1-CD1 4.44Å; Y703-L732 HydrophobicContact CE2-CD1 3.74Å; Y703-L732 HydrophobicContact CG-CB 4.4Å; Y703-L732 HydrophobicContact CG-CD1 4.15Å; Y703-L732 HydrophobicContact CG-CD2 4.29Å; L732-L737 HydrophobicContact CD1-CB 4.05Å
733	T	88.6	Confident	80	Confident	32 Å²	32	54 Å²	54	20%	0.196	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-80.9	160	167.6	70.7	0	0	0	0	111.8	R648 D731 T735 M736 L737	R648-T733 CarbonylContact O-C 3.6Å; R648-T733 VanDerWaalsContact O-CA 3.28Å; R648-T733 WeakPolarHBondContact O-CA 3.49Å; D731-T733 PolarHBondContact O-N 2.85Å; D731-T733 VanDerWaalsContact O-N 3.15Å; T733-T735 PolarHBondContact OG1-OG1 2.94Å; T733-M736 PolarHBondContact O-N 2.9Å; T733-M736 WeakPolarHBondContact OG1-CB 3.22Å; T733-M736 VanDerWaalsContact OG1-CG 3.25Å; T733-M736 WeakPolarHBondContact OG1-CG 3.25Å; T733-M736 PolarHBondContact OG1-N 2.73Å; T733-L737 PolarHBondContact O-N 3.13Å
734	T	88.8	Confident	80.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-34.6	173.9	36.8	0	0	0	0	113.6	Q646 D647 R648 V650 L737 L738 L945 A948 A949	Q646-T734 PolarHBondContact O-OG1 2.88Å; D647-T734 VanDerWaalsContact CA-OG1 3.31Å; D647-T734 WeakPolarHBondContact CA-OG1 3.44Å; D647-T734 PolarHBondContact OD1-N 3.07Å; D647-T734 PolarHBondContact OD1-OG1 2.94Å; R648-T734 PolarHBondContact N-OG1 2.8Å; R648-T734 PolarHBondContact O-N 2.59Å; R648-T734 PolarHBondContact O-OG1 2.72Å; V650-T734 HydrophobicContact CG2-CG2 4.08Å; T734-L737 PolarHBondContact O-N 2.85Å; T734-L738 WeakPolarHBondContact O-CB 3.1Å; T734-L738 PolarHBondContact O-N 3.43Å; T734-L945 HydrophobicContact CG2-CD1 4.33Å; T734-A948 HydrophobicContact CG2-CB 3.43Å; T734-A948 VanDerWaalsContact CG2-CB 3.43Å; T734-A949 HydrophobicContact CG2-CB 4.07Å
735	T	88.6	Confident	80.9	Confident	55 Å²	55	47.9 Å²	47.9	34%	0.337	25%	0.253	S	S	.	.	H	α-helix	trans	-64.8	-42.9	171.9	48.7	0	0	0	0	111.8	F645 D647 T733 L738 D739	F645-T735 HydrophobicContact CE1-CG2 4.22Å; D647-T735 HydrophobicContact CB-CG2 3.82Å; D647-T735 WeakPolarHBondContact OD1-CG2 3.41Å; D647-T735 PolarHBondContact OD1-N 3.14Å; D647-T735 PolarHBondContact OD1-OG1 2.85Å; D647-T735 WeakPolarHBondContact OD2-CB 3.25Å; D647-T735 WeakPolarHBondContact OD2-CG2 3.29Å; D647-T735 PolarHBondContact OD2-OG1 2.97Å; T733-T735 PolarHBondContact OG1-OG1 2.94Å; T735-L738 PolarHBondContact O-N 3.5Å; T735-D739 PolarHBondContact O-N 3.22Å
736	M	86.9	Confident	81.6	Confident	98 Å²	98	44.5 Å²	44.5	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-67.5	-39	176.2	-68.2	-65.5	162	0	0	111.1	T733 Q740	T733-M736 PolarHBondContact O-N 2.9Å; T733-M736 WeakPolarHBondContact OG1-CB 3.22Å; T733-M736 VanDerWaalsContact OG1-CG 3.25Å; T733-M736 WeakPolarHBondContact OG1-CG 3.25Å; T733-M736 PolarHBondContact OG1-N 2.73Å; M736-Q740 WeakPolarHBondContact O-CB 3.19Å; M736-Q740 WeakPolarHBondContact O-CG 3.4Å; M736-Q740 PolarHBondContact O-N 3Å; M736-Q740 VanDerWaalsContact O-N 3.17Å
737	L	89.3	Confident	82.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-59.2	-48.6	171.4	-178.3	55.6	0	0	0	111.1	V650 L683 L708 L732 T733 T734 Q740 I741 L945	V650-L737 HydrophobicContact CG2-CD2 4.1Å; L683-L737 HydrophobicContact CD2-CD1 3.5Å; L683-L737 VanDerWaalsContact CD2-CD1 3.5Å; L683-L737 HydrophobicContact CD2-CD2 4.43Å; L708-L737 HydrophobicContact CD2-CD1 4.04Å; L732-L737 HydrophobicContact CD1-CB 4.05Å; T733-L737 PolarHBondContact O-N 3.13Å; T734-L737 PolarHBondContact O-N 2.85Å; L737-Q740 PolarHBondContact O-N 2.96Å; L737-I741 HydrophobicContact CD1-CG2 3.89Å; L737-I741 WeakPolarHBondContact O-CG1 3.43Å; L737-I741 WeakPolarHBondContact O-CG2 3.11Å; L737-I741 PolarHBondContact O-N 3.33Å; L737-L945 HydrophobicContact CB-CD1 4.4Å; L737-L945 HydrophobicContact CD2-CB 3.98Å; L737-L945 HydrophobicContact CD2-CD1 4.03Å; L737-L945 HydrophobicContact CG-CD1 4.21Å
738	L	90.4	Very high	83.1	Confident	6 Å²	6	39.3 Å²	39.3	3%	0.031	22%	0.216	C	C	.	.	H	α-helix	trans	-59.4	-46.9	-178.5	-179.9	59.5	0	0	0	112.8	F645 T734 T735 I741 L742 M823 L826 L945	F645-L738 HydrophobicContact CE1-CD2 4.45Å; F645-L738 HydrophobicContact CE2-CD2 4.04Å; F645-L738 HydrophobicContact CZ-CD2 3.82Å; T734-L738 WeakPolarHBondContact O-CB 3.1Å; T734-L738 PolarHBondContact O-N 3.43Å; T735-L738 PolarHBondContact O-N 3.5Å; L738-I741 WeakPolarHBondContact O-CG1 3.49Å; L738-L742 HydrophobicContact CD1-CD1 3.69Å; L738-L742 HydrophobicContact CD1-CG 4.25Å; L738-L742 HydrophobicContact CG-CD1 4.17Å; L738-L742 WeakPolarHBondContact O-CB 3.08Å; L738-L742 VanDerWaalsContact O-CG 3.26Å; L738-L742 WeakPolarHBondContact O-CG 3.24Å; L738-L742 PolarHBondContact O-N 2.92Å; L738-M823 HydrophobicContact CD1-CG 4.35Å; L738-M823 HydrophobicContact CD2-CG 3.75Å; L738-M823 HydrophobicContact CG-CG 4.1Å; L738-L826 HydrophobicContact CD1-CB 3.91Å; L738-L826 HydrophobicContact CD1-CD1 3.4Å; L738-L826 VanDerWaalsContact CD1-CD1 3.4Å; L738-L826 HydrophobicContact CD1-CG 4.3Å; L738-L945 HydrophobicContact CB-CD1 4.42Å; L738-L945 HydrophobicContact CD1-CD2 4.02Å
739	D	88.3	Confident	84.5	Confident	46 Å²	46	37.9 Å²	37.9	25%	0.246	20%	0.204	C	C	.	.	H	α-helix	trans	-64	-43.3	175.3	178	70.8	0	0	0	111.9	T735 I741 L742 K743 R819	T735-D739 PolarHBondContact O-N 3.22Å; D739-I741 PolarHBondContact O-N 3.46Å; D739-L742 PolarHBondContact O-N 3.45Å; D739-K743 PolarHBondContact O-N 3.36Å; D739-K743 WeakPolarHBondContact OD2-CE 3.35Å; D739-K743 IonicContact OD2-NZ 3.84Å; D739-K743 PolarHBondContact OD2-NZ 3.45Å; D739-R819 IonicContact OD1-CZ 3.67Å; D739-R819 IonicContact OD1-NE 3.89Å; D739-R819 IonicContact OD1-NH2 2.72Å; D739-R819 PolarHBondContact OD1-NH2 3.46Å
740	Q	88.1	Confident	85.4	Confident	32 Å²	32	39.6 Å²	39.6	15%	0.15	20%	0.201	C	C	.	.	H	α-helix	trans	-66.5	-39	-175.4	-61.2	-80.9	-9.9	0	0	111.9	G706 L708 M736 L737 K743	G706-Q740 PolarHBondContact O-NE2 3.47Å; L708-Q740 HydrophobicContact CB-CB 3.79Å; L708-Q740 HydrophobicContact CB-CG 4.39Å; L708-Q740 HydrophobicContact CD2-CB 4.22Å; M736-Q740 WeakPolarHBondContact O-CB 3.19Å; M736-Q740 WeakPolarHBondContact O-CG 3.4Å; M736-Q740 PolarHBondContact O-N 3Å; M736-Q740 VanDerWaalsContact O-N 3.17Å; L737-Q740 PolarHBondContact O-N 2.96Å; Q740-K743 VanDerWaalsContact NE2-NZ 3.16Å
741	I	90.1	Very high	85.7	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-74.9	-21.4	177.5	68.3	173.7	0	0	0	113.7	L708 L737 L738 D739 P744 L826 L938 C941 L945	L708-I741 HydrophobicContact CD2-CG2 3.48Å; L708-I741 VanDerWaalsContact CD2-CG2 3.48Å; L737-I741 HydrophobicContact CD1-CG2 3.89Å; L737-I741 WeakPolarHBondContact O-CG1 3.43Å; L737-I741 WeakPolarHBondContact O-CG2 3.11Å; L737-I741 PolarHBondContact O-N 3.33Å; L738-I741 WeakPolarHBondContact O-CG1 3.49Å; D739-I741 PolarHBondContact O-N 3.46Å; I741-P744 WeakPolarHBondContact O-CD 3.43Å; I741-P744 WeakPolarHBondContact O-CG 3.29Å; I741-L826 HydrophobicContact CD1-CD1 4.2Å; I741-L938 HydrophobicContact CB-CB 4.38Å; I741-L938 HydrophobicContact CB-CG 4.32Å; I741-L938 WeakPolarHBondContact O-CD1 3.13Å; I741-C941 HydrophobicContact CG2-CB 3.73Å; I741-L945 HydrophobicContact CD1-CD2 3.86Å
742	L	89.6	Confident	85.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-89.5	-8.1	-178.4	-71.6	178.8	0	0	0	114.6	L738 D739 P744 C745 R819 M822 M823 L826 L938	L738-L742 HydrophobicContact CD1-CD1 3.69Å; L738-L742 HydrophobicContact CD1-CG 4.25Å; L738-L742 HydrophobicContact CG-CD1 4.17Å; L738-L742 WeakPolarHBondContact O-CB 3.08Å; L738-L742 VanDerWaalsContact O-CG 3.26Å; L738-L742 WeakPolarHBondContact O-CG 3.24Å; L738-L742 PolarHBondContact O-N 2.92Å; D739-L742 PolarHBondContact O-N 3.45Å; L742-P744 VanDerWaalsContact C-CD 3.42Å; L742-C745 WeakPolarHBondContact O-CB 3.46Å; L742-C745 PolarHBondContact O-N 3.05Å; L742-R819 HydrophobicContact CB-CG 4.2Å; L742-R819 HydrophobicContact CD1-CG 4.43Å; L742-M822 HydrophobicContact CD2-CB 3.58Å; L742-M823 HydrophobicContact CD1-CB 3.69Å; L742-M823 HydrophobicContact CD1-CG 4.05Å; L742-L826 HydrophobicContact CD1-CD1 4.31Å; L742-L826 HydrophobicContact CD2-CD1 3.86Å; L742-L826 HydrophobicContact CG-CD1 4.23Å; L742-L938 HydrophobicContact CD2-CD1 4.39Å
743	K	84.6	Confident	85.7	Confident	61 Å²	61	40 Å²	40	27%	0.265	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-50	-38.8	172	-74.5	166.9	-166.7	176.9	0	116.2	D739 Q740 C745	D739-K743 PolarHBondContact O-N 3.36Å; D739-K743 WeakPolarHBondContact OD2-CE 3.35Å; D739-K743 IonicContact OD2-NZ 3.84Å; D739-K743 PolarHBondContact OD2-NZ 3.45Å; Q740-K743 VanDerWaalsContact NE2-NZ 3.16Å; K743-C745 VanDerWaalsContact C-N 3.33Å; K743-C745 PolarHBondContact O-N 3.31Å
744	P	82.1	Confident	85.4	Confident	1 Å²	1	41.4 Å²	41.4	1%	0.006	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-64.2	-33	173.8	25.8	-38	0	0	0	113.6	Y670 I741 L742 K746 F747 L938	Y670-P744 WeakPolarHBondContact OH-CD 3.36Å; I741-P744 WeakPolarHBondContact O-CD 3.43Å; I741-P744 WeakPolarHBondContact O-CG 3.29Å; L742-P744 VanDerWaalsContact C-CD 3.42Å; P744-K746 PolarHBondContact O-N 2.97Å; P744-F747 PolarHBondContact O-N 2.86Å; P744-L938 HydrophobicContact CG-CD1 4.24Å
745	C	81	Confident	85.3	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-64.7	-15.1	-171.3	-60.4	0	0	0	0	114.3	L742 K743 F747 Q818 L938	L742-C745 WeakPolarHBondContact O-CB 3.46Å; L742-C745 PolarHBondContact O-N 3.05Å; K743-C745 VanDerWaalsContact C-N 3.33Å; K743-C745 PolarHBondContact O-N 3.31Å; C745-F747 PolarHBondContact O-N 3.08Å; C745-Q818 VanDerWaalsContact O-CB 3.32Å; C745-Q818 WeakPolarHBondContact O-CB 3.23Å; C745-Q818 PolarHBondContact O-OE1 2.99Å; C745-L938 WeakPolarHBondContact SG-CD1 3.22Å
746	K	80	Confident	85.1	Confident	90 Å²	90	42.6 Å²	42.6	39%	0.391	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-73.5	-7.9	174.4	-55.4	-153.9	172.8	-164.2	0	114.3	P744 S816 R819	P744-K746 PolarHBondContact O-N 2.97Å; K746-S816 WeakPolarHBondContact CD-OG 3.45Å; K746-S816 VanDerWaalsContact CE-OG 3.25Å; K746-S816 WeakPolarHBondContact CE-OG 3.33Å; K746-S816 WeakPolarHBondContact CG-OG 3.44Å; K746-R819 HydrophobicContact CG-CB 4.48Å
747	F	80.4	Confident	85	Confident	119 Å²	119	41.2 Å²	41.2	52%	0.522	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-133.3	21.5	-166.7	-55.6	-93.2	0	0	0	113	P744 C745 H931	P744-F747 PolarHBondContact O-N 2.86Å; C745-F747 PolarHBondContact O-N 3.08Å; F747-H931 HydrophobicContact CB-CB 4.18Å; F747-H931 WeakPolarHBondContact CB-ND1 3.4Å; F747-H931 AromaticContact CD1-CE1 3.52Å; F747-H931 AromaticContact CD1-NE2 3.84Å; F747-H931 AromaticContact CD2-CE1 3.24Å; F747-H931 WeakPolarHBondContact CD2-CE1 3.42Å; F747-H931 AromaticContact CD2-ND1 3.16Å; F747-H931 WeakPolarHBondContact CD2-ND1 3.41Å; F747-H931 AromaticContact CE1-CE1 3.84Å; F747-H931 AromaticContact CE2-CE1 3.58Å; F747-H931 AromaticContact CE2-ND1 3.85Å; F747-H931 AromaticContact CG-CE1 3.2Å; F747-H931 WeakPolarHBondContact CG-CE1 3.34Å; F747-H931 AromaticContact CG-CG 3.91Å; F747-H931 AromaticContact CG-ND1 3.3Å; F747-H931 VanDerWaalsContact CG-ND1 3.3Å; F747-H931 WeakPolarHBondContact CG-ND1 3.28Å; F747-H931 AromaticContact CG-NE2 3.8Å; F747-H931 AromaticContact CZ-CE1 3.86Å
748	L	83.9	Confident	84.8	Confident	8 Å²	8	41.7 Å²	41.7	4%	0.042	21%	0.211	C	C	.	.			trans	-109	138.3	177.5	-56.5	176.5	0	0	0	109.6	Q818 F841 V842 T845 W929	L748-Q818 PolarHBondContact O-NE2 3.04Å; L748-Q818 PolarHBondContact O-OE1 3.13Å; L748-F841 HydrophobicContact CB-CB 3.91Å; L748-F841 HydrophobicContact CB-CD2 4.45Å; L748-F841 HydrophobicContact CD1-CB 4Å; L748-F841 HydrophobicContact CD1-CD2 4.49Å; L748-V842 HydrophobicContact CD1-CG2 4.33Å; L748-V842 HydrophobicContact CD2-CG2 4.29Å; L748-T845 WeakPolarHBondContact CA-OG1 3.34Å; L748-W929 HydrophobicContact CD2-CZ2 4.04Å
749	T	84.9	Confident	84.5	Confident	54 Å²	54	41.4 Å²	41.4	33%	0.331	21%	0.209	S	C	.	.			trans	-70.3	141.9	171.3	-43.4	0	0	0	0	110	F841 L844 T845 V848	T749-F841 WeakPolarHBondContact O-CA 3.49Å; T749-L844 HydrophobicContact CG2-CD2 3.88Å; T749-L844 HydrophobicContact CG2-CG 4.04Å; T749-T845 PolarHBondContact N-OG1 3.47Å; T749-V848 HydrophobicContact CG2-CG2 4.47Å
750	Y	84.8	Confident	84.3	Confident	70 Å²	70	41.6 Å²	41.6	28%	0.275	21%	0.209	S	C	.	.			trans	-144.1	153.1	177.1	72	-76.9	0	0	0	111.5	Y752 V755 F817 Q818 F841	Y750-Y752 HydrophobicContact CE2-CD2 4.3Å; Y750-V755 HydrophobicContact CD2-CG2 4.03Å; Y750-F817 HydrophobicContact CD2-CE1 4.35Å; Y750-F817 HydrophobicContact CE1-CD1 4.43Å; Y750-F817 AromaticContact CE2-CD1 3.65Å; Y750-F817 HydrophobicContact CE2-CD1 3.65Å; Y750-F817 AromaticContact CE2-CE1 3.61Å; Y750-F817 HydrophobicContact CE2-CE1 3.61Å; Y750-F817 AromaticContact CZ-CD1 3.59Å; Y750-F817 WeakPolarHBondContact OH-CD1 3.43Å; Y750-Q818 HydrophobicContact CD1-CG 3.71Å; Y750-Q818 VanDerWaalsContact CD1-NE2 3.28Å; Y750-Q818 HydrophobicContact CE1-CG 3.83Å; Y750-Q818 HydrophobicContact CG-CG 4.18Å; Y750-F841 VanDerWaalsContact CB-CE1 3.48Å; Y750-F841 HydrophobicContact CG-CZ 4.37Å
751	I	83.1	Confident	84.1	Confident	66 Å²	66	46.5 Å²	46.5	34%	0.338	23%	0.232	S	C	.	.			trans	-102.6	113.3	171.3	-65.9	162.8	0	0	0	108	A753 T754 V755 L844	I751-A753 VanDerWaalsContact C-N 3.29Å; I751-A753 HydrophobicContact CG2-CB 4.22Å; I751-A753 PolarHBondContact O-N 3.07Å; I751-T754 WeakPolarHBondContact CG2-OG1 3.37Å; I751-T754 PolarHBondContact O-N 2.72Å; I751-T754 VanDerWaalsContact O-N 3.17Å; I751-V755 WeakPolarHBondContact O-CG2 3.43Å; I751-V755 PolarHBondContact O-N 3.24Å; I751-V755 VanDerWaalsContact O-N 3.1Å; I751-L844 HydrophobicContact CD1-CD1 4.4Å; I751-L844 HydrophobicContact CD1-CD2 4.01Å; I751-L844 HydrophobicContact CG1-CD2 3.73Å
752	Y	84.5	Confident	83.7	Confident	40 Å²	40	48.5 Å²	48.5	16%	0.157	24%	0.243	C	C	.	.	H	α-helix	trans	-57.5	-38.8	-176.8	-178.8	-98.8	0	0	0	113.2	Y750 T754 V755 R756 L799 E800 K803 F817	Y750-Y752 HydrophobicContact CE2-CD2 4.3Å; Y752-T754 PolarHBondContact O-N 2.72Å; Y752-V755 PolarHBondContact O-N 3.37Å; Y752-R756 WeakPolarHBondContact O-CB 3.48Å; Y752-R756 PolarHBondContact O-N 3.05Å; Y752-L799 HydrophobicContact CE2-CD2 4.39Å; Y752-L799 HydrophobicContact CE2-CG 4.17Å; Y752-L799 PolarHBondContact OH-O 2.69Å; Y752-E800 WeakPolarHBondContact OH-CA 3.45Å; Y752-E800 WeakPolarHBondContact OH-CG 3.16Å; Y752-E800 PolarHBondContact OH-N 3.05Å; Y752-K803 HydrophobicContact CD1-CD 4.42Å; Y752-K803 HydrophobicContact CD2-CD 3.92Å; Y752-K803 HydrophobicContact CD2-CG 4.42Å; Y752-K803 HydrophobicContact CE1-CD 4.18Å; Y752-K803 HydrophobicContact CE2-CB 4.1Å; Y752-K803 HydrophobicContact CE2-CD 3.67Å; Y752-K803 HydrophobicContact CE2-CG 4.11Å; Y752-K803 HydrophobicContact CG-CD 4.3Å; Y752-F817 HydrophobicContact CD2-CE1 4.16Å; Y752-F817 AromaticContact CD2-CZ 3.88Å; Y752-F817 HydrophobicContact CD2-CZ 3.88Å; Y752-F817 HydrophobicContact CE2-CE1 4.35Å; Y752-F817 HydrophobicContact CE2-CE2 4.1Å; Y752-F817 AromaticContact CE2-CZ 3.61Å; Y752-F817 HydrophobicContact CE2-CZ 3.61Å
753	A	81.5	Confident	83.4	Confident	61 Å²	61	48.9 Å²	48.9	50%	0.504	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-44.2	177.7	0	0	0	0	0	112.3	I751 R756 T757	I751-A753 VanDerWaalsContact C-N 3.29Å; I751-A753 HydrophobicContact CG2-CB 4.22Å; I751-A753 PolarHBondContact O-N 3.07Å; A753-R756 PolarHBondContact O-N 2.75Å; A753-T757 PolarHBondContact O-N 2.73Å; A753-T757 PolarHBondContact O-OG1 3.39Å; A753-T757 VanDerWaalsContact O-OG1 3.13Å
754	T	83.1	Confident	83.1	Confident	60 Å²	60	47.9 Å²	47.9	37%	0.368	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-43.6	176.1	-47	0	0	0	0	111.2	I751 Y752 R756 T757 V758	I751-T754 WeakPolarHBondContact CG2-OG1 3.37Å; I751-T754 PolarHBondContact O-N 2.72Å; I751-T754 VanDerWaalsContact O-N 3.17Å; Y752-T754 PolarHBondContact O-N 2.72Å; T754-R756 VanDerWaalsContact C-N 3.35Å; T754-R756 PolarHBondContact O-N 2.88Å; T754-T757 PolarHBondContact O-N 2.84Å; T754-V758 HydrophobicContact CG2-CG2 4.39Å; T754-V758 WeakPolarHBondContact O-CB 3.01Å; T754-V758 VanDerWaalsContact O-CG2 3.27Å; T754-V758 WeakPolarHBondContact O-CG2 3.48Å; T754-V758 PolarHBondContact O-N 3.33Å
755	V	86.6	Confident	83.3	Confident	1 Å²	1	49 Å²	49	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-45.4	175.6	176	0	0	0	0	111.2	Y750 I751 Y752 V758 L759 L799 F817 L821 L837 F841	Y750-V755 HydrophobicContact CD2-CG2 4.03Å; I751-V755 WeakPolarHBondContact O-CG2 3.43Å; I751-V755 PolarHBondContact O-N 3.24Å; I751-V755 VanDerWaalsContact O-N 3.1Å; Y752-V755 PolarHBondContact O-N 3.37Å; V755-V758 PolarHBondContact O-N 3.42Å; V755-L759 HydrophobicContact CG1-CD1 3.96Å; V755-L759 VanDerWaalsContact O-CD1 3.29Å; V755-L759 WeakPolarHBondContact O-CD1 3.1Å; V755-L759 PolarHBondContact O-N 3.27Å; V755-L799 HydrophobicContact CG1-CD2 4.33Å; V755-F817 HydrophobicContact CG1-CE1 4.49Å; V755-L821 HydrophobicContact CG1-CD2 3.6Å; V755-L837 HydrophobicContact CG2-CD2 4.42Å; V755-F841 HydrophobicContact CG2-CE1 3.48Å; V755-F841 VanDerWaalsContact CG2-CE1 3.48Å; V755-F841 HydrophobicContact CG2-CZ 3.58Å
756	R	84.7	Confident	83.6	Confident	80 Å²	80	50.4 Å²	50.4	30%	0.302	27%	0.265	S	S	.	.	H	α-helix	trans	-58.5	-54.9	177.4	-171.1	-172.8	-168.5	-89.3	9	111.1	Y752 A753 T754 V758 L759 M760 A796 L799 E800	Y752-R756 WeakPolarHBondContact O-CB 3.48Å; Y752-R756 PolarHBondContact O-N 3.05Å; A753-R756 PolarHBondContact O-N 2.75Å; T754-R756 VanDerWaalsContact C-N 3.35Å; T754-R756 PolarHBondContact O-N 2.88Å; R756-V758 PolarHBondContact O-N 3.12Å; R756-L759 PolarHBondContact O-N 3.25Å; R756-M760 HydrophobicContact CG-SD 4.08Å; R756-M760 PolarHBondContact NH1-SD 2.92Å; R756-M760 VanDerWaalsContact O-CG 3.25Å; R756-M760 WeakPolarHBondContact O-CG 3.29Å; R756-M760 PolarHBondContact O-N 3.32Å; R756-A796 HydrophobicContact CG-CB 4.24Å; R756-L799 HydrophobicContact CB-CD2 4.08Å; R756-L799 HydrophobicContact CG-CD2 4.33Å; R756-E800 IonicContact CZ-OE1 2.75Å; R756-E800 IonicContact NE-OE1 2.67Å; R756-E800 PolarHBondContact NE-OE1 2.94Å; R756-E800 IonicContact NH2-OE1 2.68Å; R756-E800 PolarHBondContact NH2-OE1 3.25Å
757	T	84.1	Confident	83.9	Confident	68 Å²	68	49.4 Å²	49.4	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-58	-48.1	179.4	-55.3	0	0	0	0	111.9	A753 T754 L759 M760 E761	A753-T757 PolarHBondContact O-N 2.73Å; A753-T757 PolarHBondContact O-OG1 3.39Å; A753-T757 VanDerWaalsContact O-OG1 3.13Å; T754-T757 PolarHBondContact O-N 2.84Å; T757-L759 VanDerWaalsContact C-N 3.32Å; T757-L759 PolarHBondContact O-N 3.48Å; T757-M760 PolarHBondContact O-N 2.82Å; T757-E761 HydrophobicContact CG2-CG 4.49Å; T757-E761 WeakPolarHBondContact O-CG 3.42Å; T757-E761 PolarHBondContact O-N 3.4Å
758	V	84.1	Confident	84.2	Confident	11 Å²	11	44.5 Å²	44.5	7%	0.067	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-34.5	-178.4	176.5	0	0	0	0	111.6	T754 V755 R756 N762 L833 K836 L837	T754-V758 HydrophobicContact CG2-CG2 4.39Å; T754-V758 WeakPolarHBondContact O-CB 3.01Å; T754-V758 VanDerWaalsContact O-CG2 3.27Å; T754-V758 WeakPolarHBondContact O-CG2 3.48Å; T754-V758 PolarHBondContact O-N 3.33Å; V755-V758 PolarHBondContact O-N 3.42Å; R756-V758 PolarHBondContact O-N 3.12Å; V758-N762 WeakPolarHBondContact O-CB 3.26Å; V758-N762 PolarHBondContact O-N 3.26Å; V758-N762 PolarHBondContact O-ND2 3.06Å; V758-L833 HydrophobicContact CG1-CD1 3.53Å; V758-K836 HydrophobicContact CG1-CD 4.46Å; V758-L837 HydrophobicContact CB-CD2 4.42Å; V758-L837 HydrophobicContact CG1-CD2 4.19Å
759	L	85.8	Confident	84.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.3	-44.7	171.9	-97	79.6	0	0	0	112.4	V755 R756 T757 E761 N762 V763 F769 V795 L799 L821 L825 L837	V755-L759 HydrophobicContact CG1-CD1 3.96Å; V755-L759 VanDerWaalsContact O-CD1 3.29Å; V755-L759 WeakPolarHBondContact O-CD1 3.1Å; V755-L759 PolarHBondContact O-N 3.27Å; R756-L759 PolarHBondContact O-N 3.25Å; T757-L759 VanDerWaalsContact C-N 3.32Å; T757-L759 PolarHBondContact O-N 3.48Å; L759-E761 PolarHBondContact O-N 2.84Å; L759-N762 PolarHBondContact O-N 3.45Å; L759-N762 VanDerWaalsContact O-N 3.12Å; L759-V763 HydrophobicContact CB-CG2 4.29Å; L759-V763 HydrophobicContact CD2-CG2 4.37Å; L759-V763 HydrophobicContact CG-CG2 3.97Å; L759-V763 WeakPolarHBondContact O-CB 3.25Å; L759-V763 PolarHBondContact O-N 2.93Å; L759-F769 HydrophobicContact CD2-CE1 3.98Å; L759-F769 HydrophobicContact CD2-CE2 3.84Å; L759-F769 HydrophobicContact CD2-CZ 3.44Å; L759-F769 VanDerWaalsContact CD2-CZ 3.44Å; L759-V795 HydrophobicContact CB-CG1 4.28Å; L759-L799 HydrophobicContact CB-CD2 4.49Å; L759-L799 HydrophobicContact CD2-CD1 4.01Å; L759-L799 HydrophobicContact CD2-CD2 4.26Å; L759-L821 HydrophobicContact CD1-CD1 4.25Å; L759-L821 HydrophobicContact CD2-CD1 3.68Å; L759-L825 HydrophobicContact CD1-CD1 4.36Å; L759-L837 HydrophobicContact CD1-CD1 3.99Å
760	M	84.1	Confident	84.6	Confident	49 Å²	49	41.5 Å²	41.5	24%	0.241	22%	0.223	C	C	.	.	H	α-helix	trans	-57.1	-34.7	176.8	-69	177	74.9	0	0	112.4	R756 T757 P792 E793 A796	R756-M760 HydrophobicContact CG-SD 4.08Å; R756-M760 PolarHBondContact NH1-SD 2.92Å; R756-M760 VanDerWaalsContact O-CG 3.25Å; R756-M760 WeakPolarHBondContact O-CG 3.29Å; R756-M760 PolarHBondContact O-N 3.32Å; T757-M760 PolarHBondContact O-N 2.82Å; M760-P792 HydrophobicContact CB-CB 4Å; M760-P792 HydrophobicContact CE-CB 4.17Å; M760-P792 HydrophobicContact CG-CB 4.4Å; M760-P792 WeakPolarHBondContact CG-O 3.49Å; M760-P792 WeakPolarHBondContact O-CB 3.13Å; M760-E793 HydrophobicContact CE-CG 4.22Å; M760-A796 HydrophobicContact CG-CB 4.16Å; M760-A796 HydrophobicContact SD-CB 4.03Å
761	E	82.7	Confident	84.7	Confident	135 Å²	135	41.7 Å²	41.7	63%	0.631	23%	0.228	S	C	*	.	H	α-helix	trans	-79.7	-22.4	178.5	-71.3	171.5	169.9	0	0	114.3	T757 L759	T757-E761 HydrophobicContact CG2-CG 4.49Å; T757-E761 WeakPolarHBondContact O-CG 3.42Å; T757-E761 PolarHBondContact O-N 3.4Å; L759-E761 PolarHBondContact O-N 2.84Å
762	N	81	Confident	84.9	Confident	45 Å²	45	39.2 Å²	39.2	24%	0.241	22%	0.218	C	C	.	.	H	α-helix	trans	-123.8	-10.3	-166	-67.4	-104.2	0	0	0	114.8	V758 L759 L833	V758-N762 WeakPolarHBondContact O-CB 3.26Å; V758-N762 PolarHBondContact O-N 3.26Å; V758-N762 PolarHBondContact O-ND2 3.06Å; L759-N762 PolarHBondContact O-N 3.45Å; L759-N762 VanDerWaalsContact O-N 3.12Å; N762-L833 HydrophobicContact CB-CD1 4.27Å; N762-L833 HydrophobicContact CB-CD2 4.08Å
763	V	84.4	Confident	85	Confident	8 Å²	8	38.9 Å²	38.9	5%	0.048	22%	0.219	C	C	.	.			trans	-107.1	102.4	-179.3	179.6	0	0	0	0	110.1	L759 S765 F769 V795 L825 M828 L833	L759-V763 HydrophobicContact CB-CG2 4.29Å; L759-V763 HydrophobicContact CD2-CG2 4.37Å; L759-V763 HydrophobicContact CG-CG2 3.97Å; L759-V763 WeakPolarHBondContact O-CB 3.25Å; L759-V763 PolarHBondContact O-N 2.93Å; V763-S765 VanDerWaalsContact C-N 3.3Å; V763-S765 PolarHBondContact O-N 3.04Å; V763-F769 HydrophobicContact CG1-CB 4.08Å; V763-F769 HydrophobicContact CG1-CG 4.44Å; V763-V795 HydrophobicContact CB-CG1 4.09Å; V763-V795 HydrophobicContact CB-CG2 4.28Å; V763-V795 HydrophobicContact CG1-CG1 4.21Å; V763-V795 HydrophobicContact CG1-CG2 3.95Å; V763-L825 HydrophobicContact CG2-CD2 4.17Å; V763-M828 HydrophobicContact CG1-CE 4.12Å; V763-L833 HydrophobicContact CG2-CD2 4.09Å
764	G	78.3	Confident	85.1	Confident	39 Å²	39	38.9 Å²	38.9	40%	0.402	23%	0.225	S	C	.	.			trans	-80.5	9.3	-175	0	0	0	0	0	117
765	S	85.9	Confident	85.2	Confident	25 Å²	25	37.2 Å²	37.2	18%	0.175	21%	0.212	C	C	.	.			trans	-157.7	120.9	174.4	-178.1	0	0	0	0	111.3	V763 R767	V763-S765 VanDerWaalsContact C-N 3.3Å; V763-S765 PolarHBondContact O-N 3.04Å; S765-R767 VanDerWaalsContact C-N 3.28Å; S765-R767 PolarHBondContact O-N 3.06Å; S765-R767 PolarHBondContact OG-N 3.44Å
766	W	87.4	Confident	84.6	Confident	30 Å²	30	38.9 Å²	38.9	11%	0.114	23%	0.229	C	C	.	.	H	α-helix	trans	-65.7	-33.2	172.9	75.3	-88.4	0	0	0	112.2	F769 A770 L780 F783 E791 R794 V795 V798	W766-F769 PolarHBondContact O-N 3.07Å; W766-A770 HydrophobicContact CE3-CB 4.23Å; W766-A770 HydrophobicContact CZ3-CB 4.45Å; W766-A770 WeakPolarHBondContact O-CB 3.32Å; W766-A770 PolarHBondContact O-N 3Å; W766-L780 HydrophobicContact CD2-CD1 4.16Å; W766-L780 HydrophobicContact CE3-CD1 4.14Å; W766-L780 HydrophobicContact CH2-CB 3.83Å; W766-L780 HydrophobicContact CH2-CD1 4Å; W766-L780 HydrophobicContact CH2-CG 4.46Å; W766-L780 HydrophobicContact CZ2-CB 4.04Å; W766-L780 HydrophobicContact CZ2-CD1 4.04Å; W766-L780 HydrophobicContact CZ2-CG 4.42Å; W766-L780 HydrophobicContact CZ3-CD1 4.06Å; W766-F783 HydrophobicContact CZ3-CD2 4.26Å; W766-F783 HydrophobicContact CZ3-CE2 4.11Å; W766-E791 VanDerWaalsContact CD1-OE2 3.28Å; W766-E791 PolarHBondContact N-OE2 3.37Å; W766-E791 PolarHBondContact NE1-OE1 3.39Å; W766-R794 HydrophobicContact CB-CB 3.68Å; W766-R794 VanDerWaalsContact CD1-CD 3.42Å; W766-R794 HydrophobicContact CD2-CB 4.37Å; W766-R794 HydrophobicContact CG-CB 3.62Å; W766-V795 HydrophobicContact CB-CG2 3.92Å; W766-V798 HydrophobicContact CE3-CG2 4.07Å
767	R	87.3	Confident	84.1	Confident	68 Å²	68	42.8 Å²	42.8	26%	0.257	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-51.3	-176	-170.4	71.3	-127.4	172.5	-2	111.2	S765 F769 A770 D771 Y775 G776 L778	S765-R767 VanDerWaalsContact C-N 3.28Å; S765-R767 PolarHBondContact O-N 3.06Å; S765-R767 PolarHBondContact OG-N 3.44Å; R767-F769 PolarHBondContact O-N 3.31Å; R767-A770 PolarHBondContact O-N 3.24Å; R767-D771 IonicContact CZ-OD1 2.61Å; R767-D771 VanDerWaalsContact CZ-OD1 3.28Å; R767-D771 IonicContact NE-OD1 2.7Å; R767-D771 PolarHBondContact NE-OD1 3.15Å; R767-D771 IonicContact NE-OD2 2.72Å; R767-D771 IonicContact NH2-OD1 2.72Å; R767-D771 PolarHBondContact NH2-OD1 2.7Å; R767-D771 WeakPolarHBondContact O-CB 3.48Å; R767-D771 PolarHBondContact O-N 3.15Å; R767-Y775 PolarHBondContact NH2-O 2.73Å; R767-G776 PolarHBondContact NH2-O 2.98Å; R767-L778 PolarHBondContact NH1-O 3.2Å
768	A	85.7	Confident	84.1	Confident	16 Å²	16	42.1 Å²	42.1	13%	0.132	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-32.7	179.1	0	0	0	0	0	112.5	H642 A772 M828	H642-A768 WeakPolarHBondContact CD2-CB 3.33Å; A768-A772 VanDerWaalsContact O-CB 3.22Å; A768-A772 WeakPolarHBondContact O-CB 3.26Å; A768-A772 PolarHBondContact O-N 3.28Å; A768-M828 HydrophobicContact CB-CE 3.87Å
769	F	88.7	Confident	84	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-69.9	-45.3	174.4	-176	-122.6	0	0	0	112.4	L759 V763 W766 R767 A772 L773 V795 V798 L799 L821 A824 L825 M828	L759-F769 HydrophobicContact CD2-CE1 3.98Å; L759-F769 HydrophobicContact CD2-CE2 3.84Å; L759-F769 HydrophobicContact CD2-CZ 3.44Å; L759-F769 VanDerWaalsContact CD2-CZ 3.44Å; V763-F769 HydrophobicContact CG1-CB 4.08Å; V763-F769 HydrophobicContact CG1-CG 4.44Å; W766-F769 PolarHBondContact O-N 3.07Å; R767-F769 PolarHBondContact O-N 3.31Å; F769-A772 PolarHBondContact O-N 2.89Å; F769-L773 HydrophobicContact CD1-CD1 4.17Å; F769-L773 HydrophobicContact CD2-CD1 4.41Å; F769-L773 HydrophobicContact CE1-CD1 3.84Å; F769-L773 HydrophobicContact CE2-CD1 4.09Å; F769-L773 HydrophobicContact CE2-CG 4.47Å; F769-L773 HydrophobicContact CG-CD1 4.44Å; F769-L773 HydrophobicContact CZ-CD1 3.79Å; F769-L773 WeakPolarHBondContact O-CG 3.45Å; F769-L773 PolarHBondContact O-N 2.99Å; F769-L773 VanDerWaalsContact O-N 3.09Å; F769-V795 HydrophobicContact CD1-CG1 4.37Å; F769-V798 HydrophobicContact CD1-CB 4.06Å; F769-V798 HydrophobicContact CD1-CG1 3.64Å; F769-V798 HydrophobicContact CE1-CB 4.28Å; F769-V798 HydrophobicContact CE1-CG1 3.86Å; F769-L799 HydrophobicContact CE1-CB 4.36Å; F769-L799 HydrophobicContact CE1-CD1 4.43Å; F769-L799 HydrophobicContact CZ-CD1 4.12Å; F769-L821 HydrophobicContact CE2-CD1 4.02Å; F769-L821 HydrophobicContact CZ-CD1 3.83Å; F769-A824 HydrophobicContact CD2-CB 4.4Å; F769-A824 HydrophobicContact CE2-CB 4.25Å; F769-L825 HydrophobicContact CD2-CD2 4.27Å; F769-L825 HydrophobicContact CE2-CD2 4.08Å; F769-L825 HydrophobicContact CE2-CG 4.47Å; F769-M828 VanDerWaalsContact CA-SD 3.55Å; F769-M828 HydrophobicContact CB-CE 4.16Å; F769-M828 HydrophobicContact CB-SD 3.99Å; F769-M828 HydrophobicContact CD2-SD 3.91Å; F769-M828 HydrophobicContact CG-SD 4.46Å
770	A	88.3	Confident	83.7	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.7	-45.5	174.4	0	0	0	0	0	111.9	W766 R767 A772 L773 G774 Y775 F783 V798	W766-A770 HydrophobicContact CE3-CB 4.23Å; W766-A770 HydrophobicContact CZ3-CB 4.45Å; W766-A770 WeakPolarHBondContact O-CB 3.32Å; W766-A770 PolarHBondContact O-N 3Å; R767-A770 PolarHBondContact O-N 3.24Å; A770-A772 PolarHBondContact O-N 3.45Å; A770-L773 PolarHBondContact O-N 2.87Å; A770-G774 PolarHBondContact O-N 3.31Å; A770-G774 VanDerWaalsContact O-N 3.15Å; A770-Y775 HydrophobicContact CB-CD2 4.45Å; A770-Y775 WeakPolarHBondContact O-CB 3.44Å; A770-Y775 PolarHBondContact O-N 3.18Å; A770-F783 HydrophobicContact CB-CZ 4.17Å; A770-V798 HydrophobicContact CB-CG1 4.13Å; A770-V798 HydrophobicContact CB-CG2 4.22Å
771	D	86.9	Confident	83.5	Confident	73 Å²	73	50.7 Å²	50.7	39%	0.39	30%	0.3	S	S	.	.	H	α-helix	trans	-61.3	-42.3	176.9	-64.6	-8.6	0	0	0	111.4	R767 L773 G774 G776	R767-D771 IonicContact CZ-OD1 2.61Å; R767-D771 VanDerWaalsContact CZ-OD1 3.28Å; R767-D771 IonicContact NE-OD1 2.7Å; R767-D771 PolarHBondContact NE-OD1 3.15Å; R767-D771 IonicContact NE-OD2 2.72Å; R767-D771 IonicContact NH2-OD1 2.72Å; R767-D771 PolarHBondContact NH2-OD1 2.7Å; R767-D771 WeakPolarHBondContact O-CB 3.48Å; R767-D771 PolarHBondContact O-N 3.15Å; D771-L773 PolarHBondContact O-N 2.93Å; D771-G774 PolarHBondContact O-N 2.72Å; D771-G776 WeakPolarHBondContact OD1-CA 3.2Å
772	A	86.8	Confident	83.4	Confident	15 Å²	15	49.4 Å²	49.4	12%	0.124	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-29.9	179.6	0	0	0	0	0	114	A768 F769 A770 G774 A824 K827 M828	A768-A772 VanDerWaalsContact O-CB 3.22Å; A768-A772 WeakPolarHBondContact O-CB 3.26Å; A768-A772 PolarHBondContact O-N 3.28Å; F769-A772 PolarHBondContact O-N 2.89Å; A770-A772 PolarHBondContact O-N 3.45Å; A772-G774 VanDerWaalsContact C-N 3.29Å; A772-A824 HydrophobicContact CB-CB 3.91Å; A772-K827 HydrophobicContact CB-CB 4.29Å; A772-K827 WeakPolarHBondContact O-CD 3.45Å; A772-K827 PolarHBondContact O-NZ 2.61Å; A772-K827 VanDerWaalsContact O-NZ 3.15Å; A772-M828 HydrophobicContact CB-CG 3.76Å; A772-M828 HydrophobicContact CB-SD 4.15Å
773	L	86.8	Confident	83.5	Confident	33 Å²	33	48.1 Å²	48.1	17%	0.173	28%	0.282	C	S	.	.	H	α-helix	trans	-73.9	-18.4	169.7	-72	167.4	0	0	0	113	F769 A770 D771 Y775 V798 L802 E820 A824	F769-L773 HydrophobicContact CD1-CD1 4.17Å; F769-L773 HydrophobicContact CD2-CD1 4.41Å; F769-L773 HydrophobicContact CE1-CD1 3.84Å; F769-L773 HydrophobicContact CE2-CD1 4.09Å; F769-L773 HydrophobicContact CE2-CG 4.47Å; F769-L773 HydrophobicContact CG-CD1 4.44Å; F769-L773 HydrophobicContact CZ-CD1 3.79Å; F769-L773 WeakPolarHBondContact O-CG 3.45Å; F769-L773 PolarHBondContact O-N 2.99Å; F769-L773 VanDerWaalsContact O-N 3.09Å; A770-L773 PolarHBondContact O-N 2.87Å; D771-L773 PolarHBondContact O-N 2.93Å; L773-Y775 HydrophobicContact CB-CD2 3.74Å; L773-Y775 HydrophobicContact CB-CE2 3.69Å; L773-Y775 HydrophobicContact CD1-CD2 4.38Å; L773-Y775 HydrophobicContact CD1-CE2 3.96Å; L773-Y775 HydrophobicContact CG-CE2 4.44Å; L773-V798 HydrophobicContact CD1-CG1 3.78Å; L773-L802 HydrophobicContact CD1-CD2 3.99Å; L773-L802 HydrophobicContact CD2-CD1 3.93Å; L773-L802 HydrophobicContact CD2-CD2 3.59Å; L773-L802 HydrophobicContact CD2-CG 4.37Å; L773-L802 HydrophobicContact CG-CD2 4.48Å; L773-E820 HydrophobicContact CD2-CB 4.5Å; L773-A824 HydrophobicContact CD2-CB 3.53Å; L773-A824 HydrophobicContact CG-CB 3.63Å
774	G	84.1	Confident	83.1	Confident	61 Å²	61	49.3 Å²	49.3	63%	0.629	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.2	1.1	177.6	0	0	0	0	0	115	A770 D771 A772 G776	A770-G774 PolarHBondContact O-N 3.31Å; A770-G774 VanDerWaalsContact O-N 3.15Å; D771-G774 PolarHBondContact O-N 2.72Å; A772-G774 VanDerWaalsContact C-N 3.29Å; G774-G776 PolarHBondContact O-N 3.46Å
775	Y	85.1	Confident	82.5	Confident	25 Å²	25	59.9 Å²	59.9	10%	0.098	32%	0.318	C	S	.	.			trans	-80.5	29.4	179.3	-52.1	-67.1	0	0	0	113.6	R767 A770 L773 N777 L778 F783 V798 E805	R767-Y775 PolarHBondContact NH2-O 2.73Å; A770-Y775 HydrophobicContact CB-CD2 4.45Å; A770-Y775 WeakPolarHBondContact O-CB 3.44Å; A770-Y775 PolarHBondContact O-N 3.18Å; L773-Y775 HydrophobicContact CB-CD2 3.74Å; L773-Y775 HydrophobicContact CB-CE2 3.69Å; L773-Y775 HydrophobicContact CD1-CD2 4.38Å; L773-Y775 HydrophobicContact CD1-CE2 3.96Å; L773-Y775 HydrophobicContact CG-CE2 4.44Å; Y775-N777 PolarHBondContact O-N 3.08Å; Y775-L778 HydrophobicContact CD1-CD1 3.81Å; Y775-L778 HydrophobicContact CG-CD1 4.37Å; Y775-L778 PolarHBondContact O-N 2.78Å; Y775-F783 HydrophobicContact CD1-CE1 4.46Å; Y775-F783 HydrophobicContact CD1-CZ 4.46Å; Y775-F783 AromaticContact CD2-CE1 3.85Å; Y775-F783 HydrophobicContact CD2-CE1 3.85Å; Y775-F783 AromaticContact CD2-CZ 3.98Å; Y775-F783 HydrophobicContact CD2-CZ 3.98Å; Y775-F783 HydrophobicContact CE2-CE1 4.18Å; Y775-F783 HydrophobicContact CG-CE1 4.01Å; Y775-F783 AromaticContact CG-CZ 3.83Å; Y775-F783 HydrophobicContact CG-CZ 3.83Å; Y775-V798 HydrophobicContact CD2-CG1 4.5Å; Y775-E805 VanDerWaalsContact CE1-OE2 3.3Å; Y775-E805 WeakPolarHBondContact CE1-OE2 3.46Å; Y775-E805 VanDerWaalsContact OH-CD 3.28Å; Y775-E805 PolarHBondContact OH-OE2 3.28Å
776	G	74.4	Confident	81.6	Confident	35 Å²	35	63.5 Å²	63.5	36%	0.361	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-17.1	-163.6	0	0	0	0	0	117	R767 D771 G774	R767-G776 PolarHBondContact NH2-O 2.98Å; D771-G776 WeakPolarHBondContact OD1-CA 3.2Å; G774-G776 PolarHBondContact O-N 3.46Å
777	N	73.6	Confident	80.4	Confident	163 Å²	163	70.6 Å²	70.6	87%	0.872	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.3	3	-178.1	-62.1	-13.4	0	0	0	113.9	Y775	Y775-N777 PolarHBondContact O-N 3.08Å
778	L	85	Confident	79.8	Confident	54 Å²	54	69 Å²	69	28%	0.283	37%	0.37	S	S	.	.			trans	-90.1	139	-174.7	-57.8	-175.8	0	0	0	112.6	R767 Y775 Y782 F783	R767-L778 PolarHBondContact NH1-O 3.2Å; Y775-L778 HydrophobicContact CD1-CD1 3.81Å; Y775-L778 HydrophobicContact CG-CD1 4.37Å; Y775-L778 PolarHBondContact O-N 2.78Å; L778-Y782 HydrophobicContact CB-CD1 4.5Å; L778-Y782 HydrophobicContact CB-CG 4.32Å; L778-Y782 HydrophobicContact CD1-CD1 3.59Å; L778-Y782 HydrophobicContact CD1-CD2 4.17Å; L778-Y782 HydrophobicContact CD1-CE1 3.6Å; L778-Y782 HydrophobicContact CD1-CE2 4.18Å; L778-Y782 HydrophobicContact CD1-CG 3.89Å; L778-F783 HydrophobicContact CB-CE2 4.27Å; L778-F783 HydrophobicContact CB-CZ 4.44Å
779	P	81.9	Confident	78.8	Confident	78 Å²	78	75.1 Å²	75.1	51%	0.506	40%	0.401	S	S	.	.			trans	-74.8	163.2	176.2	32.5	-36.1	0	0	0	112	N781 Y782	P779-N781 PolarHBondContact O-N 2.74Å; P779-Y782 VanDerWaalsContact O-CB 3.27Å; P779-Y782 WeakPolarHBondContact O-CB 3.41Å; P779-Y782 PolarHBondContact O-N 3.2Å
780	L	79.3	Confident	78.4	Confident	36 Å²	36	79.2 Å²	79.2	19%	0.188	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-58.1	-34.4	179.2	-175.3	58.8	0	0	0	112.2	W766 Y782 F783 C784 R794	W766-L780 HydrophobicContact CD2-CD1 4.16Å; W766-L780 HydrophobicContact CE3-CD1 4.14Å; W766-L780 HydrophobicContact CH2-CB 3.83Å; W766-L780 HydrophobicContact CH2-CD1 4Å; W766-L780 HydrophobicContact CH2-CG 4.46Å; W766-L780 HydrophobicContact CZ2-CB 4.04Å; W766-L780 HydrophobicContact CZ2-CD1 4.04Å; W766-L780 HydrophobicContact CZ2-CG 4.42Å; W766-L780 HydrophobicContact CZ3-CD1 4.06Å; L780-Y782 PolarHBondContact O-N 3.02Å; L780-F783 PolarHBondContact O-N 3.07Å; L780-C784 PolarHBondContact O-N 3.33Å; L780-R794 HydrophobicContact CD1-CB 4.34Å; L780-R794 HydrophobicContact CD1-CG 4.26Å; L780-R794 HydrophobicContact CD2-CG 4.27Å
781	N	80.1	Confident	78.2	Confident	125 Å²	125	82.1 Å²	82.1	67%	0.668	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-60.3	-13.8	178.2	-53.7	44.1	0	0	0	113.8	P779 C784	P779-N781 PolarHBondContact O-N 2.74Å; N781-C784 CarbonylContact C-O 3.44Å; N781-C784 VanDerWaalsContact CA-O 3.31Å; N781-C784 WeakPolarHBondContact CA-O 3.39Å
782	Y	81.4	Confident	78.1	Confident	108 Å²	108	80.9 Å²	80.9	42%	0.424	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-74.7	-30.4	171.2	-173.9	-94.2	0	0	0	112.7	L778 P779 L780 K801	L778-Y782 HydrophobicContact CB-CD1 4.5Å; L778-Y782 HydrophobicContact CB-CG 4.32Å; L778-Y782 HydrophobicContact CD1-CD1 3.59Å; L778-Y782 HydrophobicContact CD1-CD2 4.17Å; L778-Y782 HydrophobicContact CD1-CE1 3.6Å; L778-Y782 HydrophobicContact CD1-CE2 4.18Å; L778-Y782 HydrophobicContact CD1-CG 3.89Å; P779-Y782 VanDerWaalsContact O-CB 3.27Å; P779-Y782 WeakPolarHBondContact O-CB 3.41Å; P779-Y782 PolarHBondContact O-N 3.2Å; L780-Y782 PolarHBondContact O-N 3.02Å; Y782-K801 HydrophobicContact CD1-CD 4.44Å; Y782-K801 HydrophobicContact CD1-CG 4.49Å; Y782-K801 HydrophobicContact CE1-CD 4.06Å; Y782-K801 HydrophobicContact CE1-CG 4.11Å
783	F	81.9	Confident	78	Confident	18 Å²	18	83.7 Å²	83.7	8%	0.079	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-33.9	-174.8	-56.7	-81.6	0	0	0	112.8	W766 A770 Y775 L778 L780 V798 K801	W766-F783 HydrophobicContact CZ3-CD2 4.26Å; W766-F783 HydrophobicContact CZ3-CE2 4.11Å; A770-F783 HydrophobicContact CB-CZ 4.17Å; Y775-F783 HydrophobicContact CD1-CE1 4.46Å; Y775-F783 HydrophobicContact CD1-CZ 4.46Å; Y775-F783 AromaticContact CD2-CE1 3.85Å; Y775-F783 HydrophobicContact CD2-CE1 3.85Å; Y775-F783 AromaticContact CD2-CZ 3.98Å; Y775-F783 HydrophobicContact CD2-CZ 3.98Å; Y775-F783 HydrophobicContact CE2-CE1 4.18Å; Y775-F783 HydrophobicContact CG-CE1 4.01Å; Y775-F783 AromaticContact CG-CZ 3.83Å; Y775-F783 HydrophobicContact CG-CZ 3.83Å; L778-F783 HydrophobicContact CB-CE2 4.27Å; L778-F783 HydrophobicContact CB-CZ 4.44Å; L780-F783 PolarHBondContact O-N 3.07Å; F783-V798 HydrophobicContact CD1-CB 4.27Å; F783-V798 HydrophobicContact CD1-CG2 3.84Å; F783-V798 HydrophobicContact CD2-CG2 4.34Å; F783-V798 HydrophobicContact CE1-CB 4.45Å; F783-V798 HydrophobicContact CE1-CG1 4.22Å; F783-V798 HydrophobicContact CE1-CG2 4.06Å; F783-V798 HydrophobicContact CG-CG2 3.98Å; F783-V798 HydrophobicContact CZ-CG2 4.39Å; F783-K801 HydrophobicContact CD1-CB 3.74Å; F783-K801 HydrophobicContact CD1-CG 3.83Å; F783-K801 HydrophobicContact CE1-CB 4.32Å; F783-K801 HydrophobicContact CE1-CG 4.16Å
784	C	76.9	Confident	78	Confident	34 Å²	34	84.8 Å²	84.8	23%	0.23	45%	0.445	C	S	.	.			trans	-140.3	145.4	173.7	-94.2	0	0	0	0	111.5	L780 N781 L788 S797	L780-C784 PolarHBondContact O-N 3.33Å; N781-C784 CarbonylContact C-O 3.44Å; N781-C784 VanDerWaalsContact CA-O 3.31Å; N781-C784 WeakPolarHBondContact CA-O 3.39Å; C784-L788 HydrophobicContact CB-CD1 4.19Å; C784-S797 VanDerWaalsContact SG-CB 3.54Å; C784-S797 PolarHBondContact SG-OG 3.06Å
785	R	65.2	Low	78.2	Confident	261 Å²	261	81.9 Å²	81.9	99%	0.985	42%	0.415	S	S	*	.	S	Bend	trans	-85.6	-11.7	175.1	-63	-175.7	-179.7	-171.1	0.1	113.4
786	T	67.4	Low	78.3	Confident	100 Å²	100	80.7 Å²	80.7	61%	0.613	41%	0.41	S	S	*	.	S	Bend	trans	-105.2	141.9	178.2	-24.4	0	0	0	0	108.8	L788	T786-L788 PolarHBondContact O-N 3.07Å
787	E	61.1	Low	78.9	Confident	179 Å²	179	79.3 Å²	79.3	84%	0.836	40%	0.395	S	S	*	.			trans	-68.8	129.1	166.5	-63.3	-175.4	156.4	0	0	108.7
788	L	74.4	Confident	79.6	Confident	35 Å²	35	71.5 Å²	71.5	18%	0.183	35%	0.353	C	S	.	.			trans	-121.3	123.8	-179.9	-64.3	174.2	0	0	0	107.6	C784 T786 E793 R794 S797	C784-L788 HydrophobicContact CB-CD1 4.19Å; T786-L788 PolarHBondContact O-N 3.07Å; L788-E793 HydrophobicContact CD1-CB 4.27Å; L788-R794 HydrophobicContact CB-CG 4.26Å; L788-R794 PolarHBondContact O-NE 3.18Å; L788-R794 PolarHBondContact O-NH2 3.41Å; L788-S797 WeakPolarHBondContact CD1-OG 3.42Å
789	D	64.7	Low	79.8	Confident	145 Å²	145	69 Å²	69	78%	0.775	34%	0.34	S	S	*	.			trans	-79	-32.1	178.7	-68.8	-45.3	0	0	0	112.8	E791 R794	D789-E791 PolarHBondContact O-N 3.35Å; D789-R794 PolarHBondContact O-NH2 2.93Å
790	N	82.1	Confident	80.1	Confident	85 Å²	85	68.7 Å²	68.7	46%	0.455	33%	0.332	S	S	.	.			trans	-77.4	112	-175	-75.2	-27.1	0	0	0	112.4	P792 E793 R794	N790-P792 VanDerWaalsContact C-CD 3.44Å; N790-P792 HydrophobicContact CB-CG 4.27Å; N790-E793 HydrophobicContact CB-CB 4.05Å; N790-E793 HydrophobicContact CB-CG 3.92Å; N790-E793 PolarHBondContact ND2-OE1 3.28Å; N790-E793 WeakPolarHBondContact O-CA 3.5Å; N790-E793 WeakPolarHBondContact O-CB 3.31Å; N790-E793 PolarHBondContact O-N 3.17Å; N790-R794 PolarHBondContact O-N 2.93Å
791	E	83.6	Confident	80.5	Confident	61 Å²	61	69 Å²	69	29%	0.285	33%	0.332	S	S	.	.	H	α-helix	trans	-42.7	-47.7	167.3	-80.7	-63.3	115.5	0	0	115.1	W766 D789 E793 R794 V795	W766-E791 VanDerWaalsContact CD1-OE2 3.28Å; W766-E791 PolarHBondContact N-OE2 3.37Å; W766-E791 PolarHBondContact NE1-OE1 3.39Å; D789-E791 PolarHBondContact O-N 3.35Å; E791-E793 VanDerWaalsContact C-N 3.27Å; E791-E793 PolarHBondContact O-N 3.48Å; E791-R794 WeakPolarHBondContact O-CB 3.37Å; E791-R794 PolarHBondContact O-N 3.1Å; E791-R794 WeakPolarHBondContact OE1-CD 3.4Å; E791-R794 IonicContact OE1-CZ 2.67Å; E791-R794 IonicContact OE1-NE 3.7Å; E791-R794 IonicContact OE1-NH1 3.53Å; E791-R794 PolarHBondContact OE1-NH1 3.35Å; E791-V795 WeakPolarHBondContact O-CG2 3.43Å; E791-V795 PolarHBondContact O-N 2.9Å
792	P	84.1	Confident	80.8	Confident	48 Å²	48	63.5 Å²	63.5	31%	0.312	30%	0.302	S	S	.	.	H	α-helix	trans	-64.5	-29.8	178.3	24.9	-35.4	0	0	0	113.1	M760 N790 V795 A796	M760-P792 HydrophobicContact CB-CB 4Å; M760-P792 HydrophobicContact CE-CB 4.17Å; M760-P792 HydrophobicContact CG-CB 4.4Å; M760-P792 WeakPolarHBondContact CG-O 3.49Å; M760-P792 WeakPolarHBondContact O-CB 3.13Å; N790-P792 VanDerWaalsContact C-CD 3.44Å; N790-P792 HydrophobicContact CB-CG 4.27Å; P792-V795 PolarHBondContact O-N 3.1Å; P792-A796 PolarHBondContact O-N 3.3Å
793	E	84.6	Confident	81	Confident	74 Å²	74	62.2 Å²	62.2	35%	0.346	30%	0.299	S	S	.	.	H	α-helix	trans	-73.1	-39.3	174.8	-68.4	168.6	-148.8	0	0	110.9	M760 L788 N790 E791 V795 A796 S797	M760-E793 HydrophobicContact CE-CG 4.22Å; L788-E793 HydrophobicContact CD1-CB 4.27Å; N790-E793 HydrophobicContact CB-CB 4.05Å; N790-E793 HydrophobicContact CB-CG 3.92Å; N790-E793 PolarHBondContact ND2-OE1 3.28Å; N790-E793 WeakPolarHBondContact O-CA 3.5Å; N790-E793 WeakPolarHBondContact O-CB 3.31Å; N790-E793 PolarHBondContact O-N 3.17Å; E791-E793 VanDerWaalsContact C-N 3.27Å; E791-E793 PolarHBondContact O-N 3.48Å; E793-V795 VanDerWaalsContact C-N 3.31Å; E793-V795 PolarHBondContact O-N 3.29Å; E793-A796 CarbonylContact O-C 3.6Å; E793-A796 WeakPolarHBondContact O-CA 2.87Å; E793-A796 WeakPolarHBondContact O-CB 2.96Å; E793-A796 PolarHBondContact O-N 3.03Å; E793-S797 PolarHBondContact O-N 3.31Å; E793-S797 PolarHBondContact O-OG 2.89Å
794	R	87.3	Confident	81.1	Confident	55 Å²	55	66.1 Å²	66.1	21%	0.208	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-39.9	171	-59.1	174	-176.3	162.1	-1.7	112.1	W766 L780 L788 D789 N790 E791 A796 S797 V798	W766-R794 HydrophobicContact CB-CB 3.68Å; W766-R794 VanDerWaalsContact CD1-CD 3.42Å; W766-R794 HydrophobicContact CD2-CB 4.37Å; W766-R794 HydrophobicContact CG-CB 3.62Å; L780-R794 HydrophobicContact CD1-CB 4.34Å; L780-R794 HydrophobicContact CD1-CG 4.26Å; L780-R794 HydrophobicContact CD2-CG 4.27Å; L788-R794 HydrophobicContact CB-CG 4.26Å; L788-R794 PolarHBondContact O-NE 3.18Å; L788-R794 PolarHBondContact O-NH2 3.41Å; D789-R794 PolarHBondContact O-NH2 2.93Å; N790-R794 PolarHBondContact O-N 2.93Å; E791-R794 WeakPolarHBondContact O-CB 3.37Å; E791-R794 PolarHBondContact O-N 3.1Å; E791-R794 WeakPolarHBondContact OE1-CD 3.4Å; E791-R794 IonicContact OE1-CZ 2.67Å; E791-R794 IonicContact OE1-NE 3.7Å; E791-R794 IonicContact OE1-NH1 3.53Å; E791-R794 PolarHBondContact OE1-NH1 3.35Å; R794-A796 VanDerWaalsContact C-N 3.33Å; R794-S797 WeakPolarHBondContact O-CB 3.48Å; R794-S797 PolarHBondContact O-N 2.86Å; R794-V798 WeakPolarHBondContact O-CG2 3.34Å; R794-V798 PolarHBondContact O-N 2.96Å
795	V	87.4	Confident	81.2	Confident	0 Å²	0	67 Å²	67	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61	-42.3	171.9	170.5	0	0	0	0	111	L759 V763 W766 F769 E791 P792 E793 V798 L799	L759-V795 HydrophobicContact CB-CG1 4.28Å; V763-V795 HydrophobicContact CB-CG1 4.09Å; V763-V795 HydrophobicContact CB-CG2 4.28Å; V763-V795 HydrophobicContact CG1-CG1 4.21Å; V763-V795 HydrophobicContact CG1-CG2 3.95Å; W766-V795 HydrophobicContact CB-CG2 3.92Å; F769-V795 HydrophobicContact CD1-CG1 4.37Å; E791-V795 WeakPolarHBondContact O-CG2 3.43Å; E791-V795 PolarHBondContact O-N 2.9Å; P792-V795 PolarHBondContact O-N 3.1Å; E793-V795 VanDerWaalsContact C-N 3.31Å; E793-V795 PolarHBondContact O-N 3.29Å; V795-V798 PolarHBondContact O-N 3.21Å; V795-L799 PolarHBondContact O-N 3.23Å
796	A	87.2	Confident	81.7	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-40.8	176.5	0	0	0	0	0	112.3	R756 M760 P792 E793 R794 V798 L799 E800	R756-A796 HydrophobicContact CG-CB 4.24Å; M760-A796 HydrophobicContact CG-CB 4.16Å; M760-A796 HydrophobicContact SD-CB 4.03Å; P792-A796 PolarHBondContact O-N 3.3Å; E793-A796 CarbonylContact O-C 3.6Å; E793-A796 WeakPolarHBondContact O-CA 2.87Å; E793-A796 WeakPolarHBondContact O-CB 2.96Å; E793-A796 PolarHBondContact O-N 3.03Å; R794-A796 VanDerWaalsContact C-N 3.33Å; A796-V798 PolarHBondContact O-N 3.48Å; A796-L799 CarbonylContact O-C 3.55Å; A796-L799 WeakPolarHBondContact O-CB 3.45Å; A796-L799 PolarHBondContact O-N 2.77Å; A796-L799 VanDerWaalsContact O-N 3.12Å; A796-E800 WeakPolarHBondContact O-CB 3.38Å; A796-E800 WeakPolarHBondContact O-CG 3.39Å; A796-E800 PolarHBondContact O-N 3.3Å
797	S	87.9	Confident	81.9	Confident	5 Å²	5	56.1 Å²	56.1	4%	0.035	28%	0.283	C	S	.	.	H	α-helix	trans	-57.2	-44.7	174.3	-48.2	0	0	0	0	112.5	C784 L788 E793 R794 L799 E800 K801	C784-S797 VanDerWaalsContact SG-CB 3.54Å; C784-S797 PolarHBondContact SG-OG 3.06Å; L788-S797 WeakPolarHBondContact CD1-OG 3.42Å; E793-S797 PolarHBondContact O-N 3.31Å; E793-S797 PolarHBondContact O-OG 2.89Å; R794-S797 WeakPolarHBondContact O-CB 3.48Å; R794-S797 PolarHBondContact O-N 2.86Å; S797-L799 VanDerWaalsContact C-N 3.33Å; S797-L799 PolarHBondContact O-N 2.81Å; S797-E800 PolarHBondContact O-N 3.33Å; S797-K801 WeakPolarHBondContact O-CB 3.41Å; S797-K801 PolarHBondContact O-N 3.41Å
798	V	88.6	Confident	82.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-38.1	176.2	177.3	0	0	0	0	111.2	W766 F769 A770 L773 Y775 F783 R794 V795 A796 L802	W766-V798 HydrophobicContact CE3-CG2 4.07Å; F769-V798 HydrophobicContact CD1-CB 4.06Å; F769-V798 HydrophobicContact CD1-CG1 3.64Å; F769-V798 HydrophobicContact CE1-CB 4.28Å; F769-V798 HydrophobicContact CE1-CG1 3.86Å; A770-V798 HydrophobicContact CB-CG1 4.13Å; A770-V798 HydrophobicContact CB-CG2 4.22Å; L773-V798 HydrophobicContact CD1-CG1 3.78Å; Y775-V798 HydrophobicContact CD2-CG1 4.5Å; F783-V798 HydrophobicContact CD1-CB 4.27Å; F783-V798 HydrophobicContact CD1-CG2 3.84Å; F783-V798 HydrophobicContact CD2-CG2 4.34Å; F783-V798 HydrophobicContact CE1-CB 4.45Å; F783-V798 HydrophobicContact CE1-CG1 4.22Å; F783-V798 HydrophobicContact CE1-CG2 4.06Å; F783-V798 HydrophobicContact CG-CG2 3.98Å; F783-V798 HydrophobicContact CZ-CG2 4.39Å; R794-V798 WeakPolarHBondContact O-CG2 3.34Å; R794-V798 PolarHBondContact O-N 2.96Å; V795-V798 PolarHBondContact O-N 3.21Å; A796-V798 PolarHBondContact O-N 3.48Å; V798-L802 WeakPolarHBondContact O-CB 3.21Å; V798-L802 PolarHBondContact O-N 2.81Å
799	L	88.8	Confident	81.3	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-71.2	-31	176.8	-171.2	66.9	0	0	0	113.3	Y752 V755 R756 L759 F769 V795 A796 S797 K803 F817 L821	Y752-L799 HydrophobicContact CE2-CD2 4.39Å; Y752-L799 HydrophobicContact CE2-CG 4.17Å; Y752-L799 PolarHBondContact OH-O 2.69Å; V755-L799 HydrophobicContact CG1-CD2 4.33Å; R756-L799 HydrophobicContact CB-CD2 4.08Å; R756-L799 HydrophobicContact CG-CD2 4.33Å; L759-L799 HydrophobicContact CB-CD2 4.49Å; L759-L799 HydrophobicContact CD2-CD1 4.01Å; L759-L799 HydrophobicContact CD2-CD2 4.26Å; F769-L799 HydrophobicContact CE1-CB 4.36Å; F769-L799 HydrophobicContact CE1-CD1 4.43Å; F769-L799 HydrophobicContact CZ-CD1 4.12Å; V795-L799 PolarHBondContact O-N 3.23Å; A796-L799 CarbonylContact O-C 3.55Å; A796-L799 WeakPolarHBondContact O-CB 3.45Å; A796-L799 PolarHBondContact O-N 2.77Å; A796-L799 VanDerWaalsContact O-N 3.12Å; S797-L799 VanDerWaalsContact C-N 3.33Å; S797-L799 PolarHBondContact O-N 2.81Å; L799-K803 PolarHBondContact O-N 2.78Å; L799-F817 HydrophobicContact CD1-CE2 3.93Å; L799-F817 HydrophobicContact CD1-CZ 3.59Å; L799-F817 HydrophobicContact CG-CZ 4.16Å; L799-L821 HydrophobicContact CD1-CD1 3.85Å
800	E	88.1	Confident	80.8	Confident	72 Å²	72	60.8 Å²	60.8	34%	0.336	30%	0.304	S	S	.	.	H	α-helix	trans	-71.1	-45.1	173.6	-74.5	169.3	-159.6	0	0	110	Y752 R756 A796 S797 L802 K803 E804	Y752-E800 WeakPolarHBondContact OH-CA 3.45Å; Y752-E800 WeakPolarHBondContact OH-CG 3.16Å; Y752-E800 PolarHBondContact OH-N 3.05Å; R756-E800 IonicContact CZ-OE1 2.75Å; R756-E800 IonicContact NE-OE1 2.67Å; R756-E800 PolarHBondContact NE-OE1 2.94Å; R756-E800 IonicContact NH2-OE1 2.68Å; R756-E800 PolarHBondContact NH2-OE1 3.25Å; A796-E800 WeakPolarHBondContact O-CB 3.38Å; A796-E800 WeakPolarHBondContact O-CG 3.39Å; A796-E800 PolarHBondContact O-N 3.3Å; S797-E800 PolarHBondContact O-N 3.33Å; E800-L802 PolarHBondContact O-N 2.86Å; E800-K803 WeakPolarHBondContact O-CA 3.48Å; E800-K803 VanDerWaalsContact O-CB 3.29Å; E800-K803 WeakPolarHBondContact O-CB 3.37Å; E800-K803 PolarHBondContact O-N 3.3Å; E800-E804 PolarHBondContact O-N 3.29Å
801	K	87.1	Confident	79.4	Confident	41 Å²	41	61.7 Å²	61.7	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-46	173.1	-167.5	73.6	-146.8	158.4	0	113.1	Y782 F783 S797 K803 E804 E805	Y782-K801 HydrophobicContact CD1-CD 4.44Å; Y782-K801 HydrophobicContact CD1-CG 4.49Å; Y782-K801 HydrophobicContact CE1-CD 4.06Å; Y782-K801 HydrophobicContact CE1-CG 4.11Å; F783-K801 HydrophobicContact CD1-CB 3.74Å; F783-K801 HydrophobicContact CD1-CG 3.83Å; F783-K801 HydrophobicContact CE1-CB 4.32Å; F783-K801 HydrophobicContact CE1-CG 4.16Å; S797-K801 WeakPolarHBondContact O-CB 3.41Å; S797-K801 PolarHBondContact O-N 3.41Å; K801-K803 PolarHBondContact O-N 2.99Å; K801-E804 IonicContact NZ-OE2 3.49Å; K801-E804 PolarHBondContact NZ-OE2 3.08Å; K801-E804 WeakPolarHBondContact O-CB 3.49Å; K801-E804 PolarHBondContact O-N 3.47Å; K801-E805 VanDerWaalsContact CE-OE1 3.26Å; K801-E805 WeakPolarHBondContact CE-OE1 3.49Å; K801-E805 PolarHBondContact O-N 3.25Å; K801-E805 VanDerWaalsContact O-N 3.07Å
802	L	87.3	Confident	77.6	Confident	11 Å²	11	69.1 Å²	69.1	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-58.8	-35.6	175.3	-179	64.3	0	0	0	112.2	L773 V798 E800 S806 F817 E820 L821	L773-L802 HydrophobicContact CD1-CD2 3.99Å; L773-L802 HydrophobicContact CD2-CD1 3.93Å; L773-L802 HydrophobicContact CD2-CD2 3.59Å; L773-L802 HydrophobicContact CD2-CG 4.37Å; L773-L802 HydrophobicContact CG-CD2 4.48Å; V798-L802 WeakPolarHBondContact O-CB 3.21Å; V798-L802 PolarHBondContact O-N 2.81Å; E800-L802 PolarHBondContact O-N 2.86Å; L802-S806 VanDerWaalsContact O-CB 3.31Å; L802-S806 WeakPolarHBondContact O-CB 3.48Å; L802-S806 PolarHBondContact O-N 2.73Å; L802-S806 VanDerWaalsContact O-N 3.08Å; L802-S806 PolarHBondContact O-OG 3.32Å; L802-F817 HydrophobicContact CB-CE2 4.38Å; L802-F817 HydrophobicContact CD2-CD2 4.2Å; L802-F817 HydrophobicContact CD2-CE2 4.04Å; L802-F817 HydrophobicContact CG-CD2 4.01Å; L802-F817 HydrophobicContact CG-CE2 4.1Å; L802-E820 HydrophobicContact CD1-CB 4.3Å; L802-L821 HydrophobicContact CD2-CB 4.24Å
803	K	85.3	Confident	76.1	Confident	81 Å²	81	74 Å²	74	35%	0.352	36%	0.359	S	S	.	.	H	α-helix	trans	-68.3	-47.2	177.5	-170.2	-163	-176.2	-178.7	0	111.1	Y752 L799 E800 K801 E805 S806 T807 F817	Y752-K803 HydrophobicContact CD1-CD 4.42Å; Y752-K803 HydrophobicContact CD2-CD 3.92Å; Y752-K803 HydrophobicContact CD2-CG 4.42Å; Y752-K803 HydrophobicContact CE1-CD 4.18Å; Y752-K803 HydrophobicContact CE2-CB 4.1Å; Y752-K803 HydrophobicContact CE2-CD 3.67Å; Y752-K803 HydrophobicContact CE2-CG 4.11Å; Y752-K803 HydrophobicContact CG-CD 4.3Å; L799-K803 PolarHBondContact O-N 2.78Å; E800-K803 WeakPolarHBondContact O-CA 3.48Å; E800-K803 VanDerWaalsContact O-CB 3.29Å; E800-K803 WeakPolarHBondContact O-CB 3.37Å; E800-K803 PolarHBondContact O-N 3.3Å; K801-K803 PolarHBondContact O-N 2.99Å; K803-E805 PolarHBondContact O-N 3.33Å; K803-S806 PolarHBondContact O-N 3.16Å; K803-S806 PolarHBondContact O-OG 3.39Å; K803-T807 WeakPolarHBondContact O-CB 3.33Å; K803-T807 PolarHBondContact O-N 2.87Å; K803-T807 VanDerWaalsContact O-N 3.16Å; K803-T807 PolarHBondContact O-OG1 2.8Å; K803-F817 HydrophobicContact CB-CD2 4.17Å; K803-F817 HydrophobicContact CB-CE2 3.93Å
804	E	84.3	Confident	74.8	Confident	99 Å²	99	80.9 Å²	80.9	46%	0.463	38%	0.381	S	S	.	.	H	α-helix	trans	-53	-55	174.3	-65.8	176.3	173.2	0	0	111	E800 K801 S806 T807 N808	E800-E804 PolarHBondContact O-N 3.29Å; K801-E804 IonicContact NZ-OE2 3.49Å; K801-E804 PolarHBondContact NZ-OE2 3.08Å; K801-E804 WeakPolarHBondContact O-CB 3.49Å; K801-E804 PolarHBondContact O-N 3.47Å; E804-S806 VanDerWaalsContact C-N 3.28Å; E804-S806 PolarHBondContact O-N 3.5Å; E804-T807 WeakPolarHBondContact O-CA 3.16Å; E804-T807 WeakPolarHBondContact O-CB 3.32Å; E804-T807 PolarHBondContact O-N 2.76Å; E804-N808 PolarHBondContact O-N 3.22Å; E804-N808 PolarHBondContact O-OD1 3.33Å
805	E	79.6	Confident	73.7	Confident	52 Å²	52	84 Å²	84	24%	0.243	40%	0.397	C	S	.	.	H	α-helix	trans	-63.2	-32.6	-177	-71.4	174.4	-160.8	0	0	113.2	Y775 K801 K803 T807	Y775-E805 VanDerWaalsContact CE1-OE2 3.3Å; Y775-E805 WeakPolarHBondContact CE1-OE2 3.46Å; Y775-E805 VanDerWaalsContact OH-CD 3.28Å; Y775-E805 PolarHBondContact OH-OE2 3.28Å; K801-E805 VanDerWaalsContact CE-OE1 3.26Å; K801-E805 WeakPolarHBondContact CE-OE1 3.49Å; K801-E805 PolarHBondContact O-N 3.25Å; K801-E805 VanDerWaalsContact O-N 3.07Å; K803-E805 PolarHBondContact O-N 3.33Å; E805-T807 VanDerWaalsContact C-N 3.26Å; E805-T807 PolarHBondContact O-N 3.17Å
806	S	74.6	Confident	73.4	Confident	38 Å²	38	85.3 Å²	85.3	27%	0.266	41%	0.406	S	S	.	.	H	α-helix	trans	-74.8	-13	173.5	74.3	0	0	0	0	114.5	L802 K803 E804 K815	L802-S806 VanDerWaalsContact O-CB 3.31Å; L802-S806 WeakPolarHBondContact O-CB 3.48Å; L802-S806 PolarHBondContact O-N 2.73Å; L802-S806 VanDerWaalsContact O-N 3.08Å; L802-S806 PolarHBondContact O-OG 3.32Å; K803-S806 PolarHBondContact O-N 3.16Å; K803-S806 PolarHBondContact O-OG 3.39Å; E804-S806 VanDerWaalsContact C-N 3.28Å; E804-S806 PolarHBondContact O-N 3.5Å; S806-K815 WeakPolarHBondContact CB-O 3.48Å
807	T	70.9	Confident	73.3	Confident	96 Å²	96	85.7 Å²	85.7	59%	0.589	41%	0.407	S	S	*	.	H	α-helix	trans	-100	-28.7	-179.6	-51.5	0	0	0	0	111.8	K803 E804 E805 M809	K803-T807 WeakPolarHBondContact O-CB 3.33Å; K803-T807 PolarHBondContact O-N 2.87Å; K803-T807 VanDerWaalsContact O-N 3.16Å; K803-T807 PolarHBondContact O-OG1 2.8Å; E804-T807 WeakPolarHBondContact O-CA 3.16Å; E804-T807 WeakPolarHBondContact O-CB 3.32Å; E804-T807 PolarHBondContact O-N 2.76Å; E805-T807 VanDerWaalsContact C-N 3.26Å; E805-T807 PolarHBondContact O-N 3.17Å; T807-M809 PolarHBondContact O-N 3.49Å
808	N	70.1	Confident	73.2	Confident	97 Å²	97	86.2 Å²	86.2	52%	0.519	41%	0.409	S	S	.	.			trans	-62.4	122.6	-179.7	-72.4	-15.2	0	0	0	112.5	E804 E810	E804-N808 PolarHBondContact O-N 3.22Å; E804-N808 PolarHBondContact O-OD1 3.33Å; N808-E810 PolarHBondContact O-N 2.94Å
809	M	53.8	Low	73.1	Confident	171 Å²	171	88.5 Å²	88.5	84%	0.842	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.3	-169.7	-77.2	178.2	49	0	0	115.7	T807 N811	T807-M809 PolarHBondContact O-N 3.49Å; M809-N811 VanDerWaalsContact C-N 3.35Å; M809-N811 PolarHBondContact O-N 3.2Å
810	E	54.7	Low	73.2	Confident	189 Å²	189	89.9 Å²	89.9	88%	0.883	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-20.6	-172.5	-59	-175.4	142.2	0	0	113.6	N808 K812	N808-E810 PolarHBondContact O-N 2.94Å; E810-K812 PolarHBondContact O-N 3.37Å
811	N	51.8	Low	73.3	Confident	103 Å²	103	86.4 Å²	86.4	55%	0.551	41%	0.408	S	S	*	.			trans	-72.8	109.6	177.1	-86	-44.1	0	0	0	111.3	M809 E813	M809-N811 VanDerWaalsContact C-N 3.35Å; M809-N811 PolarHBondContact O-N 3.2Å; N811-E813 CarbonylContact O-C 3.56Å; N811-E813 PolarHBondContact O-N 3.04Å; N811-E813 VanDerWaalsContact O-N 3.09Å
812	K	47.3	Very low	73.5	Confident	217 Å²	217	84.5 Å²	84.5	94%	0.943	40%	0.399	S	S	*	.	S	Bend	trans	-56.4	-25.1	177.4	-70.9	-179.5	178	174.9	0	113.6	E810	E810-K812 PolarHBondContact O-N 3.37Å
813	E	52.1	Low	73.6	Confident	152 Å²	152	85.2 Å²	85.2	71%	0.71	40%	0.403	S	S	*	.	S	Bend	trans	-96.5	106.3	167.2	-65.6	-165.4	162.3	0	0	111.4	N811 K815	N811-E813 CarbonylContact O-C 3.56Å; N811-E813 PolarHBondContact O-N 3.04Å; N811-E813 VanDerWaalsContact O-N 3.09Å; E813-K815 VanDerWaalsContact C-N 3.33Å; E813-K815 PolarHBondContact O-N 3.01Å
814	R	55.8	Low	73.9	Confident	217 Å²	217	81.4 Å²	81.4	82%	0.819	39%	0.387	S	S	*	.			trans	-67.9	86.5	172.2	-76.8	-176.9	172.6	170.7	-2.8	111.7	S816	R814-S816 PolarHBondContact O-N 3.49Å; R814-S816 VanDerWaalsContact O-N 3.11Å
815	K	65.1	Low	74.2	Confident	122 Å²	122	76.7 Å²	76.7	53%	0.53	37%	0.365	S	S	.	.			trans	-68.4	94.2	166.1	-72.8	-175.1	-176.9	177.6	0	109.9	S806 E813 F817 E820	S806-K815 WeakPolarHBondContact CB-O 3.48Å; E813-K815 VanDerWaalsContact C-N 3.33Å; E813-K815 PolarHBondContact O-N 3.01Å; K815-F817 PolarHBondContact O-N 3.47Å; K815-E820 HydrophobicContact CB-CG 3.94Å; K815-E820 HydrophobicContact CG-CG 4.41Å
816	S	80.2	Confident	74.7	Confident	27 Å²	27	74.2 Å²	74.2	19%	0.189	35%	0.353	C	S	.	.			trans	-66.9	117.6	178.1	49.7	0	0	0	0	111.1	K746 R814 Q818 R819 E820	K746-S816 WeakPolarHBondContact CD-OG 3.45Å; K746-S816 VanDerWaalsContact CE-OG 3.25Å; K746-S816 WeakPolarHBondContact CE-OG 3.33Å; K746-S816 WeakPolarHBondContact CG-OG 3.44Å; R814-S816 PolarHBondContact O-N 3.49Å; R814-S816 VanDerWaalsContact O-N 3.11Å; S816-Q818 VanDerWaalsContact C-N 3.29Å; S816-Q818 PolarHBondContact O-N 3.41Å; S816-R819 WeakPolarHBondContact O-CB 3.34Å; S816-R819 PolarHBondContact O-N 3.35Å; S816-R819 WeakPolarHBondContact OG-CB 3.46Å; S816-E820 PolarHBondContact O-N 3.4Å
817	F	86.3	Confident	75.4	Confident	9 Å²	9	75.6 Å²	75.6	4%	0.039	35%	0.354	C	S	.	.	H	α-helix	trans	-32.3	-56.9	-179.3	180	-105.3	0	0	0	114.4	Y750 Y752 V755 L799 L802 K803 K815 R819 E820 L821	Y750-F817 HydrophobicContact CD2-CE1 4.35Å; Y750-F817 HydrophobicContact CE1-CD1 4.43Å; Y750-F817 AromaticContact CE2-CD1 3.65Å; Y750-F817 HydrophobicContact CE2-CD1 3.65Å; Y750-F817 AromaticContact CE2-CE1 3.61Å; Y750-F817 HydrophobicContact CE2-CE1 3.61Å; Y750-F817 AromaticContact CZ-CD1 3.59Å; Y750-F817 WeakPolarHBondContact OH-CD1 3.43Å; Y752-F817 HydrophobicContact CD2-CE1 4.16Å; Y752-F817 AromaticContact CD2-CZ 3.88Å; Y752-F817 HydrophobicContact CD2-CZ 3.88Å; Y752-F817 HydrophobicContact CE2-CE1 4.35Å; Y752-F817 HydrophobicContact CE2-CE2 4.1Å; Y752-F817 AromaticContact CE2-CZ 3.61Å; Y752-F817 HydrophobicContact CE2-CZ 3.61Å; V755-F817 HydrophobicContact CG1-CE1 4.49Å; L799-F817 HydrophobicContact CD1-CE2 3.93Å; L799-F817 HydrophobicContact CD1-CZ 3.59Å; L799-F817 HydrophobicContact CG-CZ 4.16Å; L802-F817 HydrophobicContact CB-CE2 4.38Å; L802-F817 HydrophobicContact CD2-CD2 4.2Å; L802-F817 HydrophobicContact CD2-CE2 4.04Å; L802-F817 HydrophobicContact CG-CD2 4.01Å; L802-F817 HydrophobicContact CG-CE2 4.1Å; K803-F817 HydrophobicContact CB-CD2 4.17Å; K803-F817 HydrophobicContact CB-CE2 3.93Å; K815-F817 PolarHBondContact O-N 3.47Å; F817-R819 VanDerWaalsContact C-N 3.34Å; F817-R819 PolarHBondContact O-N 3Å; F817-E820 PolarHBondContact O-N 3.13Å; F817-L821 HydrophobicContact CE1-CD2 3.87Å; F817-L821 HydrophobicContact CZ-CD2 4.19Å; F817-L821 VanDerWaalsContact O-CB 3.24Å; F817-L821 WeakPolarHBondContact O-CB 3.4Å; F817-L821 PolarHBondContact O-N 2.89Å
818	Q	85.3	Confident	76.1	Confident	15 Å²	15	71.8 Å²	71.8	7%	0.07	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-32.8	-176.3	-65	166.8	-76.2	0	0	113.8	C745 L748 Y750 S816 M822 F841	C745-Q818 VanDerWaalsContact O-CB 3.32Å; C745-Q818 WeakPolarHBondContact O-CB 3.23Å; C745-Q818 PolarHBondContact O-OE1 2.99Å; L748-Q818 PolarHBondContact O-NE2 3.04Å; L748-Q818 PolarHBondContact O-OE1 3.13Å; Y750-Q818 HydrophobicContact CD1-CG 3.71Å; Y750-Q818 VanDerWaalsContact CD1-NE2 3.28Å; Y750-Q818 HydrophobicContact CE1-CG 3.83Å; Y750-Q818 HydrophobicContact CG-CG 4.18Å; S816-Q818 VanDerWaalsContact C-N 3.29Å; S816-Q818 PolarHBondContact O-N 3.41Å; Q818-M822 VanDerWaalsContact O-CB 3.26Å; Q818-M822 WeakPolarHBondContact O-CB 3.38Å; Q818-M822 WeakPolarHBondContact O-CG 3.46Å; Q818-M822 PolarHBondContact O-N 3.37Å; Q818-F841 HydrophobicContact CB-CE2 4.44Å; Q818-F841 HydrophobicContact CG-CE2 3.97Å; Q818-F841 VanDerWaalsContact NE2-CD2 3.34Å
819	R	87.6	Confident	76.8	Confident	49 Å²	49	68.8 Å²	68.8	19%	0.185	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-47.5	177	175.8	174.9	172.8	-96.8	12.3	110.5	D739 L742 K746 S816 F817 M822 M823	D739-R819 IonicContact OD1-CZ 3.67Å; D739-R819 IonicContact OD1-NE 3.89Å; D739-R819 IonicContact OD1-NH2 2.72Å; D739-R819 PolarHBondContact OD1-NH2 3.46Å; L742-R819 HydrophobicContact CB-CG 4.2Å; L742-R819 HydrophobicContact CD1-CG 4.43Å; K746-R819 HydrophobicContact CG-CB 4.48Å; S816-R819 WeakPolarHBondContact O-CB 3.34Å; S816-R819 PolarHBondContact O-N 3.35Å; S816-R819 WeakPolarHBondContact OG-CB 3.46Å; F817-R819 VanDerWaalsContact C-N 3.34Å; F817-R819 PolarHBondContact O-N 3Å; R819-M822 PolarHBondContact O-N 2.79Å; R819-M823 HydrophobicContact CG-CE 4.39Å; R819-M823 VanDerWaalsContact O-CB 3.25Å; R819-M823 WeakPolarHBondContact O-CB 3.44Å; R819-M823 PolarHBondContact O-N 3.49Å
820	E	89.2	Confident	78.3	Confident	29 Å²	29	62.1 Å²	62.1	14%	0.136	28%	0.284	C	S	.	.	H	α-helix	trans	-71.1	-40.2	-176.2	-47.7	-43.7	123.5	0	0	110.9	L773 L802 K815 S816 F817 M823 A824	L773-E820 HydrophobicContact CD2-CB 4.5Å; L802-E820 HydrophobicContact CD1-CB 4.3Å; K815-E820 HydrophobicContact CB-CG 3.94Å; K815-E820 HydrophobicContact CG-CG 4.41Å; S816-E820 PolarHBondContact O-N 3.4Å; F817-E820 PolarHBondContact O-N 3.13Å; E820-M823 PolarHBondContact O-N 3.49Å; E820-A824 PolarHBondContact O-N 3.49Å
821	L	90.6	Very high	79.8	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-53.6	-55.6	169.5	172.8	61.9	0	0	0	111.8	V755 L759 F769 L799 L802 F817 M823 A824 L825	V755-L821 HydrophobicContact CG1-CD2 3.6Å; L759-L821 HydrophobicContact CD1-CD1 4.25Å; L759-L821 HydrophobicContact CD2-CD1 3.68Å; F769-L821 HydrophobicContact CE2-CD1 4.02Å; F769-L821 HydrophobicContact CZ-CD1 3.83Å; L799-L821 HydrophobicContact CD1-CD1 3.85Å; L802-L821 HydrophobicContact CD2-CB 4.24Å; F817-L821 HydrophobicContact CE1-CD2 3.87Å; F817-L821 HydrophobicContact CZ-CD2 4.19Å; F817-L821 VanDerWaalsContact O-CB 3.24Å; F817-L821 WeakPolarHBondContact O-CB 3.4Å; F817-L821 PolarHBondContact O-N 2.89Å; L821-M823 VanDerWaalsContact C-N 3.29Å; L821-M823 PolarHBondContact O-N 2.72Å; L821-A824 PolarHBondContact O-N 2.82Å; L821-L825 HydrophobicContact CD1-CD1 4.01Å; L821-L825 HydrophobicContact CD1-CG 4.35Å; L821-L825 HydrophobicContact CG-CD1 4.29Å; L821-L825 WeakPolarHBondContact O-CG 3.25Å; L821-L825 PolarHBondContact O-N 3.49Å; L821-L825 VanDerWaalsContact O-N 3.07Å
822	M	90.8	Very high	81.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.3	-34.5	180	-65.7	-74	-174.1	0	0	111.5	L742 Q818 R819 L825 L826 V834 L837 V838 F841	L742-M822 HydrophobicContact CD2-CB 3.58Å; Q818-M822 VanDerWaalsContact O-CB 3.26Å; Q818-M822 WeakPolarHBondContact O-CB 3.38Å; Q818-M822 WeakPolarHBondContact O-CG 3.46Å; Q818-M822 PolarHBondContact O-N 3.37Å; R819-M822 PolarHBondContact O-N 2.79Å; M822-L825 PolarHBondContact O-N 2.88Å; M822-L826 WeakPolarHBondContact O-CB 3.34Å; M822-L826 WeakPolarHBondContact O-CG 3.42Å; M822-L826 PolarHBondContact O-N 3.34Å; M822-V834 HydrophobicContact SD-CB 4.22Å; M822-V834 HydrophobicContact SD-CG1 3.77Å; M822-V834 HydrophobicContact SD-CG2 4.07Å; M822-L837 HydrophobicContact CE-CB 3.5Å; M822-L837 HydrophobicContact CE-CD1 4.41Å; M822-L837 HydrophobicContact SD-CB 4.38Å; M822-V838 HydrophobicContact CE-CG2 3.79Å; M822-V838 HydrophobicContact SD-CG2 4.09Å; M822-F841 HydrophobicContact CE-CD2 3.86Å; M822-F841 HydrophobicContact CE-CE2 3.39Å; M822-F841 HydrophobicContact CE-CZ 3.99Å
823	M	91.3	Very high	83.2	Confident	27 Å²	27	39 Å²	39	13%	0.133	18%	0.178	C	C	.	.	H	α-helix	trans	-63.7	-43.9	175.9	-164.3	-168.2	-56.5	0	0	112	L738 L742 R819 E820 L821 L826 K827	L738-M823 HydrophobicContact CD1-CG 4.35Å; L738-M823 HydrophobicContact CD2-CG 3.75Å; L738-M823 HydrophobicContact CG-CG 4.1Å; L742-M823 HydrophobicContact CD1-CB 3.69Å; L742-M823 HydrophobicContact CD1-CG 4.05Å; R819-M823 HydrophobicContact CG-CE 4.39Å; R819-M823 VanDerWaalsContact O-CB 3.25Å; R819-M823 WeakPolarHBondContact O-CB 3.44Å; R819-M823 PolarHBondContact O-N 3.49Å; E820-M823 PolarHBondContact O-N 3.49Å; L821-M823 VanDerWaalsContact C-N 3.29Å; L821-M823 PolarHBondContact O-N 2.72Å; M823-L826 PolarHBondContact O-N 3.02Å; M823-K827 HydrophobicContact CG-CD 4.39Å; M823-K827 WeakPolarHBondContact O-CB 3.29Å; M823-K827 VanDerWaalsContact O-CG 3.26Å; M823-K827 WeakPolarHBondContact O-CG 3.45Å; M823-K827 PolarHBondContact O-N 3.49Å
824	A	90.2	Very high	85	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-63.9	-47	176.2	0	0	0	0	0	111.7	F769 A772 L773 E820 L821 L826 K827 M828	F769-A824 HydrophobicContact CD2-CB 4.4Å; F769-A824 HydrophobicContact CE2-CB 4.25Å; A772-A824 HydrophobicContact CB-CB 3.91Å; L773-A824 HydrophobicContact CD2-CB 3.53Å; L773-A824 HydrophobicContact CG-CB 3.63Å; E820-A824 PolarHBondContact O-N 3.49Å; L821-A824 PolarHBondContact O-N 2.82Å; A824-L826 VanDerWaalsContact C-N 3.32Å; A824-L826 PolarHBondContact O-N 3.15Å; A824-K827 WeakPolarHBondContact O-CB 3.46Å; A824-K827 PolarHBondContact O-N 3.45Å; A824-K827 VanDerWaalsContact O-N 3.08Å; A824-M828 WeakPolarHBondContact O-CG 3.38Å; A824-M828 PolarHBondContact O-N 2.9Å
825	L	90.2	Very high	86.6	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-61.6	-38.4	177.4	-65.1	177.2	0	0	0	112.3	L759 V763 F769 L821 M822 M828 C830 L833 V834 L837	L759-L825 HydrophobicContact CD1-CD1 4.36Å; V763-L825 HydrophobicContact CG2-CD2 4.17Å; F769-L825 HydrophobicContact CD2-CD2 4.27Å; F769-L825 HydrophobicContact CE2-CD2 4.08Å; F769-L825 HydrophobicContact CE2-CG 4.47Å; L821-L825 HydrophobicContact CD1-CD1 4.01Å; L821-L825 HydrophobicContact CD1-CG 4.35Å; L821-L825 HydrophobicContact CG-CD1 4.29Å; L821-L825 WeakPolarHBondContact O-CG 3.25Å; L821-L825 PolarHBondContact O-N 3.49Å; L821-L825 VanDerWaalsContact O-N 3.07Å; M822-L825 PolarHBondContact O-N 2.88Å; L825-M828 PolarHBondContact O-N 3.03Å; L825-C830 HydrophobicContact CB-CB 4.16Å; L825-C830 HydrophobicContact CD2-CB 4.35Å; L825-C830 WeakPolarHBondContact O-CA 3.49Å; L825-C830 VanDerWaalsContact O-CB 3.29Å; L825-C830 WeakPolarHBondContact O-CB 3.19Å; L825-C830 PolarHBondContact O-N 2.81Å; L825-L833 HydrophobicContact CD1-CD2 4.04Å; L825-L833 HydrophobicContact CD1-CG 4.17Å; L825-L833 HydrophobicContact CD2-CD2 3.86Å; L825-V834 HydrophobicContact CB-CG2 3.53Å; L825-V834 HydrophobicContact CD1-CG2 4.31Å; L825-L837 HydrophobicContact CD1-CD1 3.82Å
826	L	90.5	Very high	87.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.1	-34.9	173.2	-71	175.4	0	0	0	112.8	L738 I741 L742 M822 M823 A824 M828 D829 Q831 V834 L942 L945 F950	L738-L826 HydrophobicContact CD1-CB 3.91Å; L738-L826 HydrophobicContact CD1-CD1 3.4Å; L738-L826 VanDerWaalsContact CD1-CD1 3.4Å; L738-L826 HydrophobicContact CD1-CG 4.3Å; I741-L826 HydrophobicContact CD1-CD1 4.2Å; L742-L826 HydrophobicContact CD1-CD1 4.31Å; L742-L826 HydrophobicContact CD2-CD1 3.86Å; L742-L826 HydrophobicContact CG-CD1 4.23Å; M822-L826 WeakPolarHBondContact O-CB 3.34Å; M822-L826 WeakPolarHBondContact O-CG 3.42Å; M822-L826 PolarHBondContact O-N 3.34Å; M823-L826 PolarHBondContact O-N 3.02Å; A824-L826 VanDerWaalsContact C-N 3.32Å; A824-L826 PolarHBondContact O-N 3.15Å; L826-M828 VanDerWaalsContact C-N 3.29Å; L826-M828 PolarHBondContact O-N 2.85Å; L826-D829 PolarHBondContact O-N 3.08Å; L826-Q831 PolarHBondContact O-NE2 2.76Å; L826-V834 HydrophobicContact CD2-CB 4.11Å; L826-V834 HydrophobicContact CD2-CG1 3.93Å; L826-V834 HydrophobicContact CD2-CG2 3.96Å; L826-V834 HydrophobicContact CG-CG1 4.26Å; L826-V834 HydrophobicContact CG-CG2 4.02Å; L826-L942 HydrophobicContact CD2-CD2 3.59Å; L826-L945 HydrophobicContact CB-CD2 4.4Å; L826-L945 HydrophobicContact CD1-CD2 4.16Å; L826-L945 HydrophobicContact CD2-CD2 4.3Å; L826-F950 WeakPolarHBondContact O-CZ 3.36Å
827	K	88.8	Confident	88.2	Confident	66 Å²	66	16.7 Å²	16.7	29%	0.287	8%	0.082	S	C	.	.	H	α-helix	trans	-70.1	-22	174.2	-74.5	165	172.8	173	0	113.7	F645 A772 M823 A824 F950	F645-K827 HydrophobicContact CB-CB 4.03Å; F645-K827 HydrophobicContact CB-CG 4.03Å; F645-K827 HydrophobicContact CD1-CG 4.46Å; F645-K827 HydrophobicContact CD2-CG 4.2Å; F645-K827 HydrophobicContact CG-CB 4.44Å; F645-K827 HydrophobicContact CG-CG 3.99Å; A772-K827 HydrophobicContact CB-CB 4.29Å; A772-K827 WeakPolarHBondContact O-CD 3.45Å; A772-K827 PolarHBondContact O-NZ 2.61Å; A772-K827 VanDerWaalsContact O-NZ 3.15Å; M823-K827 HydrophobicContact CG-CD 4.39Å; M823-K827 WeakPolarHBondContact O-CB 3.29Å; M823-K827 VanDerWaalsContact O-CG 3.26Å; M823-K827 WeakPolarHBondContact O-CG 3.45Å; M823-K827 PolarHBondContact O-N 3.49Å; A824-K827 WeakPolarHBondContact O-CB 3.46Å; A824-K827 PolarHBondContact O-N 3.45Å; A824-K827 VanDerWaalsContact O-N 3.08Å; K827-F950 WeakPolarHBondContact O-CZ 3.23Å
828	M	86.1	Confident	88.4	Confident	17 Å²	17	16.3 Å²	16.3	8%	0.084	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	6.6	176.5	-66	172.9	70.6	0	0	113.7	V763 A768 F769 A772 A824 L825 L826 C830	V763-M828 HydrophobicContact CG1-CE 4.12Å; A768-M828 HydrophobicContact CB-CE 3.87Å; F769-M828 VanDerWaalsContact CA-SD 3.55Å; F769-M828 HydrophobicContact CB-CE 4.16Å; F769-M828 HydrophobicContact CB-SD 3.99Å; F769-M828 HydrophobicContact CD2-SD 3.91Å; F769-M828 HydrophobicContact CG-SD 4.46Å; A772-M828 HydrophobicContact CB-CG 3.76Å; A772-M828 HydrophobicContact CB-SD 4.15Å; A824-M828 WeakPolarHBondContact O-CG 3.38Å; A824-M828 PolarHBondContact O-N 2.9Å; L825-M828 PolarHBondContact O-N 3.03Å; L826-M828 VanDerWaalsContact C-N 3.29Å; L826-M828 PolarHBondContact O-N 2.85Å; M828-C830 PolarHBondContact O-N 3.47Å
829	D	84.9	Confident	88.7	Confident	34 Å²	34	15.7 Å²	15.7	18%	0.182	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	19.8	-171.5	-161.4	31	0	0	0	115.2	P643 L826 Q831 R946 F950	P643-D829 HydrophobicContact CG-CB 3.94Å; L826-D829 PolarHBondContact O-N 3.08Å; D829-Q831 PolarHBondContact O-N 3.34Å; D829-Q831 WeakPolarHBondContact OD1-CG 3.35Å; D829-R946 VanDerWaalsContact CG-NE 3.29Å; D829-R946 WeakPolarHBondContact OD1-CD 3.38Å; D829-R946 VanDerWaalsContact OD1-CG 3.3Å; D829-R946 WeakPolarHBondContact OD1-CG 3.39Å; D829-R946 IonicContact OD1-CZ 3.45Å; D829-R946 IonicContact OD1-NE 3.15Å; D829-R946 PolarHBondContact OD1-NE 2.96Å; D829-R946 IonicContact OD1-NH2 2.71Å; D829-R946 IonicContact OD2-CZ 2.99Å; D829-R946 VanDerWaalsContact OD2-CZ 3.25Å; D829-R946 IonicContact OD2-NE 2.75Å; D829-R946 PolarHBondContact OD2-NE 3.32Å; D829-R946 IonicContact OD2-NH2 2.73Å; D829-R946 PolarHBondContact OD2-NH2 3.29Å; D829-F950 HydrophobicContact CB-CD2 4.1Å; D829-F950 HydrophobicContact CB-CE1 4.28Å; D829-F950 HydrophobicContact CB-CE2 3.8Å; D829-F950 HydrophobicContact CB-CG 4.49Å; D829-F950 HydrophobicContact CB-CZ 3.88Å
830	C	86.3	Confident	88.7	Confident	31 Å²	31	15 Å²	15	21%	0.209	8%	0.077	C	C	.	.			trans	-78.1	42	178	-54.5	0	0	0	0	112.9	L825 M828 G832 L833 V834	L825-C830 HydrophobicContact CB-CB 4.16Å; L825-C830 HydrophobicContact CD2-CB 4.35Å; L825-C830 WeakPolarHBondContact O-CA 3.49Å; L825-C830 VanDerWaalsContact O-CB 3.29Å; L825-C830 WeakPolarHBondContact O-CB 3.19Å; L825-C830 PolarHBondContact O-N 2.81Å; M828-C830 PolarHBondContact O-N 3.47Å; C830-G832 VanDerWaalsContact C-N 3.26Å; C830-G832 PolarHBondContact O-N 2.62Å; C830-L833 HydrophobicContact CB-CB 4.19Å; C830-L833 HydrophobicContact CB-CD2 4.4Å; C830-L833 PolarHBondContact O-N 3.08Å; C830-L833 VanDerWaalsContact O-N 3.11Å; C830-V834 PolarHBondContact O-N 3.17Å
831	Q	85.5	Confident	88.8	Confident	3 Å²	3	13.9 Å²	13.9	1%	0.014	7%	0.072	C	C	.	.	H	α-helix	trans	-54.5	-38.2	-174.3	-53.1	-65.8	-37.2	0	0	112.9	L623 L826 D829 V834 A835 R946	L623-Q831 HydrophobicContact CD1-CB 4.32Å; L826-Q831 PolarHBondContact O-NE2 2.76Å; D829-Q831 PolarHBondContact O-N 3.34Å; D829-Q831 WeakPolarHBondContact OD1-CG 3.35Å; Q831-V834 PolarHBondContact O-N 2.87Å; Q831-A835 PolarHBondContact O-N 2.86Å; Q831-R946 HydrophobicContact CG-CB 4.18Å; Q831-R946 HydrophobicContact CG-CG 4.26Å
832	G	84.7	Confident	88.8	Confident	8 Å²	8	13.9 Å²	13.9	8%	0.082	7%	0.072	C	C	.	.	H	α-helix	trans	-69	-40	178.5	0	0	0	0	0	114	C830 V834 A835 K836	C830-G832 VanDerWaalsContact C-N 3.26Å; C830-G832 PolarHBondContact O-N 2.62Å; G832-V834 VanDerWaalsContact C-N 3.33Å; G832-A835 PolarHBondContact O-N 2.86Å; G832-K836 PolarHBondContact O-N 3.23Å
833	L	86	Confident	88.8	Confident	13 Å²	13	13.9 Å²	13.9	7%	0.068	7%	0.072	C	C	.	.	H	α-helix	trans	-65	-40.1	173.9	172.5	58.3	0	0	0	110.7	V758 N762 V763 L825 C830 K836 L837	V758-L833 HydrophobicContact CG1-CD1 3.53Å; N762-L833 HydrophobicContact CB-CD1 4.27Å; N762-L833 HydrophobicContact CB-CD2 4.08Å; V763-L833 HydrophobicContact CG2-CD2 4.09Å; L825-L833 HydrophobicContact CD1-CD2 4.04Å; L825-L833 HydrophobicContact CD1-CG 4.17Å; L825-L833 HydrophobicContact CD2-CD2 3.86Å; C830-L833 HydrophobicContact CB-CB 4.19Å; C830-L833 HydrophobicContact CB-CD2 4.4Å; C830-L833 PolarHBondContact O-N 3.08Å; C830-L833 VanDerWaalsContact O-N 3.11Å; L833-K836 PolarHBondContact O-N 3.4Å; L833-L837 HydrophobicContact CD1-CD1 3.88Å; L833-L837 HydrophobicContact CD1-CG 4.01Å; L833-L837 HydrophobicContact CG-CD1 4.06Å; L833-L837 WeakPolarHBondContact O-CB 3.33Å; L833-L837 WeakPolarHBondContact O-CG 3.33Å; L833-L837 PolarHBondContact O-N 3.38Å
834	V	90	Very high	88.7	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-63.2	-43.5	173.1	171.7	0	0	0	0	111.4	M822 L825 L826 C830 Q831 G832 K836 L837 V838 L938 L942	M822-V834 HydrophobicContact SD-CB 4.22Å; M822-V834 HydrophobicContact SD-CG1 3.77Å; M822-V834 HydrophobicContact SD-CG2 4.07Å; L825-V834 HydrophobicContact CB-CG2 3.53Å; L825-V834 HydrophobicContact CD1-CG2 4.31Å; L826-V834 HydrophobicContact CD2-CB 4.11Å; L826-V834 HydrophobicContact CD2-CG1 3.93Å; L826-V834 HydrophobicContact CD2-CG2 3.96Å; L826-V834 HydrophobicContact CG-CG1 4.26Å; L826-V834 HydrophobicContact CG-CG2 4.02Å; C830-V834 PolarHBondContact O-N 3.17Å; Q831-V834 PolarHBondContact O-N 2.87Å; G832-V834 VanDerWaalsContact C-N 3.33Å; V834-K836 VanDerWaalsContact C-N 3.35Å; V834-K836 PolarHBondContact O-N 2.85Å; V834-L837 PolarHBondContact O-N 3.24Å; V834-V838 HydrophobicContact CG1-CG2 4.14Å; V834-V838 VanDerWaalsContact O-CB 3.28Å; V834-V838 WeakPolarHBondContact O-CB 3.46Å; V834-V838 WeakPolarHBondContact O-CG2 3.5Å; V834-V838 PolarHBondContact O-N 2.92Å; V834-L938 HydrophobicContact CG1-CD2 4.34Å; V834-L942 HydrophobicContact CG1-CD2 4.25Å
835	A	89.9	Confident	88.6	Confident	1 Å²	1	13 Å²	13	1%	0.008	7%	0.068	C	C	.	.	H	α-helix	trans	-61.5	-40.2	175.7	0	0	0	0	0	112.8	Q831 G832 L839 Y907 L942	Q831-A835 PolarHBondContact O-N 2.86Å; G832-A835 PolarHBondContact O-N 2.86Å; A835-L839 PolarHBondContact O-N 3.46Å; A835-L839 VanDerWaalsContact O-N 3.08Å; A835-Y907 HydrophobicContact CB-CD1 4.48Å; A835-Y907 HydrophobicContact CB-CD2 4.08Å; A835-Y907 HydrophobicContact CB-CG 4.06Å; A835-L942 HydrophobicContact CB-CD1 3.93Å
836	K	87.6	Confident	88.6	Confident	46 Å²	46	13 Å²	13	20%	0.2	7%	0.068	C	C	.	.	H	α-helix	trans	-62.3	-56.6	174	-178.5	175.7	176.1	178.5	0	111.4	V628 V758 G832 L833 V834 V838 L839 D840 Y907	V628-K836 HydrophobicContact CG1-CD 4.3Å; V758-K836 HydrophobicContact CG1-CD 4.46Å; G832-K836 PolarHBondContact O-N 3.23Å; L833-K836 PolarHBondContact O-N 3.4Å; V834-K836 VanDerWaalsContact C-N 3.35Å; V834-K836 PolarHBondContact O-N 2.85Å; K836-V838 VanDerWaalsContact C-N 3.34Å; K836-V838 PolarHBondContact O-N 2.78Å; K836-L839 PolarHBondContact O-N 3.07Å; K836-L839 VanDerWaalsContact O-N 3.1Å; K836-D840 VanDerWaalsContact O-CG 3.3Å; K836-D840 PolarHBondContact O-N 3.29Å; K836-Y907 HydrophobicContact CB-CE1 4.16Å
837	L	90.1	Very high	88.5	Confident	2 Å²	2	13 Å²	13	1%	0.01	7%	0.068	C	C	.	.	H	α-helix	trans	-61	-39.1	-179.4	-68.4	171.4	0	0	0	112.5	V755 V758 L759 M822 L825 L833 V834 D840 F841	V755-L837 HydrophobicContact CG2-CD2 4.42Å; V758-L837 HydrophobicContact CB-CD2 4.42Å; V758-L837 HydrophobicContact CG1-CD2 4.19Å; L759-L837 HydrophobicContact CD1-CD1 3.99Å; M822-L837 HydrophobicContact CE-CB 3.5Å; M822-L837 HydrophobicContact CE-CD1 4.41Å; M822-L837 HydrophobicContact SD-CB 4.38Å; L825-L837 HydrophobicContact CD1-CD1 3.82Å; L833-L837 HydrophobicContact CD1-CD1 3.88Å; L833-L837 HydrophobicContact CD1-CG 4.01Å; L833-L837 HydrophobicContact CG-CD1 4.06Å; L833-L837 WeakPolarHBondContact O-CB 3.33Å; L833-L837 WeakPolarHBondContact O-CG 3.33Å; L833-L837 PolarHBondContact O-N 3.38Å; V834-L837 PolarHBondContact O-N 3.24Å; L837-D840 PolarHBondContact O-N 3.11Å; L837-F841 HydrophobicContact CB-CE1 4.43Å; L837-F841 HydrophobicContact CB-CZ 4.38Å; L837-F841 HydrophobicContact CD2-CE1 4.35Å; L837-F841 WeakPolarHBondContact O-CB 3.44Å; L837-F841 WeakPolarHBondContact O-CD1 3.31Å; L837-F841 WeakPolarHBondContact O-CG 3.35Å; L837-F841 PolarHBondContact O-N 3.41Å
838	V	91.5	Very high	88.4	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.2	-38.6	175.5	169.2	0	0	0	0	111.4	M822 V834 K836 V842 A935 L938 V939	M822-V838 HydrophobicContact CE-CG2 3.79Å; M822-V838 HydrophobicContact SD-CG2 4.09Å; V834-V838 HydrophobicContact CG1-CG2 4.14Å; V834-V838 VanDerWaalsContact O-CB 3.28Å; V834-V838 WeakPolarHBondContact O-CB 3.46Å; V834-V838 WeakPolarHBondContact O-CG2 3.5Å; V834-V838 PolarHBondContact O-N 2.92Å; K836-V838 VanDerWaalsContact C-N 3.34Å; K836-V838 PolarHBondContact O-N 2.78Å; V838-V842 HydrophobicContact CG1-CG2 4.48Å; V838-V842 VanDerWaalsContact O-CB 3.29Å; V838-V842 WeakPolarHBondContact O-CB 3.45Å; V838-V842 VanDerWaalsContact O-CG2 3.24Å; V838-V842 WeakPolarHBondContact O-CG2 3.2Å; V838-V842 PolarHBondContact O-N 3.21Å; V838-A935 HydrophobicContact CG1-CB 4.11Å; V838-L938 HydrophobicContact CG2-CD1 3.96Å; V838-L938 HydrophobicContact CG2-CD2 4.17Å; V838-V939 HydrophobicContact CB-CG2 4.46Å; V838-V939 HydrophobicContact CG1-CG2 3.86Å
839	L	90.7	Very high	88.4	Confident	2 Å²	2	16.9 Å²	16.9	1%	0.01	9%	0.091	C	C	.	.	H	α-helix	trans	-64.8	-49.4	173.1	175.2	62.1	0	0	0	111.4	A835 K836 F841 V842 L843 Y907 V910 I911	A835-L839 PolarHBondContact O-N 3.46Å; A835-L839 VanDerWaalsContact O-N 3.08Å; K836-L839 PolarHBondContact O-N 3.07Å; K836-L839 VanDerWaalsContact O-N 3.1Å; L839-F841 VanDerWaalsContact C-N 3.28Å; L839-F841 PolarHBondContact O-N 3.04Å; L839-V842 PolarHBondContact O-N 2.83Å; L839-V842 VanDerWaalsContact O-N 3.08Å; L839-L843 HydrophobicContact CD1-CD1 3.93Å; L839-L843 HydrophobicContact CD1-CD2 4.21Å; L839-L843 HydrophobicContact CD1-CG 3.83Å; L839-L843 HydrophobicContact CD2-CD1 4.46Å; L839-L843 HydrophobicContact CG-CD1 3.89Å; L839-L843 HydrophobicContact CG-CG 4.23Å; L839-L843 WeakPolarHBondContact O-CG 3.48Å; L839-L843 PolarHBondContact O-N 2.84Å; L839-Y907 HydrophobicContact CB-CD1 3.9Å; L839-Y907 HydrophobicContact CB-CE1 4.48Å; L839-Y907 HydrophobicContact CD2-CD1 3.63Å; L839-Y907 HydrophobicContact CD2-CE1 4Å; L839-Y907 HydrophobicContact CG-CD1 4.39Å; L839-V910 HydrophobicContact CD1-CB 4.12Å; L839-V910 HydrophobicContact CD1-CG1 3.58Å; L839-V910 HydrophobicContact CD2-CB 4.48Å; L839-V910 HydrophobicContact CD2-CG1 4.29Å; L839-V910 HydrophobicContact CD2-CG2 4.49Å; L839-I911 HydrophobicContact CD1-CD1 4.46Å; L839-I911 HydrophobicContact CD1-CG1 3.88Å
840	D	87.9	Confident	88.4	Confident	34 Å²	34	15.5 Å²	15.5	18%	0.182	8%	0.084	C	C	.	.	H	α-helix	trans	-58.7	-42.3	-179	-62.8	-25.3	0	0	0	111	K836 L837 L843 L844	K836-D840 VanDerWaalsContact O-CG 3.3Å; K836-D840 PolarHBondContact O-N 3.29Å; L837-D840 PolarHBondContact O-N 3.11Å; D840-L843 PolarHBondContact O-N 2.87Å; D840-L844 WeakPolarHBondContact O-CB 3.25Å; D840-L844 PolarHBondContact O-N 3.47Å
841	F	90.3	Very high	88.3	Confident	6 Å²	6	15.2 Å²	15.2	3%	0.026	8%	0.083	C	C	.	.	H	α-helix	trans	-66.3	-40.7	175.3	-65.2	4.4	0	0	0	111.7	L748 T749 Y750 V755 Q818 M822 L837 L839 L844 T845	L748-F841 HydrophobicContact CB-CB 3.91Å; L748-F841 HydrophobicContact CB-CD2 4.45Å; L748-F841 HydrophobicContact CD1-CB 4Å; L748-F841 HydrophobicContact CD1-CD2 4.49Å; T749-F841 WeakPolarHBondContact O-CA 3.49Å; Y750-F841 VanDerWaalsContact CB-CE1 3.48Å; Y750-F841 HydrophobicContact CG-CZ 4.37Å; V755-F841 HydrophobicContact CG2-CE1 3.48Å; V755-F841 VanDerWaalsContact CG2-CE1 3.48Å; V755-F841 HydrophobicContact CG2-CZ 3.58Å; Q818-F841 HydrophobicContact CB-CE2 4.44Å; Q818-F841 HydrophobicContact CG-CE2 3.97Å; Q818-F841 VanDerWaalsContact NE2-CD2 3.34Å; M822-F841 HydrophobicContact CE-CD2 3.86Å; M822-F841 HydrophobicContact CE-CE2 3.39Å; M822-F841 HydrophobicContact CE-CZ 3.99Å; L837-F841 HydrophobicContact CB-CE1 4.43Å; L837-F841 HydrophobicContact CB-CZ 4.38Å; L837-F841 HydrophobicContact CD2-CE1 4.35Å; L837-F841 WeakPolarHBondContact O-CB 3.44Å; L837-F841 WeakPolarHBondContact O-CD1 3.31Å; L837-F841 WeakPolarHBondContact O-CG 3.35Å; L837-F841 PolarHBondContact O-N 3.41Å; L839-F841 VanDerWaalsContact C-N 3.28Å; L839-F841 PolarHBondContact O-N 3.04Å; F841-L844 PolarHBondContact O-N 3.24Å; F841-T845 WeakPolarHBondContact O-CB 3.27Å; F841-T845 PolarHBondContact O-N 2.96Å; F841-T845 PolarHBondContact O-OG1 2.83Å
842	V	91.6	Very high	88.2	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-63.7	-43.2	176.3	158.3	0	0	0	0	111.6	L748 V838 L839 T846 I911 L914 W929 L932 A935	L748-V842 HydrophobicContact CD1-CG2 4.33Å; L748-V842 HydrophobicContact CD2-CG2 4.29Å; V838-V842 HydrophobicContact CG1-CG2 4.48Å; V838-V842 VanDerWaalsContact O-CB 3.29Å; V838-V842 WeakPolarHBondContact O-CB 3.45Å; V838-V842 VanDerWaalsContact O-CG2 3.24Å; V838-V842 WeakPolarHBondContact O-CG2 3.2Å; V838-V842 PolarHBondContact O-N 3.21Å; L839-V842 PolarHBondContact O-N 2.83Å; L839-V842 VanDerWaalsContact O-N 3.08Å; V842-T846 WeakPolarHBondContact O-CB 3.45Å; V842-T846 PolarHBondContact O-N 3.05Å; V842-T846 PolarHBondContact O-OG1 2.85Å; V842-I911 HydrophobicContact CG1-CG1 4.43Å; V842-L914 HydrophobicContact CG1-CD2 3.71Å; V842-W929 HydrophobicContact CG1-CH2 4.34Å; V842-L932 HydrophobicContact CG1-CD1 3.53Å; V842-L932 HydrophobicContact CG2-CD1 4.37Å; V842-A935 HydrophobicContact CG2-CB 3.66Å
843	L	90.7	Very high	88.3	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-45.2	177.5	-66.2	171.8	0	0	0	110.9	L839 D840 T846 A847 Y893 L896 L897 W899 A900 L914	L839-L843 HydrophobicContact CD1-CD1 3.93Å; L839-L843 HydrophobicContact CD1-CD2 4.21Å; L839-L843 HydrophobicContact CD1-CG 3.83Å; L839-L843 HydrophobicContact CD2-CD1 4.46Å; L839-L843 HydrophobicContact CG-CD1 3.89Å; L839-L843 HydrophobicContact CG-CG 4.23Å; L839-L843 WeakPolarHBondContact O-CG 3.48Å; L839-L843 PolarHBondContact O-N 2.84Å; D840-L843 PolarHBondContact O-N 2.87Å; L843-T846 PolarHBondContact O-N 3.42Å; L843-A847 PolarHBondContact O-N 3.46Å; L843-Y893 HydrophobicContact CB-CE2 4.19Å; L843-L896 HydrophobicContact CD2-CB 4.15Å; L843-L897 HydrophobicContact CD1-CD2 4.18Å; L843-W899 HydrophobicContact CD2-CZ3 4.39Å; L843-A900 HydrophobicContact CD1-CB 3.78Å; L843-A900 HydrophobicContact CD2-CB 4.06Å; L843-L914 HydrophobicContact CD2-CD2 3.95Å
844	L	88.9	Confident	88.4	Confident	6 Å²	6	20.8 Å²	20.8	3%	0.031	11%	0.111	C	C	.	.	H	α-helix	trans	-65.3	-45.6	177.5	-177	63.6	0	0	0	112.5	T749 I751 D840 F841 T846 A847 V848 W889 Y893	T749-L844 HydrophobicContact CG2-CD2 3.88Å; T749-L844 HydrophobicContact CG2-CG 4.04Å; I751-L844 HydrophobicContact CD1-CD1 4.4Å; I751-L844 HydrophobicContact CD1-CD2 4.01Å; I751-L844 HydrophobicContact CG1-CD2 3.73Å; D840-L844 WeakPolarHBondContact O-CB 3.25Å; D840-L844 PolarHBondContact O-N 3.47Å; F841-L844 PolarHBondContact O-N 3.24Å; L844-T846 VanDerWaalsContact C-N 3.25Å; L844-T846 PolarHBondContact O-N 2.93Å; L844-A847 WeakPolarHBondContact O-CB 3.33Å; L844-A847 PolarHBondContact O-N 2.92Å; L844-V848 WeakPolarHBondContact O-CG2 3.44Å; L844-V848 PolarHBondContact O-N 3.11Å; L844-W889 HydrophobicContact CD1-CE3 4.16Å; L844-W889 HydrophobicContact CD1-CZ3 3.99Å; L844-Y893 HydrophobicContact CB-CD2 4.08Å; L844-Y893 HydrophobicContact CB-CE2 3.66Å; L844-Y893 HydrophobicContact CD1-CD1 4.44Å; L844-Y893 HydrophobicContact CD1-CD2 3.93Å; L844-Y893 HydrophobicContact CD1-CE2 4.02Å; L844-Y893 HydrophobicContact CD1-CG 4.14Å; L844-Y893 HydrophobicContact CG-CE2 4.43Å
845	T	89.3	Confident	88.3	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.018	13%	0.13	C	C	.	.	H	α-helix	trans	-60.3	-40.2	176.1	-47.1	0	0	0	0	110.5	L748 T749 F841 V848 E849 W929	L748-T845 WeakPolarHBondContact CA-OG1 3.34Å; T749-T845 PolarHBondContact N-OG1 3.47Å; F841-T845 WeakPolarHBondContact O-CB 3.27Å; F841-T845 PolarHBondContact O-N 2.96Å; F841-T845 PolarHBondContact O-OG1 2.83Å; T845-V848 PolarHBondContact O-N 2.88Å; T845-E849 HydrophobicContact CG2-CG 4.23Å; T845-E849 WeakPolarHBondContact O-CB 3.2Å; T845-E849 WeakPolarHBondContact O-CG 3.36Å; T845-E849 PolarHBondContact O-N 3.37Å; T845-W929 HydrophobicContact CG2-CH2 4.32Å; T845-W929 HydrophobicContact CG2-CZ2 3.43Å; T845-W929 VanDerWaalsContact CG2-CZ2 3.43Å
846	T	89.8	Confident	88.3	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-45.4	175.7	-54	0	0	0	0	111.2	V842 L843 L844 V848 E849 V850 L857 L896 L914 L918 W929	V842-T846 WeakPolarHBondContact O-CB 3.45Å; V842-T846 PolarHBondContact O-N 3.05Å; V842-T846 PolarHBondContact O-OG1 2.85Å; L843-T846 PolarHBondContact O-N 3.42Å; L844-T846 VanDerWaalsContact C-N 3.25Å; L844-T846 PolarHBondContact O-N 2.93Å; T846-V848 VanDerWaalsContact C-N 3.3Å; T846-V848 PolarHBondContact O-N 3.29Å; T846-E849 PolarHBondContact O-N 3Å; T846-V850 HydrophobicContact CG2-CG2 3.78Å; T846-V850 WeakPolarHBondContact O-CB 3.34Å; T846-V850 WeakPolarHBondContact O-CG2 3.49Å; T846-V850 PolarHBondContact O-N 3Å; T846-L857 HydrophobicContact CG2-CD2 3.89Å; T846-L896 HydrophobicContact CG2-CD1 3.84Å; T846-L914 HydrophobicContact CG2-CD1 4.19Å; T846-L918 HydrophobicContact CG2-CD1 3.93Å; T846-L918 HydrophobicContact CG2-CD2 3.92Å; T846-L918 HydrophobicContact CG2-CG 4.37Å; T846-W929 WeakPolarHBondContact OG1-CH2 3.34Å; T846-W929 VanDerWaalsContact OG1-CZ3 3.25Å; T846-W929 WeakPolarHBondContact OG1-CZ3 3.38Å
847	A	88.4	Confident	88.3	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59	-40.8	178.9	0	0	0	0	0	112.4	L843 L844 A851 W889 A892 Y893 L896	L843-A847 PolarHBondContact O-N 3.46Å; L844-A847 WeakPolarHBondContact O-CB 3.33Å; L844-A847 PolarHBondContact O-N 2.92Å; A847-A851 WeakPolarHBondContact O-CA 3.44Å; A847-A851 PolarHBondContact O-N 3.35Å; A847-W889 WeakPolarHBondContact O-CB 3.4Å; A847-A892 HydrophobicContact CB-CB 4.02Å; A847-Y893 HydrophobicContact CB-CD2 4.22Å; A847-Y893 HydrophobicContact CB-CG 4.42Å; A847-L896 HydrophobicContact CB-CD1 4.18Å
848	V	86.6	Confident	88.2	Confident	62 Å²	62	25.7 Å²	25.7	38%	0.376	13%	0.13	S	C	.	.	H	α-helix	trans	-73.8	-45.2	178.4	175.6	0	0	0	0	112.5	T749 L844 T845 T846 V850 W889	T749-V848 HydrophobicContact CG2-CG2 4.47Å; L844-V848 WeakPolarHBondContact O-CG2 3.44Å; L844-V848 PolarHBondContact O-N 3.11Å; T845-V848 PolarHBondContact O-N 2.88Å; T846-V848 VanDerWaalsContact C-N 3.3Å; T846-V848 PolarHBondContact O-N 3.29Å; V848-V850 VanDerWaalsContact C-N 3.31Å; V848-V850 PolarHBondContact O-N 3.24Å; V848-W889 HydrophobicContact CG2-CB 4.07Å; V848-W889 HydrophobicContact CG2-CD2 4.28Å; V848-W889 HydrophobicContact CG2-CE3 4.49Å; V848-W889 HydrophobicContact CG2-CG 4.11Å
849	E	85.8	Confident	88.1	Confident	103 Å²	103	30 Å²	30	48%	0.481	15%	0.15	S	C	.	.	H	α-helix	trans	-66.5	-30.6	177.6	-77.8	-84.7	164.2	0	0	113.1	T845 T846 I925	T845-E849 HydrophobicContact CG2-CG 4.23Å; T845-E849 WeakPolarHBondContact O-CB 3.2Å; T845-E849 WeakPolarHBondContact O-CG 3.36Å; T845-E849 PolarHBondContact O-N 3.37Å; T846-E849 PolarHBondContact O-N 3Å; E849-I925 HydrophobicContact CB-CG2 4.44Å
850	V	85.3	Confident	88	Confident	5 Å²	5	33.1 Å²	33.1	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-87.6	-40	-178.9	177.4	0	0	0	0	111.4	T846 V848 S852 R853 W854 L857 L918 I925	T846-V850 HydrophobicContact CG2-CG2 3.78Å; T846-V850 WeakPolarHBondContact O-CB 3.34Å; T846-V850 WeakPolarHBondContact O-CG2 3.49Å; T846-V850 PolarHBondContact O-N 3Å; V848-V850 VanDerWaalsContact C-N 3.31Å; V848-V850 PolarHBondContact O-N 3.24Å; V850-S852 PolarHBondContact O-N 3.2Å; V850-S852 VanDerWaalsContact O-N 3.16Å; V850-R853 HydrophobicContact CG1-CB 4.09Å; V850-R853 WeakPolarHBondContact O-CB 3.16Å; V850-R853 PolarHBondContact O-N 3.09Å; V850-W854 VanDerWaalsContact CG1-CA 3.44Å; V850-W854 HydrophobicContact CG1-CB 4.02Å; V850-L857 HydrophobicContact CG1-CB 4.25Å; V850-L857 HydrophobicContact CG1-CD2 4.28Å; V850-L857 HydrophobicContact CG2-CD2 3.98Å; V850-L918 HydrophobicContact CG2-CD2 3.69Å; V850-I925 HydrophobicContact CB-CD1 4.32Å; V850-I925 HydrophobicContact CG2-CD1 3.64Å
851	A	84.6	Confident	87.9	Confident	25 Å²	25	32.9 Å²	32.9	21%	0.207	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	36.4	-113	177.2	0	0	0	0	0	113.8	A847 R853 W854	A847-A851 WeakPolarHBondContact O-CA 3.44Å; A847-A851 PolarHBondContact O-N 3.35Å; A851-R853 PolarHBondContact O-N 3.4Å; A851-W854 WeakPolarHBondContact O-CB 3.3Å; A851-W854 VanDerWaalsContact O-CD1 3.29Å; A851-W854 PolarHBondContact O-N 2.83Å
852	S	82.1	Confident	87.6	Confident	65 Å²	65	35 Å²	35	46%	0.455	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-58	-19	-176.8	59.6	0	0	0	0	114.9	V850	V850-S852 PolarHBondContact O-N 3.2Å; V850-S852 VanDerWaalsContact O-N 3.16Å
853	R	86.7	Confident	87.3	Confident	72 Å²	72	45.8 Å²	45.8	27%	0.272	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-90.8	4.5	178	-63.7	178.1	59.7	-153.3	-2.2	114.3	V850 A851 R855 E856 L857 N923	V850-R853 HydrophobicContact CG1-CB 4.09Å; V850-R853 WeakPolarHBondContact O-CB 3.16Å; V850-R853 PolarHBondContact O-N 3.09Å; A851-R853 PolarHBondContact O-N 3.4Å; R853-R855 PolarHBondContact O-N 3.09Å; R853-R855 VanDerWaalsContact O-N 3.11Å; R853-E856 IonicContact CZ-OE2 3.26Å; R853-E856 VanDerWaalsContact CZ-OE2 3.26Å; R853-E856 IonicContact NE-OE2 3.65Å; R853-E856 PolarHBondContact NE-OE2 3.48Å; R853-E856 IonicContact NH2-OE1 3.53Å; R853-E856 IonicContact NH2-OE2 2.71Å; R853-E856 PolarHBondContact NH2-OE2 3.02Å; R853-E856 VanDerWaalsContact O-CB 3.28Å; R853-E856 WeakPolarHBondContact O-CB 3.3Å; R853-E856 PolarHBondContact O-N 3.34Å; R853-L857 PolarHBondContact O-N 3.32Å; R853-N923 PolarHBondContact NH1-O 3.27Å; R853-N923 PolarHBondContact NH2-O 3.17Å
854	W	88.3	Confident	87.1	Confident	3 Å²	3	46.6 Å²	46.6	1%	0.011	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-28.8	-172.1	81.4	-96	0	0	0	113.6	V850 A851 E856 L857 A858 M869 Y872 E873 P891 A892 F895	V850-W854 VanDerWaalsContact CG1-CA 3.44Å; V850-W854 HydrophobicContact CG1-CB 4.02Å; A851-W854 WeakPolarHBondContact O-CB 3.3Å; A851-W854 VanDerWaalsContact O-CD1 3.29Å; A851-W854 PolarHBondContact O-N 2.83Å; W854-E856 VanDerWaalsContact C-N 3.32Å; W854-E856 PolarHBondContact O-N 2.91Å; W854-L857 WeakPolarHBondContact O-CB 3.41Å; W854-L857 PolarHBondContact O-N 3.14Å; W854-L857 VanDerWaalsContact O-N 3.11Å; W854-A858 HydrophobicContact CE3-CB 3.99Å; W854-A858 HydrophobicContact CZ3-CB 3.93Å; W854-A858 WeakPolarHBondContact O-CB 3.47Å; W854-A858 PolarHBondContact O-N 3.22Å; W854-M869 HydrophobicContact CH2-CB 3.82Å; W854-M869 HydrophobicContact CH2-CG 4.04Å; W854-M869 HydrophobicContact CZ2-CB 4.22Å; W854-M869 HydrophobicContact CZ3-CG 4.36Å; W854-Y872 HydrophobicContact CH2-CD2 4.35Å; W854-Y872 HydrophobicContact CH2-CG 4.46Å; W854-E873 HydrophobicContact CZ2-CG 3.91Å; W854-E873 WeakPolarHBondContact CZ2-OE1 3.28Å; W854-P891 HydrophobicContact CZ2-CB 3.89Å; W854-A892 HydrophobicContact CB-CB 3.36Å; W854-A892 HydrophobicContact CD2-CB 4.23Å; W854-A892 HydrophobicContact CG-CB 3.6Å; W854-F895 HydrophobicContact CE3-CB 4.14Å; W854-F895 HydrophobicContact CE3-CD1 4.11Å; W854-F895 HydrophobicContact CE3-CG 4.2Å; W854-F895 HydrophobicContact CZ3-CB 3.75Å; W854-F895 HydrophobicContact CZ3-CD1 4.2Å; W854-F895 HydrophobicContact CZ3-CD2 4.48Å; W854-F895 AromaticContact CZ3-CG 3.85Å; W854-F895 HydrophobicContact CZ3-CG 3.85Å
855	R	88.8	Confident	86.8	Confident	107 Å²	107	48.5 Å²	48.5	40%	0.404	24%	0.24	S	C	.	.	H	α-helix	trans	-56.9	-41	171.5	-59.2	-177.3	-172	123.1	-8	112.6	R853 E859 M869 E873	R853-R855 PolarHBondContact O-N 3.09Å; R853-R855 VanDerWaalsContact O-N 3.11Å; R855-E859 WeakPolarHBondContact O-CB 3.19Å; R855-E859 PolarHBondContact O-N 3.26Å; R855-E859 VanDerWaalsContact O-N 3.12Å; R855-M869 HydrophobicContact CB-CE 4.4Å; R855-M869 HydrophobicContact CB-SD 3.56Å; R855-M869 VanDerWaalsContact CB-SD 3.56Å; R855-M869 HydrophobicContact CG-SD 3.78Å; R855-M869 VanDerWaalsContact O-CE 3.23Å; R855-M869 WeakPolarHBondContact O-CE 3.24Å; R855-E873 IonicContact CZ-OE1 2.71Å; R855-E873 IonicContact CZ-OE2 3.98Å; R855-E873 IonicContact NE-OE1 3.33Å; R855-E873 PolarHBondContact NE-OE1 3.44Å; R855-E873 IonicContact NE-OE2 3Å; R855-E873 IonicContact NH2-OE1 3.15Å; R855-E873 PolarHBondContact NH2-OE1 2.87Å; R855-E873 IonicContact NH2-OE2 3.81Å; R855-E873 PolarHBondContact NH2-OE2 2.99Å
856	E	89.1	Confident	86.6	Confident	44 Å²	44	57.5 Å²	57.5	21%	0.206	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-42.5	174.6	-171.8	-170.9	174.4	0	0	111	R853 W854 K860 M921 R922	R853-E856 IonicContact CZ-OE2 3.26Å; R853-E856 VanDerWaalsContact CZ-OE2 3.26Å; R853-E856 IonicContact NE-OE2 3.65Å; R853-E856 PolarHBondContact NE-OE2 3.48Å; R853-E856 IonicContact NH2-OE1 3.53Å; R853-E856 IonicContact NH2-OE2 2.71Å; R853-E856 PolarHBondContact NH2-OE2 3.02Å; R853-E856 VanDerWaalsContact O-CB 3.28Å; R853-E856 WeakPolarHBondContact O-CB 3.3Å; R853-E856 PolarHBondContact O-N 3.34Å; W854-E856 VanDerWaalsContact C-N 3.32Å; W854-E856 PolarHBondContact O-N 2.91Å; E856-K860 WeakPolarHBondContact O-CG 3.43Å; E856-K860 PolarHBondContact O-N 3.48Å; E856-K860 VanDerWaalsContact O-N 3.1Å; E856-M921 HydrophobicContact CG-CG 4.23Å; E856-M921 HydrophobicContact CG-SD 4.41Å; E856-M921 WeakPolarHBondContact OE1-CA 3.25Å; E856-M921 WeakPolarHBondContact OE1-CB 3.43Å; E856-R922 WeakPolarHBondContact OE1-CB 3.43Å; E856-R922 PolarHBondContact OE1-N 3.35Å
857	L	88.6	Confident	86.2	Confident	2 Å²	2	65 Å²	65	1%	0.01	31%	0.309	C	S	.	.	H	α-helix	trans	-67.7	-44.2	179.3	-178	60.3	0	0	0	111.9	T846 V850 R853 W854 E859 K860 L861 L896 L918 M921	T846-L857 HydrophobicContact CG2-CD2 3.89Å; V850-L857 HydrophobicContact CG1-CB 4.25Å; V850-L857 HydrophobicContact CG1-CD2 4.28Å; V850-L857 HydrophobicContact CG2-CD2 3.98Å; R853-L857 PolarHBondContact O-N 3.32Å; W854-L857 WeakPolarHBondContact O-CB 3.41Å; W854-L857 PolarHBondContact O-N 3.14Å; W854-L857 VanDerWaalsContact O-N 3.11Å; L857-E859 VanDerWaalsContact C-N 3.33Å; L857-E859 PolarHBondContact O-N 2.99Å; L857-K860 PolarHBondContact O-N 2.96Å; L857-K860 VanDerWaalsContact O-N 3.15Å; L857-L861 HydrophobicContact CD1-CD1 3.8Å; L857-L861 HydrophobicContact CD1-CG 3.85Å; L857-L861 HydrophobicContact CD2-CD1 4.28Å; L857-L861 HydrophobicContact CG-CD1 3.72Å; L857-L861 HydrophobicContact CG-CG 4.18Å; L857-L861 WeakPolarHBondContact O-CB 3.48Å; L857-L861 WeakPolarHBondContact O-CG 3.48Å; L857-L861 PolarHBondContact O-N 3.5Å; L857-L896 HydrophobicContact CD2-CD2 4.3Å; L857-L918 HydrophobicContact CD1-CD2 3.85Å; L857-L918 HydrophobicContact CD1-CG 4.03Å; L857-L918 HydrophobicContact CD2-CD2 3.82Å; L857-L918 HydrophobicContact CD2-CG 4.49Å; L857-L918 HydrophobicContact CG-CD2 4.46Å; L857-M921 HydrophobicContact CB-SD 3.97Å; L857-M921 HydrophobicContact CD1-SD 4.24Å
858	A	87.9	Confident	85.8	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-61.3	-40.5	177.9	0	0	0	0	0	112.1	W854 A862 R863 V864 M869 F895	W854-A858 HydrophobicContact CE3-CB 3.99Å; W854-A858 HydrophobicContact CZ3-CB 3.93Å; W854-A858 WeakPolarHBondContact O-CB 3.47Å; W854-A858 PolarHBondContact O-N 3.22Å; A858-A862 PolarHBondContact O-N 2.96Å; A858-R863 PolarHBondContact O-N 3.42Å; A858-V864 HydrophobicContact CB-CB 4.24Å; A858-V864 HydrophobicContact CB-CG2 4.03Å; A858-M869 HydrophobicContact CB-CE 4.13Å; A858-F895 HydrophobicContact CB-CD1 3.96Å; A858-F895 HydrophobicContact CB-CD2 4.37Å; A858-F895 HydrophobicContact CB-CE1 3.58Å; A858-F895 HydrophobicContact CB-CE2 4.04Å; A858-F895 HydrophobicContact CB-CG 4.35Å; A858-F895 HydrophobicContact CB-CZ 3.64Å
859	E	88.3	Confident	85.6	Confident	89 Å²	89	68 Å²	68	42%	0.416	32%	0.319	S	S	.	.	H	α-helix	trans	-61.8	-44.4	172.2	-165.5	-127.9	120.6	0	0	111.7	R855 L857 R863 M869	R855-E859 WeakPolarHBondContact O-CB 3.19Å; R855-E859 PolarHBondContact O-N 3.26Å; R855-E859 VanDerWaalsContact O-N 3.12Å; L857-E859 VanDerWaalsContact C-N 3.33Å; L857-E859 PolarHBondContact O-N 2.99Å; E859-R863 VanDerWaalsContact O-CA 3.29Å; E859-R863 WeakPolarHBondContact O-CA 3.24Å; E859-R863 PolarHBondContact O-N 3.02Å; E859-M869 HydrophobicContact CB-CE 4.19Å
860	K	88.3	Confident	85.5	Confident	68 Å²	68	66.3 Å²	66.3	30%	0.296	31%	0.311	S	S	.	.	H	α-helix	trans	-78.1	-21.2	-178	-61.7	-18.3	-176.5	-161.6	0	114.5	E856 L857 K920	E856-K860 WeakPolarHBondContact O-CG 3.43Å; E856-K860 PolarHBondContact O-N 3.48Å; E856-K860 VanDerWaalsContact O-N 3.1Å; L857-K860 PolarHBondContact O-N 2.96Å; L857-K860 VanDerWaalsContact O-N 3.15Å; K860-K920 HydrophobicContact CB-CB 3.99Å; K860-K920 HydrophobicContact CB-CD 4.35Å; K860-K920 HydrophobicContact CG-CB 4.11Å
861	L	86.1	Confident	85.5	Confident	29 Å²	29	69.2 Å²	69.2	15%	0.152	34%	0.336	C	S	.	.	H	α-helix	trans	-87.7	-47.1	176.7	-79.4	179	0	0	0	112.9	L857 F895 L896 W899 L914	L857-L861 HydrophobicContact CD1-CD1 3.8Å; L857-L861 HydrophobicContact CD1-CG 3.85Å; L857-L861 HydrophobicContact CD2-CD1 4.28Å; L857-L861 HydrophobicContact CG-CD1 3.72Å; L857-L861 HydrophobicContact CG-CG 4.18Å; L857-L861 WeakPolarHBondContact O-CB 3.48Å; L857-L861 WeakPolarHBondContact O-CG 3.48Å; L857-L861 PolarHBondContact O-N 3.5Å; L861-F895 HydrophobicContact CD1-CE1 4.28Å; L861-L896 HydrophobicContact CD1-CD2 4.03Å; L861-W899 HydrophobicContact CD1-CD2 4.05Å; L861-W899 HydrophobicContact CD1-CE3 4.36Å; L861-W899 HydrophobicContact CD1-CZ2 4.17Å; L861-W899 HydrophobicContact CD2-CH2 4.28Å; L861-W899 HydrophobicContact CD2-CZ2 3.65Å; L861-W899 HydrophobicContact CG-CZ2 4.4Å; L861-L914 HydrophobicContact CD1-CD1 3.97Å
862	A	85	Confident	85.4	Confident	52 Å²	52	71.1 Å²	71.1	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-136.8	6.2	-168.4	0	0	0	0	0	114.7	A858 V864 F895	A858-A862 PolarHBondContact O-N 2.96Å; A862-V864 HydrophobicContact CB-CG2 3.89Å; A862-V864 PolarHBondContact O-N 2.84Å; A862-F895 HydrophobicContact CB-CZ 4.48Å
863	R	85.1	Confident	85.6	Confident	226 Å²	226	68.4 Å²	68.4	85%	0.853	32%	0.318	S	S	*	.			trans	53.3	34.5	-177.4	-57	-177.5	179	-176.6	-0.6	113.6	A858 E859	A858-R863 PolarHBondContact O-N 3.42Å; E859-R863 VanDerWaalsContact O-CA 3.29Å; E859-R863 WeakPolarHBondContact O-CA 3.24Å; E859-R863 PolarHBondContact O-N 3.02Å
864	V	85.8	Confident	85.4	Confident	17 Å²	17	67.8 Å²	67.8	10%	0.103	33%	0.328	C	S	.	.			trans	-54.6	136.7	-179.3	-175.3	0	0	0	0	110.3	A858 A862 Q868 M869 F895	A858-V864 HydrophobicContact CB-CB 4.24Å; A858-V864 HydrophobicContact CB-CG2 4.03Å; A862-V864 HydrophobicContact CB-CG2 3.89Å; A862-V864 PolarHBondContact O-N 2.84Å; V864-Q868 HydrophobicContact CG1-CB 3.47Å; V864-Q868 VanDerWaalsContact CG1-CB 3.47Å; V864-M869 HydrophobicContact CB-CE 4.15Å; V864-M869 HydrophobicContact CB-CG 4.44Å; V864-M869 HydrophobicContact CG1-CG 3.88Å; V864-M869 WeakPolarHBondContact O-CE 3.43Å; V864-F895 HydrophobicContact CG2-CD2 4.37Å; V864-F895 HydrophobicContact CG2-CE2 3.6Å; V864-F895 HydrophobicContact CG2-CZ 4.17Å
865	S	84.1	Confident	85.1	Confident	47 Å²	47	72.4 Å²	72.4	33%	0.329	36%	0.359	S	S	.	.			trans	-76	158.1	177.1	83.6	0	0	0	0	111.6	Q867 Q868 M869	S865-Q867 VanDerWaalsContact C-N 3.29Å; S865-Q867 PolarHBondContact O-N 3.12Å; S865-Q868 WeakPolarHBondContact O-CB 3.36Å; S865-Q868 PolarHBondContact O-N 3Å; S865-Q868 VanDerWaalsContact O-N 3.1Å; S865-Q868 WeakPolarHBondContact OG-CG 3.22Å; S865-Q868 PolarHBondContact OG-N 2.97Å; S865-M869 PolarHBondContact O-N 3.5Å
866	R	83.6	Confident	84.7	Confident	191 Å²	191	69.8 Å²	69.8	72%	0.721	35%	0.351	S	S	*	.	H	α-helix	trans	-57.5	-41.6	177.8	-179.5	173.8	172.7	163.7	0.9	112.7	Q868 M869 E870	R866-Q868 VanDerWaalsContact C-N 3.32Å; R866-Q868 PolarHBondContact O-N 3.49Å; R866-M869 WeakPolarHBondContact O-CB 3.43Å; R866-M869 PolarHBondContact O-N 2.95Å; R866-M869 VanDerWaalsContact O-N 3.17Å; R866-E870 WeakPolarHBondContact CG-OE1 3.37Å; R866-E870 IonicContact CZ-OE1 2.76Å; R866-E870 IonicContact NE-OE1 2.81Å; R866-E870 PolarHBondContact NE-OE1 2.93Å; R866-E870 IonicContact NH2-OE1 3.5Å; R866-E870 PolarHBondContact NH2-OE1 3.18Å; R866-E870 WeakPolarHBondContact O-CG 3.2Å; R866-E870 PolarHBondContact O-N 2.79Å
867	Q	80.9	Confident	84.4	Confident	159 Å²	159	72.9 Å²	72.9	74%	0.743	36%	0.361	S	S	*	.	H	α-helix	trans	-61.9	-39.3	176.2	-68.7	169.9	-26.3	0	0	112.2	S865 E870 A871	S865-Q867 VanDerWaalsContact C-N 3.29Å; S865-Q867 PolarHBondContact O-N 3.12Å; Q867-E870 PolarHBondContact O-N 3.29Å; Q867-A871 PolarHBondContact O-N 3.5Å; Q867-A871 VanDerWaalsContact O-N 3.07Å
868	Q	80.4	Confident	83.7	Confident	106 Å²	106	76.5 Å²	76.5	50%	0.495	38%	0.38	S	S	.	.	H	α-helix	trans	-67.4	-37.2	174.7	-71.7	168.5	-24.1	0	0	111.8	V864 S865 R866 A871 Y872	V864-Q868 HydrophobicContact CG1-CB 3.47Å; V864-Q868 VanDerWaalsContact CG1-CB 3.47Å; S865-Q868 WeakPolarHBondContact O-CB 3.36Å; S865-Q868 PolarHBondContact O-N 3Å; S865-Q868 VanDerWaalsContact O-N 3.1Å; S865-Q868 WeakPolarHBondContact OG-CG 3.22Å; S865-Q868 PolarHBondContact OG-N 2.97Å; R866-Q868 VanDerWaalsContact C-N 3.32Å; R866-Q868 PolarHBondContact O-N 3.49Å; Q868-A871 WeakPolarHBondContact O-CB 3.15Å; Q868-A871 PolarHBondContact O-N 2.88Å; Q868-Y872 WeakPolarHBondContact O-CD2 3.45Å; Q868-Y872 PolarHBondContact O-N 3.32Å
869	M	83.6	Confident	82.8	Confident	18 Å²	18	86.6 Å²	86.6	9%	0.089	42%	0.424	C	S	.	.	H	α-helix	trans	-63.8	-44.7	173.9	-64	177.7	-169.8	0	0	111.7	W854 R855 A858 E859 V864 S865 R866 A871 Y872 E873	W854-M869 HydrophobicContact CH2-CB 3.82Å; W854-M869 HydrophobicContact CH2-CG 4.04Å; W854-M869 HydrophobicContact CZ2-CB 4.22Å; W854-M869 HydrophobicContact CZ3-CG 4.36Å; R855-M869 HydrophobicContact CB-CE 4.4Å; R855-M869 HydrophobicContact CB-SD 3.56Å; R855-M869 VanDerWaalsContact CB-SD 3.56Å; R855-M869 HydrophobicContact CG-SD 3.78Å; R855-M869 VanDerWaalsContact O-CE 3.23Å; R855-M869 WeakPolarHBondContact O-CE 3.24Å; A858-M869 HydrophobicContact CB-CE 4.13Å; E859-M869 HydrophobicContact CB-CE 4.19Å; V864-M869 HydrophobicContact CB-CE 4.15Å; V864-M869 HydrophobicContact CB-CG 4.44Å; V864-M869 HydrophobicContact CG1-CG 3.88Å; V864-M869 WeakPolarHBondContact O-CE 3.43Å; S865-M869 PolarHBondContact O-N 3.5Å; R866-M869 WeakPolarHBondContact O-CB 3.43Å; R866-M869 PolarHBondContact O-N 2.95Å; R866-M869 VanDerWaalsContact O-N 3.17Å; M869-A871 PolarHBondContact O-N 2.67Å; M869-Y872 PolarHBondContact O-N 2.93Å; M869-Y872 VanDerWaalsContact O-N 3.09Å; M869-E873 PolarHBondContact O-N 3.26Å
870	E	83.6	Confident	81.9	Confident	68 Å²	68	88.5 Å²	88.5	32%	0.318	44%	0.437	S	S	.	.	H	α-helix	trans	-63	-29.3	178.1	-72.1	167.1	-177.2	0	0	111.9	R866 Q867 E873 A874	R866-E870 WeakPolarHBondContact CG-OE1 3.37Å; R866-E870 IonicContact CZ-OE1 2.76Å; R866-E870 IonicContact NE-OE1 2.81Å; R866-E870 PolarHBondContact NE-OE1 2.93Å; R866-E870 IonicContact NH2-OE1 3.5Å; R866-E870 PolarHBondContact NH2-OE1 3.18Å; R866-E870 WeakPolarHBondContact O-CG 3.2Å; R866-E870 PolarHBondContact O-N 2.79Å; Q867-E870 PolarHBondContact O-N 3.29Å; E870-E873 PolarHBondContact O-N 3.36Å; E870-A874 PolarHBondContact O-N 3.25Å
871	A	84.2	Confident	80.9	Confident	66 Å²	66	87.3 Å²	87.3	55%	0.545	44%	0.444	S	S	.	.	H	α-helix	trans	-69.3	-32.3	172.1	0	0	0	0	0	114.3	Q867 Q868 M869 E873 P875	Q867-A871 PolarHBondContact O-N 3.5Å; Q867-A871 VanDerWaalsContact O-N 3.07Å; Q868-A871 WeakPolarHBondContact O-CB 3.15Å; Q868-A871 PolarHBondContact O-N 2.88Å; M869-A871 PolarHBondContact O-N 2.67Å; A871-E873 VanDerWaalsContact C-N 3.31Å; A871-P875 WeakPolarHBondContact O-CD 3.32Å
872	Y	83.4	Confident	80	Confident	64 Å²	64	91.3 Å²	91.3	25%	0.251	46%	0.464	S	S	.	.	H	α-helix	trans	-73.6	-22.6	170.1	-73.2	-79.1	0	0	0	112.5	W854 Q868 M869 H876 P891 D894 F895 T898	W854-Y872 HydrophobicContact CH2-CD2 4.35Å; W854-Y872 HydrophobicContact CH2-CG 4.46Å; Q868-Y872 WeakPolarHBondContact O-CD2 3.45Å; Q868-Y872 PolarHBondContact O-N 3.32Å; M869-Y872 PolarHBondContact O-N 2.93Å; M869-Y872 VanDerWaalsContact O-N 3.09Å; Y872-H876 PolarHBondContact O-CD2 3.37Å; Y872-P891 WeakPolarHBondContact O-CB 3.28Å; Y872-D894 HydrophobicContact CD1-CB 4.3Å; Y872-F895 HydrophobicContact CD1-CB 4.24Å; Y872-F895 HydrophobicContact CD2-CB 4.43Å; Y872-F895 HydrophobicContact CE1-CB 4.28Å; Y872-F895 HydrophobicContact CE2-CB 4.49Å; Y872-F895 HydrophobicContact CE2-CD2 4.06Å; Y872-F895 HydrophobicContact CG-CB 4.33Å; Y872-T898 WeakPolarHBondContact OH-CG2 3.3Å
873	E	86	Confident	79.4	Confident	9 Å²	9	90.2 Å²	90.2	4%	0.042	45%	0.451	C	S	.	.	H	α-helix	trans	-84.7	-32.6	178.5	-70.6	171.7	-158.2	0	0	113.1	W854 R855 M869 E870 A871 P875 H876 R877 L883 P891	W854-E873 HydrophobicContact CZ2-CG 3.91Å; W854-E873 WeakPolarHBondContact CZ2-OE1 3.28Å; R855-E873 IonicContact CZ-OE1 2.71Å; R855-E873 IonicContact CZ-OE2 3.98Å; R855-E873 IonicContact NE-OE1 3.33Å; R855-E873 PolarHBondContact NE-OE1 3.44Å; R855-E873 IonicContact NE-OE2 3Å; R855-E873 IonicContact NH2-OE1 3.15Å; R855-E873 PolarHBondContact NH2-OE1 2.87Å; R855-E873 IonicContact NH2-OE2 3.81Å; R855-E873 PolarHBondContact NH2-OE2 2.99Å; M869-E873 PolarHBondContact O-N 3.26Å; E870-E873 PolarHBondContact O-N 3.36Å; A871-E873 VanDerWaalsContact C-N 3.31Å; E873-P875 VanDerWaalsContact C-CD 3.44Å; E873-H876 PolarHBondContact O-N 3.33Å; E873-R877 PolarHBondContact O-N 3.19Å; E873-L883 HydrophobicContact CB-CD1 4.13Å; E873-L883 HydrophobicContact CG-CD1 4.43Å; E873-P891 HydrophobicContact CG-CB 4.01Å; E873-P891 HydrophobicContact CG-CG 4.03Å
874	A	81.9	Confident	78.9	Confident	58 Å²	58	83.7 Å²	83.7	48%	0.479	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-51.8	-41.1	-175.9	0	0	0	0	0	115	E870 H876	E870-A874 PolarHBondContact O-N 3.25Å; A874-H876 PolarHBondContact O-N 2.85Å
875	P	82.4	Confident	78.1	Confident	100 Å²	100	88.2 Å²	88.2	65%	0.649	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-69	-14.5	178.2	-20	33.8	0	0	0	115.1	A871 E873	A871-P875 WeakPolarHBondContact O-CD 3.32Å; E873-P875 VanDerWaalsContact C-CD 3.44Å
876	H	80.3	Confident	77.4	Confident	53 Å²	53	93.7 Å²	93.7	25%	0.245	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-112.7	2.3	-172	-64.7	-77.2	0	0	0	113.8	Y872 E873 A874 L883 K890 P891 D894	Y872-H876 PolarHBondContact O-CD2 3.37Å; E873-H876 PolarHBondContact O-N 3.33Å; A874-H876 PolarHBondContact O-N 2.85Å; H876-L883 HydrophobicContact CB-CD1 3.68Å; H876-K890 WeakPolarHBondContact ND1-CB 3.24Å; H876-P891 HydrophobicContact CB-CG 4.18Å; H876-D894 IonicContact CD2-OD2 3.44Å; H876-D894 IonicContact CE1-OD2 3.56Å; H876-D894 PolarHBondContact CE1-OD2 3.44Å; H876-D894 IonicContact NE2-OD2 3.95Å; H876-D894 PolarHBondContact NE2-OD2 3.1Å
877	R	81.9	Confident	77.2	Confident	109 Å²	109	85.8 Å²	85.8	41%	0.411	45%	0.451	S	S	.	.			trans	-69.9	149.3	174.5	-71.5	172.9	-174.7	-165.8	2	110.8	E873 G881 L883	E873-R877 PolarHBondContact O-N 3.19Å; R877-G881 WeakPolarHBondContact CD-O 3.24Å; R877-L883 HydrophobicContact CG-CB 4.17Å; R877-L883 HydrophobicContact CG-CD1 4.29Å
878	D	74.9	Confident	77.3	Confident	78 Å²	78	78.4 Å²	78.4	42%	0.417	42%	0.417	S	S	.	.			trans	-74.1	-179.6	174.6	82.1	-10.8	0	0	0	111.9	N880 G881 I882	D878-N880 PolarHBondContact O-N 2.89Å; D878-N880 VanDerWaalsContact O-N 3.11Å; D878-N880 VanDerWaalsContact OD1-C 3.29Å; D878-N880 VanDerWaalsContact OD1-CA 3.26Å; D878-N880 WeakPolarHBondContact OD1-CA 3.48Å; D878-N880 VanDerWaalsContact OD1-CB 3.32Å; D878-N880 WeakPolarHBondContact OD1-CB 3.43Å; D878-N880 PolarHBondContact OD1-N 3.09Å; D878-N880 PolarHBondContact OD2-ND2 3.31Å; D878-G881 PolarHBondContact O-N 3.5Å; D878-G881 PolarHBondContact OD1-N 3.48Å; D878-I882 PolarHBondContact N-O 2.82Å; D878-I882 PolarHBondContact OD1-N 2.88Å
879	K	70.1	Confident	77.4	Confident	212 Å²	212	77.4 Å²	77.4	92%	0.922	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.9	178	-66	-176.3	178.5	-179	0	114
880	N	68.9	Low	77.4	Confident	128 Å²	128	79.7 Å²	79.7	68%	0.684	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	1.1	178.8	-47.4	-49.6	0	0	0	111.8	D878 I882	D878-N880 PolarHBondContact O-N 2.89Å; D878-N880 VanDerWaalsContact O-N 3.11Å; D878-N880 VanDerWaalsContact OD1-C 3.29Å; D878-N880 VanDerWaalsContact OD1-CA 3.26Å; D878-N880 WeakPolarHBondContact OD1-CA 3.48Å; D878-N880 VanDerWaalsContact OD1-CB 3.32Å; D878-N880 WeakPolarHBondContact OD1-CB 3.43Å; D878-N880 PolarHBondContact OD1-N 3.09Å; D878-N880 PolarHBondContact OD2-ND2 3.31Å; N880-I882 VanDerWaalsContact C-N 3.28Å; N880-I882 HydrophobicContact CB-CD1 4.49Å; N880-I882 HydrophobicContact CB-CG1 4.48Å; N880-I882 PolarHBondContact O-N 2.87Å
881	G	65.9	Low	77.5	Confident	43 Å²	43	76.5 Å²	76.5	44%	0.443	40%	0.403	S	S	.	.	S	Bend	trans	79.3	4.7	-176.4	0	0	0	0	0	114.7	R877 D878	R877-G881 WeakPolarHBondContact CD-O 3.24Å; D878-G881 PolarHBondContact O-N 3.5Å; D878-G881 PolarHBondContact OD1-N 3.48Å
882	I	67.1	Low	77.6	Confident	113 Å²	113	73.4 Å²	73.4	58%	0.579	38%	0.377	S	S	*	.			trans	-91.7	145.1	-179.4	-60.3	175.5	0	0	0	108.7	D878 N880	D878-I882 PolarHBondContact N-O 2.82Å; D878-I882 PolarHBondContact OD1-N 2.88Å; N880-I882 VanDerWaalsContact C-N 3.28Å; N880-I882 HydrophobicContact CB-CD1 4.49Å; N880-I882 HydrophobicContact CB-CG1 4.48Å; N880-I882 PolarHBondContact O-N 2.87Å
883	L	72.7	Confident	77.7	Confident	29 Å²	29	72 Å²	72	15%	0.152	37%	0.372	C	S	.	.			trans	-118.7	114	173.5	-164.4	149.5	0	0	0	108.9	E873 H876 R877 M888 P891	E873-L883 HydrophobicContact CB-CD1 4.13Å; E873-L883 HydrophobicContact CG-CD1 4.43Å; H876-L883 HydrophobicContact CB-CD1 3.68Å; R877-L883 HydrophobicContact CG-CB 4.17Å; R877-L883 HydrophobicContact CG-CD1 4.29Å; L883-M888 HydrophobicContact CD2-CG 3.8Å; L883-M888 HydrophobicContact CD2-SD 3.52Å; L883-M888 VanDerWaalsContact CD2-SD 3.52Å; L883-P891 HydrophobicContact CD1-CG 3.96Å
884	D	74.3	Confident	77.6	Confident	89 Å²	89	74.3 Å²	74.3	48%	0.476	39%	0.385	S	S	.	.			trans	-66	143.3	-179	172.6	40.6	0	0	0	112.1	E886 S887 M888	D884-E886 PolarHBondContact O-N 2.84Å; D884-E886 WeakPolarHBondContact OD2-CB 3.29Å; D884-E886 PolarHBondContact OD2-N 3.2Å; D884-S887 WeakPolarHBondContact O-CA 3.42Å; D884-S887 WeakPolarHBondContact O-CB 3.23Å; D884-S887 PolarHBondContact O-N 3.14Å; D884-M888 PolarHBondContact O-N 3.06Å
885	N	69.9	Low	78	Confident	112 Å²	112	71.8 Å²	71.8	60%	0.599	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-60.2	-32.5	-178.2	-78.2	-59.2	0	0	0	112.4	S887 M888	N885-S887 PolarHBondContact O-N 2.94Å; N885-M888 WeakPolarHBondContact O-CB 3.49Å; N885-M888 PolarHBondContact O-N 2.99Å
886	E	70	Confident	78.2	Confident	162 Å²	162	67.1 Å²	67.1	76%	0.757	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-72.1	-16.5	175.5	-53.5	-162.9	162.8	0	0	112.9	D884 W889	D884-E886 PolarHBondContact O-N 2.84Å; D884-E886 WeakPolarHBondContact OD2-CB 3.29Å; D884-E886 PolarHBondContact OD2-N 3.2Å; E886-W889 PolarHBondContact O-NE1 2.99Å
887	S	79.3	Confident	78.5	Confident	25 Å²	25	67.6 Å²	67.6	18%	0.175	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-93.9	-5.5	173.7	-73.3	0	0	0	0	114.4	D884 N885 W889 K890 P891	D884-S887 WeakPolarHBondContact O-CA 3.42Å; D884-S887 WeakPolarHBondContact O-CB 3.23Å; D884-S887 PolarHBondContact O-N 3.14Å; N885-S887 PolarHBondContact O-N 2.94Å; S887-W889 PolarHBondContact O-N 2.92Å; S887-K890 PolarHBondContact O-N 2.93Å; S887-K890 PolarHBondContact OG-NZ 2.88Å; S887-P891 WeakPolarHBondContact O-CD 3.48Å
888	M	81.8	Confident	78.6	Confident	4 Å²	4	65 Å²	65	2%	0.02	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-16.5	-179	-77.6	-75	-77	0	0	114.5	L883 D884 N885 K890 A892	L883-M888 HydrophobicContact CD2-CG 3.8Å; L883-M888 HydrophobicContact CD2-SD 3.52Å; L883-M888 VanDerWaalsContact CD2-SD 3.52Å; D884-M888 PolarHBondContact O-N 3.06Å; N885-M888 WeakPolarHBondContact O-CB 3.49Å; N885-M888 PolarHBondContact O-N 2.99Å; M888-K890 VanDerWaalsContact C-N 3.31Å; M888-K890 PolarHBondContact O-N 2.94Å; M888-A892 WeakPolarHBondContact O-CB 3.42Å
889	W	83.8	Confident	79.3	Confident	85 Å²	85	62.1 Å²	62.1	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-71.1	-21.5	173.5	68.9	-96.7	0	0	0	113.4	L844 A847 V848 E886 S887 A892 Y893	L844-W889 HydrophobicContact CD1-CE3 4.16Å; L844-W889 HydrophobicContact CD1-CZ3 3.99Å; A847-W889 WeakPolarHBondContact O-CB 3.4Å; V848-W889 HydrophobicContact CG2-CB 4.07Å; V848-W889 HydrophobicContact CG2-CD2 4.28Å; V848-W889 HydrophobicContact CG2-CE3 4.49Å; V848-W889 HydrophobicContact CG2-CG 4.11Å; E886-W889 PolarHBondContact O-NE1 2.99Å; S887-W889 PolarHBondContact O-N 2.92Å; W889-A892 PolarHBondContact O-N 2.89Å; W889-Y893 VanDerWaalsContact O-CB 3.31Å; W889-Y893 WeakPolarHBondContact O-CB 3.27Å; W889-Y893 PolarHBondContact O-N 2.92Å
890	K	83.2	Confident	80.1	Confident	67 Å²	67	52 Å²	52	29%	0.291	27%	0.272	S	S	.	.	H	α-helix	trans	-72.7	-51.6	-177.9	-49.3	160.1	-177.8	158.6	0	111.7	H876 S887 M888 A892 Y893 D894	H876-K890 WeakPolarHBondContact ND1-CB 3.24Å; S887-K890 PolarHBondContact O-N 2.93Å; S887-K890 PolarHBondContact OG-NZ 2.88Å; M888-K890 VanDerWaalsContact C-N 3.31Å; M888-K890 PolarHBondContact O-N 2.94Å; K890-A892 PolarHBondContact O-N 2.83Å; K890-Y893 PolarHBondContact O-N 2.9Å; K890-Y893 VanDerWaalsContact O-N 3.12Å; K890-D894 PolarHBondContact O-N 2.79Å
891	P	84.6	Confident	80.7	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-57.7	-37.2	170.1	-24	35.1	0	0	0	112.7	W854 Y872 E873 H876 L883 S887 Y893 F895	W854-P891 HydrophobicContact CZ2-CB 3.89Å; Y872-P891 WeakPolarHBondContact O-CB 3.28Å; E873-P891 HydrophobicContact CG-CB 4.01Å; E873-P891 HydrophobicContact CG-CG 4.03Å; H876-P891 HydrophobicContact CB-CG 4.18Å; L883-P891 HydrophobicContact CD1-CG 3.96Å; S887-P891 WeakPolarHBondContact O-CD 3.48Å; P891-Y893 PolarHBondContact O-N 2.92Å; P891-F895 WeakPolarHBondContact O-CB 3.41Å; P891-F895 PolarHBondContact O-N 3.33Å
892	A	86.7	Confident	81.3	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-62.7	-40.2	176.7	0	0	0	0	0	112.5	A847 W854 M888 W889 K890 L896	A847-A892 HydrophobicContact CB-CB 4.02Å; W854-A892 HydrophobicContact CB-CB 3.36Å; W854-A892 HydrophobicContact CD2-CB 4.23Å; W854-A892 HydrophobicContact CG-CB 3.6Å; M888-A892 WeakPolarHBondContact O-CB 3.42Å; W889-A892 PolarHBondContact O-N 2.89Å; K890-A892 PolarHBondContact O-N 2.83Å; A892-L896 VanDerWaalsContact O-CB 3.27Å; A892-L896 WeakPolarHBondContact O-CB 3.47Å; A892-L896 WeakPolarHBondContact O-CG 3.33Å; A892-L896 PolarHBondContact O-N 3.01Å
893	Y	86.4	Confident	81.7	Confident	34 Å²	34	50.6 Å²	50.6	13%	0.133	26%	0.261	C	S	.	.	H	α-helix	trans	-72	-44.1	179.1	-174.2	-121	0	0	0	111.6	L843 L844 A847 W889 K890 P891 F895 L896 L897	L843-Y893 HydrophobicContact CB-CE2 4.19Å; L844-Y893 HydrophobicContact CB-CD2 4.08Å; L844-Y893 HydrophobicContact CB-CE2 3.66Å; L844-Y893 HydrophobicContact CD1-CD1 4.44Å; L844-Y893 HydrophobicContact CD1-CD2 3.93Å; L844-Y893 HydrophobicContact CD1-CE2 4.02Å; L844-Y893 HydrophobicContact CD1-CG 4.14Å; L844-Y893 HydrophobicContact CG-CE2 4.43Å; A847-Y893 HydrophobicContact CB-CD2 4.22Å; A847-Y893 HydrophobicContact CB-CG 4.42Å; W889-Y893 VanDerWaalsContact O-CB 3.31Å; W889-Y893 WeakPolarHBondContact O-CB 3.27Å; W889-Y893 PolarHBondContact O-N 2.92Å; K890-Y893 PolarHBondContact O-N 2.9Å; K890-Y893 VanDerWaalsContact O-N 3.12Å; P891-Y893 PolarHBondContact O-N 2.92Å; Y893-F895 PolarHBondContact O-N 3.3Å; Y893-L896 PolarHBondContact O-N 3.07Å; Y893-L896 VanDerWaalsContact O-N 3.15Å; Y893-L897 HydrophobicContact CD1-CD1 3.88Å; Y893-L897 HydrophobicContact CD1-CG 4.46Å; Y893-L897 HydrophobicContact CD2-CG 4.43Å; Y893-L897 HydrophobicContact CE1-CD1 3.54Å; Y893-L897 HydrophobicContact CE1-CG 4.21Å; Y893-L897 HydrophobicContact CE2-CD1 4.38Å; Y893-L897 HydrophobicContact CE2-CD2 4.27Å; Y893-L897 HydrophobicContact CE2-CG 4.15Å; Y893-L897 HydrophobicContact CG-CD1 4.45Å; Y893-L897 WeakPolarHBondContact O-CB 3.47Å; Y893-L897 WeakPolarHBondContact O-CG 3.41Å; Y893-L897 PolarHBondContact O-N 2.96Å
894	D	83.8	Confident	81.2	Confident	58 Å²	58	51.1 Å²	51.1	31%	0.31	27%	0.273	S	S	.	.	H	α-helix	trans	-61.8	-45.5	176.2	-68.7	-15.6	0	0	0	111.1	Y872 H876 K890 L896 L897 T898	Y872-D894 HydrophobicContact CD1-CB 4.3Å; H876-D894 IonicContact CD2-OD2 3.44Å; H876-D894 IonicContact CE1-OD2 3.56Å; H876-D894 PolarHBondContact CE1-OD2 3.44Å; H876-D894 IonicContact NE2-OD2 3.95Å; H876-D894 PolarHBondContact NE2-OD2 3.1Å; K890-D894 PolarHBondContact O-N 2.79Å; D894-L896 PolarHBondContact O-N 3.44Å; D894-L897 PolarHBondContact O-N 3.27Å; D894-T898 PolarHBondContact O-N 3.21Å; D894-T898 PolarHBondContact O-OG1 2.98Å
895	F	89.3	Confident	80.9	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-57.2	-47.3	171.2	165.7	-104.3	0	0	0	111.9	W854 A858 L861 A862 V864 Y872 P891 Y893 L897 T898 W899	W854-F895 HydrophobicContact CE3-CB 4.14Å; W854-F895 HydrophobicContact CE3-CD1 4.11Å; W854-F895 HydrophobicContact CE3-CG 4.2Å; W854-F895 HydrophobicContact CZ3-CB 3.75Å; W854-F895 HydrophobicContact CZ3-CD1 4.2Å; W854-F895 HydrophobicContact CZ3-CD2 4.48Å; W854-F895 AromaticContact CZ3-CG 3.85Å; W854-F895 HydrophobicContact CZ3-CG 3.85Å; A858-F895 HydrophobicContact CB-CD1 3.96Å; A858-F895 HydrophobicContact CB-CD2 4.37Å; A858-F895 HydrophobicContact CB-CE1 3.58Å; A858-F895 HydrophobicContact CB-CE2 4.04Å; A858-F895 HydrophobicContact CB-CG 4.35Å; A858-F895 HydrophobicContact CB-CZ 3.64Å; L861-F895 HydrophobicContact CD1-CE1 4.28Å; A862-F895 HydrophobicContact CB-CZ 4.48Å; V864-F895 HydrophobicContact CG2-CD2 4.37Å; V864-F895 HydrophobicContact CG2-CE2 3.6Å; V864-F895 HydrophobicContact CG2-CZ 4.17Å; Y872-F895 HydrophobicContact CD1-CB 4.24Å; Y872-F895 HydrophobicContact CD2-CB 4.43Å; Y872-F895 HydrophobicContact CE1-CB 4.28Å; Y872-F895 HydrophobicContact CE2-CB 4.49Å; Y872-F895 HydrophobicContact CE2-CD2 4.06Å; Y872-F895 HydrophobicContact CG-CB 4.33Å; P891-F895 WeakPolarHBondContact O-CB 3.41Å; P891-F895 PolarHBondContact O-N 3.33Å; Y893-F895 PolarHBondContact O-N 3.3Å; F895-L897 PolarHBondContact O-N 3.25Å; F895-T898 PolarHBondContact O-N 3.17Å; F895-W899 HydrophobicContact CE1-CB 4.37Å; F895-W899 HydrophobicContact CE2-CB 4.01Å; F895-W899 HydrophobicContact CZ-CB 3.9Å; F895-W899 HydrophobicContact CZ-CG 4.1Å; F895-W899 WeakPolarHBondContact O-CB 3.38Å; F895-W899 PolarHBondContact O-N 3.05Å
896	L	87.8	Confident	81.4	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-35.3	-178.1	-80	172.2	0	0	0	113	L843 T846 A847 L857 L861 A892 Y893 D894 W899 A900 L914	L843-L896 HydrophobicContact CD2-CB 4.15Å; T846-L896 HydrophobicContact CG2-CD1 3.84Å; A847-L896 HydrophobicContact CB-CD1 4.18Å; L857-L896 HydrophobicContact CD2-CD2 4.3Å; L861-L896 HydrophobicContact CD1-CD2 4.03Å; A892-L896 VanDerWaalsContact O-CB 3.27Å; A892-L896 WeakPolarHBondContact O-CB 3.47Å; A892-L896 WeakPolarHBondContact O-CG 3.33Å; A892-L896 PolarHBondContact O-N 3.01Å; Y893-L896 PolarHBondContact O-N 3.07Å; Y893-L896 VanDerWaalsContact O-N 3.15Å; D894-L896 PolarHBondContact O-N 3.44Å; L896-W899 HydrophobicContact CD2-CE3 4.04Å; L896-A900 WeakPolarHBondContact O-CB 3.26Å; L896-A900 PolarHBondContact O-N 3.11Å; L896-L914 HydrophobicContact CD2-CD1 3.69Å
897	L	85.2	Confident	82	Confident	62 Å²	62	37.7 Å²	37.7	33%	0.325	21%	0.207	S	C	.	.	H	α-helix	trans	-64.1	-50	171.7	-75.5	174.3	0	0	0	111.2	L843 Y893 D894 F895 A900 A901	L843-L897 HydrophobicContact CD1-CD2 4.18Å; Y893-L897 HydrophobicContact CD1-CD1 3.88Å; Y893-L897 HydrophobicContact CD1-CG 4.46Å; Y893-L897 HydrophobicContact CD2-CG 4.43Å; Y893-L897 HydrophobicContact CE1-CD1 3.54Å; Y893-L897 HydrophobicContact CE1-CG 4.21Å; Y893-L897 HydrophobicContact CE2-CD1 4.38Å; Y893-L897 HydrophobicContact CE2-CD2 4.27Å; Y893-L897 HydrophobicContact CE2-CG 4.15Å; Y893-L897 HydrophobicContact CG-CD1 4.45Å; Y893-L897 WeakPolarHBondContact O-CB 3.47Å; Y893-L897 WeakPolarHBondContact O-CG 3.41Å; Y893-L897 PolarHBondContact O-N 2.96Å; D894-L897 PolarHBondContact O-N 3.27Å; F895-L897 PolarHBondContact O-N 3.25Å; L897-A900 PolarHBondContact O-N 2.83Å; L897-A901 PolarHBondContact O-N 2.84Å
898	T	85.2	Confident	82.3	Confident	56 Å²	56	37.6 Å²	37.6	34%	0.344	20%	0.202	S	C	.	.	H	α-helix	trans	-63	-44.8	178.7	-55.6	0	0	0	0	111.3	Y872 D894 F895 A901 H902	Y872-T898 WeakPolarHBondContact OH-CG2 3.3Å; D894-T898 PolarHBondContact O-N 3.21Å; D894-T898 PolarHBondContact O-OG1 2.98Å; F895-T898 PolarHBondContact O-N 3.17Å; T898-A901 WeakPolarHBondContact O-CB 3.5Å; T898-A901 PolarHBondContact O-N 2.71Å; T898-H902 PolarHBondContact O-N 3.45Å; T898-H902 PolarHBondContact O-ND1 3.11Å
899	W	90.1	Very high	82.5	Confident	16 Å²	16	41.1 Å²	41.1	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-49.2	174.6	169.8	79.4	0	0	0	111.7	L843 L861 F895 L896 A901 H902 V903 V910 E913 L914	L843-W899 HydrophobicContact CD2-CZ3 4.39Å; L861-W899 HydrophobicContact CD1-CD2 4.05Å; L861-W899 HydrophobicContact CD1-CE3 4.36Å; L861-W899 HydrophobicContact CD1-CZ2 4.17Å; L861-W899 HydrophobicContact CD2-CH2 4.28Å; L861-W899 HydrophobicContact CD2-CZ2 3.65Å; L861-W899 HydrophobicContact CG-CZ2 4.4Å; F895-W899 HydrophobicContact CE1-CB 4.37Å; F895-W899 HydrophobicContact CE2-CB 4.01Å; F895-W899 HydrophobicContact CZ-CB 3.9Å; F895-W899 HydrophobicContact CZ-CG 4.1Å; F895-W899 WeakPolarHBondContact O-CB 3.38Å; F895-W899 PolarHBondContact O-N 3.05Å; L896-W899 HydrophobicContact CD2-CE3 4.04Å; W899-A901 PolarHBondContact O-N 3.12Å; W899-H902 PolarHBondContact O-N 2.85Å; W899-V903 HydrophobicContact CD2-CG2 4.31Å; W899-V903 HydrophobicContact CG-CG2 4.46Å; W899-V903 HydrophobicContact CH2-CG1 4.49Å; W899-V903 HydrophobicContact CZ2-CB 4.16Å; W899-V903 HydrophobicContact CZ2-CG1 4.05Å; W899-V903 HydrophobicContact CZ2-CG2 3.9Å; W899-V903 PolarHBondContact O-N 3.41Å; W899-V903 VanDerWaalsContact O-N 3.07Å; W899-V910 HydrophobicContact CH2-CG1 4.16Å; W899-V910 WeakPolarHBondContact CH2-O 3.31Å; W899-V910 HydrophobicContact CZ3-CG1 3.79Å; W899-E913 HydrophobicContact CH2-CB 4.39Å; W899-E913 HydrophobicContact CZ2-CB 4.16Å; W899-L914 HydrophobicContact CH2-CB 3.79Å; W899-L914 HydrophobicContact CH2-CD1 4.26Å; W899-L914 HydrophobicContact CZ3-CB 4.01Å; W899-L914 HydrophobicContact CZ3-CD1 3.95Å; W899-L914 HydrophobicContact CZ3-CG 4.43Å
900	A	85.4	Confident	82.8	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.2	-19.7	178.3	0	0	0	0	0	113.3	K625 L843 L896 L897 H902 V910	K625-A900 VanDerWaalsContact NZ-C 3.27Å; K625-A900 PolarHBondContact NZ-O 3.4Å; L843-A900 HydrophobicContact CD1-CB 3.78Å; L843-A900 HydrophobicContact CD2-CB 4.06Å; L896-A900 WeakPolarHBondContact O-CB 3.26Å; L896-A900 PolarHBondContact O-N 3.11Å; L897-A900 PolarHBondContact O-N 2.83Å; A900-H902 VanDerWaalsContact C-N 3.35Å; A900-V910 HydrophobicContact CB-CG1 3.73Å
901	A	81.3	Confident	83.1	Confident	65 Å²	65	33.9 Å²	33.9	54%	0.537	19%	0.192	S	C	.	.	H	α-helix	trans	-76.6	-21.2	172.4	0	0	0	0	0	113.3	L897 T898 W899	L897-A901 PolarHBondContact O-N 2.84Å; T898-A901 WeakPolarHBondContact O-CB 3.5Å; T898-A901 PolarHBondContact O-N 2.71Å; W899-A901 PolarHBondContact O-N 3.12Å
902	H	79.3	Confident	83.3	Confident	155 Å²	155	35.5 Å²	35.5	72%	0.718	20%	0.2	S	C	*	.	H	α-helix	trans	-102.4	-18	-179.9	-66.3	84.7	0	0	0	113.8	T898 W899 A900	T898-H902 PolarHBondContact O-N 3.45Å; T898-H902 PolarHBondContact O-ND1 3.11Å; W899-H902 PolarHBondContact O-N 2.85Å; A900-H902 VanDerWaalsContact C-N 3.35Å
903	V	76.3	Confident	83.4	Confident	35 Å²	35	39.2 Å²	39.2	21%	0.212	22%	0.217	C	C	.	.	S	Bend	trans	-97.6	112.4	-179.1	173.4	0	0	0	0	112.1	W899 V910 E913	W899-V903 HydrophobicContact CD2-CG2 4.31Å; W899-V903 HydrophobicContact CG-CG2 4.46Å; W899-V903 HydrophobicContact CH2-CG1 4.49Å; W899-V903 HydrophobicContact CZ2-CB 4.16Å; W899-V903 HydrophobicContact CZ2-CG1 4.05Å; W899-V903 HydrophobicContact CZ2-CG2 3.9Å; W899-V903 PolarHBondContact O-N 3.41Å; W899-V903 VanDerWaalsContact O-N 3.07Å; V903-V910 WeakPolarHBondContact O-CG2 3.37Å; V903-E913 HydrophobicContact CG1-CB 4.26Å; V903-E913 HydrophobicContact CG1-CG 4.45Å
904	G	62.7	Low	83.6	Confident	40 Å²	40	37.6 Å²	37.6	41%	0.412	21%	0.211	S	C	.	.			trans	75.2	155.2	166.9	0	0	0	0	0	115.6
905	D	67.3	Low	83.8	Confident	55 Å²	55	35.1 Å²	35.1	29%	0.294	20%	0.197	S	C	.	.	S	Bend	trans	-87.1	-14.3	173.5	-81.6	-36.3	0	0	0	112.4	K624 K625	K624-D905 CarbonylContact C-O 3.59Å; K624-D905 WeakPolarHBondContact CA-O 3.43Å; K625-D905 PolarHBondContact N-O 3.11Å
906	S	80.1	Confident	83.7	Confident	14 Å²	14	37.5 Å²	37.5	10%	0.098	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-119.8	144.1	-173.3	177.7	0	0	0	0	113.5	R908 D909 V910	S906-R908 PolarHBondContact O-N 3.15Å; S906-R908 PolarHBondContact OG-N 3.1Å; S906-D909 WeakPolarHBondContact CB-OD2 3.47Å; S906-D909 PolarHBondContact O-N 3.15Å; S906-V910 PolarHBondContact O-N 2.71Å
907	Y	82.6	Confident	83.6	Confident	12 Å²	12	37.4 Å²	37.4	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-30	170.7	-62.6	-85.8	0	0	0	113.1	L623 V628 A835 K836 L839 I911	L623-Y907 HydrophobicContact CB-CD2 4.38Å; L623-Y907 WeakPolarHBondContact O-CD2 3.27Å; V628-Y907 HydrophobicContact CG2-CE2 4.06Å; V628-Y907 VanDerWaalsContact CG2-OH 3.28Å; V628-Y907 WeakPolarHBondContact CG2-OH 3.45Å; A835-Y907 HydrophobicContact CB-CD1 4.48Å; A835-Y907 HydrophobicContact CB-CD2 4.08Å; A835-Y907 HydrophobicContact CB-CG 4.06Å; K836-Y907 HydrophobicContact CB-CE1 4.16Å; L839-Y907 HydrophobicContact CB-CD1 3.9Å; L839-Y907 HydrophobicContact CB-CE1 4.48Å; L839-Y907 HydrophobicContact CD2-CD1 3.63Å; L839-Y907 HydrophobicContact CD2-CE1 4Å; L839-Y907 HydrophobicContact CG-CD1 4.39Å; Y907-I911 WeakPolarHBondContact O-CG1 3.06Å; Y907-I911 PolarHBondContact O-N 3.03Å
908	R	85.8	Confident	83.7	Confident	22 Å²	22	34.4 Å²	34.4	8%	0.083	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-44.5	175.5	-68.2	-177.2	-175.5	151.3	19.4	111.8	F622 E686 S906 I911 Q912 V939 N940 D943	F622-R908 VanDerWaalsContact CE1-NH1 3.29Å; E686-R908 IonicContact OE2-NH1 2.74Å; E686-R908 PolarHBondContact OE2-NH1 3.01Å; S906-R908 PolarHBondContact O-N 3.15Å; S906-R908 PolarHBondContact OG-N 3.1Å; R908-I911 PolarHBondContact O-N 2.99Å; R908-Q912 WeakPolarHBondContact O-CB 3.15Å; R908-Q912 PolarHBondContact O-N 3.02Å; R908-V939 HydrophobicContact CG-CG1 3.81Å; R908-V939 PolarHBondContact NE-O 3.43Å; R908-V939 PolarHBondContact NH2-O 3.45Å; R908-V939 VanDerWaalsContact NH2-O 3.13Å; R908-N940 WeakPolarHBondContact CD-OD1 3.43Å; R908-D943 IonicContact CZ-OD2 2.73Å; R908-D943 IonicContact NH1-OD2 2.75Å; R908-D943 IonicContact NH2-OD1 2.72Å; R908-D943 IonicContact NH2-OD2 3.59Å; R908-D943 PolarHBondContact NH2-OD2 3.2Å
909	D	86.6	Confident	83.7	Confident	78 Å²	78	32.3 Å²	32.3	42%	0.417	18%	0.179	S	C	.	.	H	α-helix	trans	-67.9	-41.8	-174.1	-56.4	-27.9	0	0	0	110.7	S906 Q912 E913	S906-D909 WeakPolarHBondContact CB-OD2 3.47Å; S906-D909 PolarHBondContact O-N 3.15Å; D909-Q912 PolarHBondContact O-N 3.45Å; D909-E913 PolarHBondContact O-N 3.04Å
910	V	89.2	Confident	83.4	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-51.6	174.4	-176.4	0	0	0	0	111	L839 W899 A900 V903 S906 Q912 E913 L914	L839-V910 HydrophobicContact CD1-CB 4.12Å; L839-V910 HydrophobicContact CD1-CG1 3.58Å; L839-V910 HydrophobicContact CD2-CB 4.48Å; L839-V910 HydrophobicContact CD2-CG1 4.29Å; L839-V910 HydrophobicContact CD2-CG2 4.49Å; W899-V910 HydrophobicContact CH2-CG1 4.16Å; W899-V910 WeakPolarHBondContact CH2-O 3.31Å; W899-V910 HydrophobicContact CZ3-CG1 3.79Å; A900-V910 HydrophobicContact CB-CG1 3.73Å; V903-V910 WeakPolarHBondContact O-CG2 3.37Å; S906-V910 PolarHBondContact O-N 2.71Å; V910-Q912 VanDerWaalsContact C-N 3.32Å; V910-Q912 PolarHBondContact O-N 3.31Å; V910-E913 PolarHBondContact O-N 3.4Å; V910-L914 WeakPolarHBondContact O-CB 3.23Å; V910-L914 PolarHBondContact O-N 2.83Å
911	I	89.6	Confident	83.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-35	-177.8	-60.9	171.8	0	0	0	110.7	L839 V842 Y907 R908 H915 L932 L936 V939	L839-I911 HydrophobicContact CD1-CD1 4.46Å; L839-I911 HydrophobicContact CD1-CG1 3.88Å; V842-I911 HydrophobicContact CG1-CG1 4.43Å; Y907-I911 WeakPolarHBondContact O-CG1 3.06Å; Y907-I911 PolarHBondContact O-N 3.03Å; R908-I911 PolarHBondContact O-N 2.99Å; I911-H915 WeakPolarHBondContact O-CB 3.38Å; I911-H915 PolarHBondContact O-N 3.26Å; I911-L932 HydrophobicContact CG2-CD1 4Å; I911-L936 HydrophobicContact CB-CD1 4.2Å; I911-L936 HydrophobicContact CG2-CB 3.97Å; I911-L936 HydrophobicContact CG2-CD1 3.93Å; I911-L936 HydrophobicContact CG2-CG 4.46Å; I911-V939 HydrophobicContact CD1-CG2 3.9Å
912	Q	89.1	Confident	83.2	Confident	34 Å²	34	43 Å²	43	16%	0.159	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-43.5	177.5	175.7	61	105.5	0	0	112.5	K689 R908 D909 V910 H916 L936	K689-Q912 PolarHBondContact O-NE2 3.37Å; K689-Q912 PolarHBondContact O-OE1 2.94Å; R908-Q912 WeakPolarHBondContact O-CB 3.15Å; R908-Q912 PolarHBondContact O-N 3.02Å; D909-Q912 PolarHBondContact O-N 3.45Å; V910-Q912 VanDerWaalsContact C-N 3.32Å; V910-Q912 PolarHBondContact O-N 3.31Å; Q912-H916 WeakPolarHBondContact O-CB 2.98Å; Q912-H916 PolarHBondContact O-N 3.3Å; Q912-L936 HydrophobicContact CB-CD1 4.22Å
913	E	88.7	Confident	83	Confident	80 Å²	80	41 Å²	41	37%	0.374	20%	0.202	S	C	.	.	H	α-helix	trans	-73.7	-32.3	174.9	-77.6	-56.9	137	0	0	112.5	W899 V903 D909 V910 H916 G917	W899-E913 HydrophobicContact CH2-CB 4.39Å; W899-E913 HydrophobicContact CZ2-CB 4.16Å; V903-E913 HydrophobicContact CG1-CB 4.26Å; V903-E913 HydrophobicContact CG1-CG 4.45Å; D909-E913 PolarHBondContact O-N 3.04Å; V910-E913 PolarHBondContact O-N 3.4Å; E913-H916 CarbonylContact O-C 3.57Å; E913-H916 PolarHBondContact O-N 2.57Å; E913-H916 IonicContact OE2-CD2 2.76Å; E913-H916 PolarHBondContact OE2-CD2 3.4Å; E913-G917 PolarHBondContact O-N 2.96Å
914	L	89.6	Confident	82.8	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-45.3	172.4	-173.9	59.7	0	0	0	111.2	V842 L843 T846 L861 L896 W899 V910 G917 L918	V842-L914 HydrophobicContact CG1-CD2 3.71Å; L843-L914 HydrophobicContact CD2-CD2 3.95Å; T846-L914 HydrophobicContact CG2-CD1 4.19Å; L861-L914 HydrophobicContact CD1-CD1 3.97Å; L896-L914 HydrophobicContact CD2-CD1 3.69Å; W899-L914 HydrophobicContact CH2-CB 3.79Å; W899-L914 HydrophobicContact CH2-CD1 4.26Å; W899-L914 HydrophobicContact CZ3-CB 4.01Å; W899-L914 HydrophobicContact CZ3-CD1 3.95Å; W899-L914 HydrophobicContact CZ3-CG 4.43Å; V910-L914 WeakPolarHBondContact O-CB 3.23Å; V910-L914 PolarHBondContact O-N 2.83Å; L914-G917 PolarHBondContact O-N 3.37Å; L914-L918 HydrophobicContact CD1-CD1 4.5Å; L914-L918 HydrophobicContact CG-CD1 4.17Å; L914-L918 WeakPolarHBondContact O-CG 3.31Å; L914-L918 PolarHBondContact O-N 2.92Å
915	H	88.9	Confident	83.3	Confident	5 Å²	5	39.2 Å²	39.2	2%	0.023	18%	0.183	C	C	.	.	H	α-helix	trans	-58.3	-47.8	172.6	-165.6	-54.1	0	0	0	110.8	I911 G917 L918 D919 L932 T933	I911-H915 WeakPolarHBondContact O-CB 3.38Å; I911-H915 PolarHBondContact O-N 3.26Å; H915-G917 VanDerWaalsContact C-N 3.32Å; H915-G917 PolarHBondContact O-N 2.88Å; H915-L918 PolarHBondContact O-N 2.87Å; H915-D919 IonicContact CE1-OD1 3.91Å; H915-D919 IonicContact CE1-OD2 2.59Å; H915-D919 IonicContact ND1-OD2 3.25Å; H915-D919 PolarHBondContact ND1-OD2 3.45Å; H915-D919 WeakPolarHBondContact O-CB 3.45Å; H915-D919 PolarHBondContact O-N 3.43Å; H915-L932 HydrophobicContact CB-CD2 3.86Å; H915-L932 HydrophobicContact CB-CG 4.45Å; H915-T933 PolarHBondContact NE2-OG1 2.81Å; H915-T933 VanDerWaalsContact NE2-OG1 3.09Å
916	H	86.9	Confident	83.4	Confident	56 Å²	56	37.4 Å²	37.4	26%	0.259	17%	0.174	S	C	.	.	H	α-helix	trans	-61.7	-36	177.1	-172.1	29.7	0	0	0	113.2	Q912 E913 K920	Q912-H916 WeakPolarHBondContact O-CB 2.98Å; Q912-H916 PolarHBondContact O-N 3.3Å; E913-H916 CarbonylContact O-C 3.57Å; E913-H916 PolarHBondContact O-N 2.57Å; E913-H916 IonicContact OE2-CD2 2.76Å; E913-H916 PolarHBondContact OE2-CD2 3.4Å; H916-K920 PolarHBondContact CD2-NZ 3.31Å; H916-K920 VanDerWaalsContact O-CG 3.27Å; H916-K920 WeakPolarHBondContact O-CG 3.33Å; H916-K920 PolarHBondContact O-N 3.45Å; H916-K920 VanDerWaalsContact O-N 3.15Å
917	G	86.6	Confident	82.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-49.7	173.5	0	0	0	0	0	113.2	E913 L914 H915 D919 K920	E913-G917 PolarHBondContact O-N 2.96Å; L914-G917 PolarHBondContact O-N 3.37Å; H915-G917 VanDerWaalsContact C-N 3.32Å; H915-G917 PolarHBondContact O-N 2.88Å; G917-D919 VanDerWaalsContact C-N 3.28Å; G917-D919 PolarHBondContact O-N 3.09Å; G917-K920 WeakPolarHBondContact O-CB 3.45Å; G917-K920 PolarHBondContact O-N 2.86Å
918	L	87.1	Confident	81.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-35.4	176.1	-68.2	163.4	0	0	0	111.7	T846 V850 L857 L914 H915 K920 M921 P924 T926 W929 L932	T846-L918 HydrophobicContact CG2-CD1 3.93Å; T846-L918 HydrophobicContact CG2-CD2 3.92Å; T846-L918 HydrophobicContact CG2-CG 4.37Å; V850-L918 HydrophobicContact CG2-CD2 3.69Å; L857-L918 HydrophobicContact CD1-CD2 3.85Å; L857-L918 HydrophobicContact CD1-CG 4.03Å; L857-L918 HydrophobicContact CD2-CD2 3.82Å; L857-L918 HydrophobicContact CD2-CG 4.49Å; L857-L918 HydrophobicContact CG-CD2 4.46Å; L914-L918 HydrophobicContact CD1-CD1 4.5Å; L914-L918 HydrophobicContact CG-CD1 4.17Å; L914-L918 WeakPolarHBondContact O-CG 3.31Å; L914-L918 PolarHBondContact O-N 2.92Å; H915-L918 PolarHBondContact O-N 2.87Å; L918-K920 VanDerWaalsContact C-N 3.29Å; L918-K920 PolarHBondContact O-N 3.45Å; L918-M921 HydrophobicContact CD2-CE 3.65Å; L918-M921 PolarHBondContact O-N 3.46Å; L918-P924 WeakPolarHBondContact O-CA 3.36Å; L918-P924 VanDerWaalsContact O-CB 3.23Å; L918-P924 WeakPolarHBondContact O-CB 3.4Å; L918-T926 HydrophobicContact CB-CG2 3.72Å; L918-W929 HydrophobicContact CD1-CE3 4.27Å; L918-W929 HydrophobicContact CD1-CZ3 3.91Å; L918-L932 HydrophobicContact CD1-CD2 3.58Å
919	D	84.5	Confident	81.3	Confident	12 Å²	12	53.7 Å²	53.7	6%	0.064	24%	0.238	C	C	.	.	H	α-helix	trans	-67.3	-21.8	172.1	-95.3	-7.5	0	0	0	113.4	R691 H915 G917 T926	R691-D919 HydrophobicContact CB-CB 3.77Å; R691-D919 VanDerWaalsContact CB-CG 3.48Å; R691-D919 WeakPolarHBondContact CB-OD2 3.46Å; R691-D919 VanDerWaalsContact CD-O 3.26Å; R691-D919 WeakPolarHBondContact CD-O 3.42Å; R691-D919 PolarHBondContact N-OD2 3.01Å; R691-D919 PolarHBondContact NH1-O 2.84Å; H915-D919 IonicContact CE1-OD1 3.91Å; H915-D919 IonicContact CE1-OD2 2.59Å; H915-D919 IonicContact ND1-OD2 3.25Å; H915-D919 PolarHBondContact ND1-OD2 3.45Å; H915-D919 WeakPolarHBondContact O-CB 3.45Å; H915-D919 PolarHBondContact O-N 3.43Å; G917-D919 VanDerWaalsContact C-N 3.28Å; G917-D919 PolarHBondContact O-N 3.09Å; D919-T926 VanDerWaalsContact OD1-CB 3.31Å; D919-T926 WeakPolarHBondContact OD1-CB 3.43Å; D919-T926 WeakPolarHBondContact OD1-CG2 3.32Å; D919-T926 PolarHBondContact OD1-OG1 3.38Å
920	K	84.2	Confident	80.9	Confident	75 Å²	75	53.2 Å²	53.2	33%	0.326	23%	0.232	S	C	.	.	H	α-helix	trans	-79.7	-22.4	177.4	-75.9	161.3	-170	160.4	0	113.5	K860 H916 G917 L918	K860-K920 HydrophobicContact CB-CB 3.99Å; K860-K920 HydrophobicContact CB-CD 4.35Å; K860-K920 HydrophobicContact CG-CB 4.11Å; H916-K920 PolarHBondContact CD2-NZ 3.31Å; H916-K920 VanDerWaalsContact O-CG 3.27Å; H916-K920 WeakPolarHBondContact O-CG 3.33Å; H916-K920 PolarHBondContact O-N 3.45Å; H916-K920 VanDerWaalsContact O-N 3.15Å; G917-K920 WeakPolarHBondContact O-CB 3.45Å; G917-K920 PolarHBondContact O-N 2.86Å; L918-K920 VanDerWaalsContact C-N 3.29Å; L918-K920 PolarHBondContact O-N 3.45Å
921	M	84.8	Confident	80.5	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.02	24%	0.24	C	C	.	.	S	Bend	trans	-62.4	152.4	-176.9	-64	-164.2	-57.1	0	0	113.1	E856 L857 L918 N923 P924 I925	E856-M921 HydrophobicContact CG-CG 4.23Å; E856-M921 HydrophobicContact CG-SD 4.41Å; E856-M921 WeakPolarHBondContact OE1-CA 3.25Å; E856-M921 WeakPolarHBondContact OE1-CB 3.43Å; L857-M921 HydrophobicContact CB-SD 3.97Å; L857-M921 HydrophobicContact CD1-SD 4.24Å; L918-M921 HydrophobicContact CD2-CE 3.65Å; L918-M921 PolarHBondContact O-N 3.46Å; M921-N923 VanDerWaalsContact C-N 3.27Å; M921-N923 PolarHBondContact O-N 3.39Å; M921-P924 WeakPolarHBondContact O-CD 3.39Å; M921-I925 HydrophobicContact CE-CB 4.4Å; M921-I925 HydrophobicContact CE-CD1 3.81Å; M921-I925 HydrophobicContact CE-CG1 3.79Å
922	R	77.3	Confident	80.4	Confident	227 Å²	227	54.9 Å²	54.9	86%	0.857	24%	0.24	S	C	*	.	S	Bend	trans	-55.6	-42	-179.4	-173.9	177.7	-178.6	-179.4	0.7	111.7	E856	E856-R922 WeakPolarHBondContact OE1-CB 3.43Å; E856-R922 PolarHBondContact OE1-N 3.35Å
923	N	75.6	Confident	80.3	Confident	112 Å²	112	54.1 Å²	54.1	60%	0.599	24%	0.237	S	C	*	.	S	Bend	trans	-118.3	95.5	167.1	-79.9	-36.6	0	0	0	109.2	R853 M921 I925	R853-N923 PolarHBondContact NH1-O 3.27Å; R853-N923 PolarHBondContact NH2-O 3.17Å; M921-N923 VanDerWaalsContact C-N 3.27Å; M921-N923 PolarHBondContact O-N 3.39Å; N923-I925 PolarHBondContact O-N 2.83Å
924	P	72.3	Confident	80.3	Confident	20 Å²	20	50.4 Å²	50.4	13%	0.13	22%	0.22	C	C	.	.			trans	-76.3	122.9	-173.2	29.7	-34.5	0	0	0	111.4	L918 M921 T926 K927	L918-P924 WeakPolarHBondContact O-CA 3.36Å; L918-P924 VanDerWaalsContact O-CB 3.23Å; L918-P924 WeakPolarHBondContact O-CB 3.4Å; M921-P924 WeakPolarHBondContact O-CD 3.39Å; P924-T926 VanDerWaalsContact C-N 3.26Å; P924-T926 PolarHBondContact O-N 2.84Å; P924-K927 HydrophobicContact CG-CD 4.01Å; P924-K927 HydrophobicContact CG-CG 4.23Å; P924-K927 PolarHBondContact O-N 3.42Å
925	I	71.9	Confident	80.3	Confident	18 Å²	18	50.4 Å²	50.4	9%	0.092	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-68.4	-27	-174.9	-63.9	176.1	0	0	0	111.5	E849 V850 M921 N923 K927 R928 W929	E849-I925 HydrophobicContact CB-CG2 4.44Å; V850-I925 HydrophobicContact CB-CD1 4.32Å; V850-I925 HydrophobicContact CG2-CD1 3.64Å; M921-I925 HydrophobicContact CE-CB 4.4Å; M921-I925 HydrophobicContact CE-CD1 3.81Å; M921-I925 HydrophobicContact CE-CG1 3.79Å; N923-I925 PolarHBondContact O-N 2.83Å; I925-K927 PolarHBondContact O-N 2.92Å; I925-R928 PolarHBondContact O-N 3.41Å; I925-W929 HydrophobicContact CG2-CB 3.88Å; I925-W929 PolarHBondContact O-N 3.37Å
926	T	68.9	Low	80.3	Confident	17 Å²	17	50.2 Å²	50.2	10%	0.104	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-50	-26.9	174.7	55.7	0	0	0	0	114.5	L918 D919 P924 R928 L932	L918-T926 HydrophobicContact CB-CG2 3.72Å; D919-T926 VanDerWaalsContact OD1-CB 3.31Å; D919-T926 WeakPolarHBondContact OD1-CB 3.43Å; D919-T926 WeakPolarHBondContact OD1-CG2 3.32Å; D919-T926 PolarHBondContact OD1-OG1 3.38Å; P924-T926 VanDerWaalsContact C-N 3.26Å; P924-T926 PolarHBondContact O-N 2.84Å; T926-R928 VanDerWaalsContact C-N 3.29Å; T926-R928 PolarHBondContact O-N 2.97Å; T926-L932 HydrophobicContact CG2-CD2 4.37Å
927	K	67.1	Low	80.4	Confident	162 Å²	162	47.8 Å²	47.8	70%	0.704	21%	0.208	S	C	*	.	G	3₁₀ helix	trans	-63.9	-32	173.6	-70.8	178.5	177.9	174.4	0	113.1	P924 I925	P924-K927 HydrophobicContact CG-CD 4.01Å; P924-K927 HydrophobicContact CG-CG 4.23Å; P924-K927 PolarHBondContact O-N 3.42Å; I925-K927 PolarHBondContact O-N 2.92Å
928	R	66.1	Low	80.6	Confident	220 Å²	220	47.8 Å²	47.8	83%	0.83	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-49.1	177.9	-65.2	-178.8	177.3	178.9	-2.3	110.7	I925 T926 K930	I925-R928 PolarHBondContact O-N 3.41Å; T926-R928 VanDerWaalsContact C-N 3.29Å; T926-R928 PolarHBondContact O-N 2.97Å; R928-K930 VanDerWaalsContact C-N 3.27Å; R928-K930 PolarHBondContact O-N 3.05Å
929	W	72.1	Confident	80.8	Confident	8 Å²	8	48 Å²	48	3%	0.03	21%	0.209	C	C	.	.			trans	-78.1	70.3	-176.1	-168.5	47.6	0	0	0	112.3	L748 V842 T845 T846 L918 I925 H931 L932	L748-W929 HydrophobicContact CD2-CZ2 4.04Å; V842-W929 HydrophobicContact CG1-CH2 4.34Å; T845-W929 HydrophobicContact CG2-CH2 4.32Å; T845-W929 HydrophobicContact CG2-CZ2 3.43Å; T845-W929 VanDerWaalsContact CG2-CZ2 3.43Å; T846-W929 WeakPolarHBondContact OG1-CH2 3.34Å; T846-W929 VanDerWaalsContact OG1-CZ3 3.25Å; T846-W929 WeakPolarHBondContact OG1-CZ3 3.38Å; L918-W929 HydrophobicContact CD1-CE3 4.27Å; L918-W929 HydrophobicContact CD1-CZ3 3.91Å; I925-W929 HydrophobicContact CG2-CB 3.88Å; I925-W929 PolarHBondContact O-N 3.37Å; W929-H931 AromaticContact CD1-CD2 3.93Å; W929-H931 PolarHBondContact O-N 2.81Å; W929-H931 VanDerWaalsContact O-N 3.09Å; W929-L932 HydrophobicContact CD2-CB 3.91Å; W929-L932 HydrophobicContact CE3-CB 3.63Å; W929-L932 HydrophobicContact CE3-CD2 4.01Å; W929-L932 HydrophobicContact CE3-CG 4.3Å; W929-L932 HydrophobicContact CH2-CB 3.94Å; W929-L932 HydrophobicContact CH2-CD1 3.79Å; W929-L932 HydrophobicContact CH2-CG 4.29Å; W929-L932 HydrophobicContact CZ2-CB 4.2Å; W929-L932 HydrophobicContact CZ3-CB 3.67Å; W929-L932 HydrophobicContact CZ3-CD1 3.83Å; W929-L932 HydrophobicContact CZ3-CD2 3.75Å; W929-L932 HydrophobicContact CZ3-CG 3.95Å; W929-L932 PolarHBondContact O-N 2.76Å
930	K	78.3	Confident	81	Confident	67 Å²	67	48 Å²	48	29%	0.291	21%	0.21	S	C	.	.	H	α-helix	trans	-58	-22.2	177.9	-66.9	172.5	-177.7	172.8	0	112.8	K667 N668 Y670 R928 T933 G934	K667-K930 PolarHBondContact O-NZ 3.33Å; N668-K930 WeakPolarHBondContact OD1-CD 3.45Å; Y670-K930 HydrophobicContact CD2-CB 4.39Å; Y670-K930 VanDerWaalsContact CD2-O 3.25Å; Y670-K930 WeakPolarHBondContact CD2-O 3.26Å; Y670-K930 HydrophobicContact CE2-CB 4.45Å; Y670-K930 VanDerWaalsContact CE2-O 3.3Å; Y670-K930 WeakPolarHBondContact CE2-O 3.48Å; R928-K930 VanDerWaalsContact C-N 3.27Å; R928-K930 PolarHBondContact O-N 3.05Å; K930-T933 WeakPolarHBondContact O-CB 3.37Å; K930-T933 PolarHBondContact O-N 2.84Å; K930-G934 PolarHBondContact O-N 2.91Å
931	H	81.9	Confident	81.3	Confident	36 Å²	36	44.5 Å²	44.5	17%	0.167	19%	0.194	C	C	.	.	H	α-helix	trans	-72.5	-29.3	-172.1	-50.9	-78.3	0	0	0	113.4	F747 W929 T933 G934 A935	F747-H931 HydrophobicContact CB-CB 4.18Å; F747-H931 WeakPolarHBondContact CB-ND1 3.4Å; F747-H931 AromaticContact CD1-CE1 3.52Å; F747-H931 AromaticContact CD1-NE2 3.84Å; F747-H931 AromaticContact CD2-CE1 3.24Å; F747-H931 WeakPolarHBondContact CD2-CE1 3.42Å; F747-H931 AromaticContact CD2-ND1 3.16Å; F747-H931 WeakPolarHBondContact CD2-ND1 3.41Å; F747-H931 AromaticContact CE1-CE1 3.84Å; F747-H931 AromaticContact CE2-CE1 3.58Å; F747-H931 AromaticContact CE2-ND1 3.85Å; F747-H931 AromaticContact CG-CE1 3.2Å; F747-H931 WeakPolarHBondContact CG-CE1 3.34Å; F747-H931 AromaticContact CG-CG 3.91Å; F747-H931 AromaticContact CG-ND1 3.3Å; F747-H931 VanDerWaalsContact CG-ND1 3.3Å; F747-H931 WeakPolarHBondContact CG-ND1 3.28Å; F747-H931 AromaticContact CG-NE2 3.8Å; F747-H931 AromaticContact CZ-CE1 3.86Å; W929-H931 AromaticContact CD1-CD2 3.93Å; W929-H931 PolarHBondContact O-N 2.81Å; W929-H931 VanDerWaalsContact O-N 3.09Å; H931-T933 VanDerWaalsContact C-N 3.34Å; H931-T933 PolarHBondContact O-N 2.99Å; H931-G934 CarbonylContact O-C 3.58Å; H931-G934 WeakPolarHBondContact O-CA 3.39Å; H931-G934 PolarHBondContact O-N 2.96Å; H931-G934 VanDerWaalsContact O-N 3.11Å; H931-A935 PolarHBondContact O-N 3.26Å
932	L	86.3	Confident	81.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-43.4	170.8	-178.9	67.3	0	0	0	111.8	V842 I911 H915 L918 T926 W929 G934 A935 L936	V842-L932 HydrophobicContact CG1-CD1 3.53Å; V842-L932 HydrophobicContact CG2-CD1 4.37Å; I911-L932 HydrophobicContact CG2-CD1 4Å; H915-L932 HydrophobicContact CB-CD2 3.86Å; H915-L932 HydrophobicContact CB-CG 4.45Å; L918-L932 HydrophobicContact CD1-CD2 3.58Å; T926-L932 HydrophobicContact CG2-CD2 4.37Å; W929-L932 HydrophobicContact CD2-CB 3.91Å; W929-L932 HydrophobicContact CE3-CB 3.63Å; W929-L932 HydrophobicContact CE3-CD2 4.01Å; W929-L932 HydrophobicContact CE3-CG 4.3Å; W929-L932 HydrophobicContact CH2-CB 3.94Å; W929-L932 HydrophobicContact CH2-CD1 3.79Å; W929-L932 HydrophobicContact CH2-CG 4.29Å; W929-L932 HydrophobicContact CZ2-CB 4.2Å; W929-L932 HydrophobicContact CZ3-CB 3.67Å; W929-L932 HydrophobicContact CZ3-CD1 3.83Å; W929-L932 HydrophobicContact CZ3-CD2 3.75Å; W929-L932 HydrophobicContact CZ3-CG 3.95Å; W929-L932 PolarHBondContact O-N 2.76Å; L932-G934 VanDerWaalsContact C-N 3.25Å; L932-G934 PolarHBondContact O-N 2.82Å; L932-A935 PolarHBondContact O-N 3.48Å; L932-L936 PolarHBondContact O-N 2.91Å
933	T	87.1	Confident	81.8	Confident	18 Å²	18	35.7 Å²	35.7	11%	0.11	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-36.4	174.7	-52.2	0	0	0	0	111	L690 L710 H915 K930 H931 V937	L690-T933 HydrophobicContact CD1-CG2 4.26Å; L710-T933 HydrophobicContact CD1-CG2 3.44Å; L710-T933 VanDerWaalsContact CD1-CG2 3.44Å; H915-T933 PolarHBondContact NE2-OG1 2.81Å; H915-T933 VanDerWaalsContact NE2-OG1 3.09Å; K930-T933 WeakPolarHBondContact O-CB 3.37Å; K930-T933 PolarHBondContact O-N 2.84Å; H931-T933 VanDerWaalsContact C-N 3.34Å; H931-T933 PolarHBondContact O-N 2.99Å; T933-V937 WeakPolarHBondContact O-CG2 3.44Å; T933-V937 PolarHBondContact O-N 2.71Å; T933-V937 VanDerWaalsContact O-N 3.08Å
934	G	88.3	Confident	82.3	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.01	14%	0.142	C	C	.	.	H	α-helix	trans	-66.7	-43.1	172.6	0	0	0	0	0	113.3	K930 H931 L932 L936 V937 L938	K930-G934 PolarHBondContact O-N 2.91Å; H931-G934 CarbonylContact O-C 3.58Å; H931-G934 WeakPolarHBondContact O-CA 3.39Å; H931-G934 PolarHBondContact O-N 2.96Å; H931-G934 VanDerWaalsContact O-N 3.11Å; L932-G934 VanDerWaalsContact C-N 3.25Å; L932-G934 PolarHBondContact O-N 2.82Å; G934-L936 VanDerWaalsContact C-N 3.31Å; G934-L936 PolarHBondContact O-N 2.9Å; G934-V937 WeakPolarHBondContact O-CB 3.31Å; G934-V937 PolarHBondContact O-N 2.73Å; G934-L938 PolarHBondContact O-N 2.85Å
935	A	89.9	Confident	83	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64.1	-36.6	176.1	0	0	0	0	0	111.9	V838 V842 H931 L932 L938 V939	V838-A935 HydrophobicContact CG1-CB 4.11Å; V842-A935 HydrophobicContact CG2-CB 3.66Å; H931-A935 PolarHBondContact O-N 3.26Å; L932-A935 PolarHBondContact O-N 3.48Å; A935-L938 WeakPolarHBondContact O-CB 3.21Å; A935-L938 PolarHBondContact O-N 3.34Å; A935-V939 WeakPolarHBondContact O-CG2 3.12Å; A935-V939 PolarHBondContact O-N 3.3Å
936	L	89.3	Confident	83.7	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-64.9	-39.6	172.4	-173.1	57.1	0	0	0	111.7	I688 L690 I911 Q912 L932 G934 N940	I688-L936 HydrophobicContact CD1-CG 4.21Å; I688-L936 HydrophobicContact CG2-CD2 3.61Å; I688-L936 HydrophobicContact CG2-CG 4.26Å; L690-L936 HydrophobicContact CD2-CD2 4.17Å; I911-L936 HydrophobicContact CB-CD1 4.2Å; I911-L936 HydrophobicContact CG2-CB 3.97Å; I911-L936 HydrophobicContact CG2-CD1 3.93Å; I911-L936 HydrophobicContact CG2-CG 4.46Å; Q912-L936 HydrophobicContact CB-CD1 4.22Å; L932-L936 PolarHBondContact O-N 2.91Å; G934-L936 VanDerWaalsContact C-N 3.31Å; G934-L936 PolarHBondContact O-N 2.9Å; L936-N940 WeakPolarHBondContact O-CB 3.41Å; L936-N940 PolarHBondContact O-N 3.39Å; L936-N940 PolarHBondContact O-ND2 3Å
937	V	89.8	Confident	84.4	Confident	4 Å²	4	37.5 Å²	37.5	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-62.8	-45.9	170.8	168.6	0	0	0	0	111.3	I701 L708 L710 T933 G934 V939 N940 C941	I701-V937 HydrophobicContact CD1-CG1 4.34Å; I701-V937 HydrophobicContact CD1-CG2 4.45Å; I701-V937 HydrophobicContact CG1-CG2 4.43Å; I701-V937 HydrophobicContact CG2-CG1 4.17Å; L708-V937 HydrophobicContact CD2-CG1 3.81Å; L708-V937 HydrophobicContact CG-CG1 4.26Å; L710-V937 HydrophobicContact CD2-CG2 4.07Å; L710-V937 HydrophobicContact CG-CG2 4.18Å; T933-V937 WeakPolarHBondContact O-CG2 3.44Å; T933-V937 PolarHBondContact O-N 2.71Å; T933-V937 VanDerWaalsContact O-N 3.08Å; G934-V937 WeakPolarHBondContact O-CB 3.31Å; G934-V937 PolarHBondContact O-N 2.73Å; V937-V939 PolarHBondContact O-N 3.48Å; V937-N940 PolarHBondContact O-N 3.16Å; V937-C941 PolarHBondContact O-N 2.93Å; V937-C941 PolarHBondContact O-SG 3.37Å; V937-C941 VanDerWaalsContact O-SG 3.41Å
938	L	90.9	Very high	85.3	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-52.6	-57.8	177.6	-175.8	173	0	0	0	111.1	I741 L742 P744 C745 V834 V838 G934 A935 N940 C941 L942	I741-L938 HydrophobicContact CB-CB 4.38Å; I741-L938 HydrophobicContact CB-CG 4.32Å; I741-L938 WeakPolarHBondContact O-CD1 3.13Å; L742-L938 HydrophobicContact CD2-CD1 4.39Å; P744-L938 HydrophobicContact CG-CD1 4.24Å; C745-L938 WeakPolarHBondContact SG-CD1 3.22Å; V834-L938 HydrophobicContact CG1-CD2 4.34Å; V838-L938 HydrophobicContact CG2-CD1 3.96Å; V838-L938 HydrophobicContact CG2-CD2 4.17Å; G934-L938 PolarHBondContact O-N 2.85Å; A935-L938 WeakPolarHBondContact O-CB 3.21Å; A935-L938 PolarHBondContact O-N 3.34Å; L938-N940 PolarHBondContact O-N 3.44Å; L938-C941 PolarHBondContact O-N 3.42Å; L938-L942 HydrophobicContact CD2-CD1 4.35Å; L938-L942 HydrophobicContact CD2-CD2 3.74Å; L938-L942 HydrophobicContact CD2-CG 4.12Å; L938-L942 PolarHBondContact O-N 2.89Å
939	V	90.1	Very high	86.2	Confident	4 Å²	4	19.6 Å²	19.6	2%	0.024	10%	0.099	C	C	.	.	H	α-helix	trans	-67.9	-20.1	-175	-176.4	0	0	0	0	112.6	V838 R908 I911 A935 V937 L942	V838-V939 HydrophobicContact CB-CG2 4.46Å; V838-V939 HydrophobicContact CG1-CG2 3.86Å; R908-V939 HydrophobicContact CG-CG1 3.81Å; R908-V939 PolarHBondContact NE-O 3.43Å; R908-V939 PolarHBondContact NH2-O 3.45Å; R908-V939 VanDerWaalsContact NH2-O 3.13Å; I911-V939 HydrophobicContact CD1-CG2 3.9Å; A935-V939 WeakPolarHBondContact O-CG2 3.12Å; A935-V939 PolarHBondContact O-N 3.3Å; V937-V939 PolarHBondContact O-N 3.48Å; V939-L942 HydrophobicContact CG1-CD1 4.39Å
940	N	89.4	Confident	86.7	Confident	13 Å²	13	20.9 Å²	20.9	7%	0.07	11%	0.105	C	C	.	.	H	α-helix	trans	-82.6	-19.3	170.5	-81.3	-90.6	0	0	0	113.9	I688 I701 R908 L936 V937 L938	I688-N940 HydrophobicContact CD1-CB 4.5Å; I701-N940 HydrophobicContact CD1-CB 3.44Å; I701-N940 VanDerWaalsContact CD1-CB 3.44Å; R908-N940 WeakPolarHBondContact CD-OD1 3.43Å; L936-N940 WeakPolarHBondContact O-CB 3.41Å; L936-N940 PolarHBondContact O-N 3.39Å; L936-N940 PolarHBondContact O-ND2 3Å; V937-N940 PolarHBondContact O-N 3.16Å; L938-N940 PolarHBondContact O-N 3.44Å
941	C	89.5	Confident	86.3	Confident	1 Å²	1	20.7 Å²	20.7	1%	0.007	11%	0.112	C	C	.	.	H	α-helix	trans	-98.2	-8.6	179.7	-71.7	0	0	0	0	114.8	I741 V937 L938 D943 T944 L945	I741-C941 HydrophobicContact CG2-CB 3.73Å; V937-C941 PolarHBondContact O-N 2.93Å; V937-C941 PolarHBondContact O-SG 3.37Å; V937-C941 VanDerWaalsContact O-SG 3.41Å; L938-C941 PolarHBondContact O-N 3.42Å; C941-D943 PolarHBondContact O-N 2.9Å; C941-T944 PolarHBondContact O-N 2.8Å; C941-L945 PolarHBondContact O-N 3.34Å
942	L	89	Confident	85.1	Confident	2 Å²	2	24.6 Å²	24.6	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-55.1	-46	-179.2	-66.1	177.3	0	0	0	113	L826 V834 A835 L938 V939 L945 R946	L826-L942 HydrophobicContact CD2-CD2 3.59Å; V834-L942 HydrophobicContact CG1-CD2 4.25Å; A835-L942 HydrophobicContact CB-CD1 3.93Å; L938-L942 HydrophobicContact CD2-CD1 4.35Å; L938-L942 HydrophobicContact CD2-CD2 3.74Å; L938-L942 HydrophobicContact CD2-CG 4.12Å; L938-L942 PolarHBondContact O-N 2.89Å; V939-L942 HydrophobicContact CG1-CD1 4.39Å; L942-L945 PolarHBondContact O-N 3.43Å; L942-R946 WeakPolarHBondContact O-CB 3.43Å; L942-R946 PolarHBondContact O-N 3.44Å
943	D	83.9	Confident	83.3	Confident	45 Å²	45	30.4 Å²	30.4	24%	0.241	18%	0.176	C	C	.	.	H	α-helix	trans	-67.5	-40.9	-178.9	-58.4	-26.7	0	0	0	111.6	F622 R908 C941 R946 S947	F622-D943 VanDerWaalsContact CD1-OD2 3.31Å; F622-D943 WeakPolarHBondContact CD1-OD2 3.37Å; F622-D943 VanDerWaalsContact CE1-OD2 3.24Å; F622-D943 WeakPolarHBondContact CE1-OD2 3.31Å; R908-D943 IonicContact CZ-OD2 2.73Å; R908-D943 IonicContact NH1-OD2 2.75Å; R908-D943 IonicContact NH2-OD1 2.72Å; R908-D943 IonicContact NH2-OD2 3.59Å; R908-D943 PolarHBondContact NH2-OD2 3.2Å; C941-D943 PolarHBondContact O-N 2.9Å; D943-R946 PolarHBondContact O-N 2.99Å; D943-S947 WeakPolarHBondContact O-CB 3.38Å; D943-S947 PolarHBondContact O-N 3.22Å; D943-S947 PolarHBondContact O-OG 3.28Å
944	T	86	Confident	81	Confident	22 Å²	22	32.7 Å²	32.7	14%	0.135	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-48.5	175	-44.2	0	0	0	0	110.3	V650 L683 C941 R946 S947 A948	V650-T944 HydrophobicContact CG1-CG2 3.83Å; L683-T944 PolarHBondContact O-OG1 2.87Å; C941-T944 PolarHBondContact O-N 2.8Å; T944-R946 PolarHBondContact O-N 2.87Å; T944-S947 PolarHBondContact O-N 3.33Å; T944-S947 PolarHBondContact O-OG 3.12Å; T944-A948 PolarHBondContact O-N 3.46Å; T944-A948 VanDerWaalsContact O-N 3.12Å
945	L	87.8	Confident	78.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.2	-47.4	176.1	-179.9	68.2	0	0	0	111.6	F645 T734 L737 L738 I741 L826 C941 L942 S947 A948 A949	F645-L945 HydrophobicContact CE2-CD1 4.16Å; T734-L945 HydrophobicContact CG2-CD1 4.33Å; L737-L945 HydrophobicContact CB-CD1 4.4Å; L737-L945 HydrophobicContact CD2-CB 3.98Å; L737-L945 HydrophobicContact CD2-CD1 4.03Å; L737-L945 HydrophobicContact CG-CD1 4.21Å; L738-L945 HydrophobicContact CB-CD1 4.42Å; L738-L945 HydrophobicContact CD1-CD2 4.02Å; I741-L945 HydrophobicContact CD1-CD2 3.86Å; L826-L945 HydrophobicContact CB-CD2 4.4Å; L826-L945 HydrophobicContact CD1-CD2 4.16Å; L826-L945 HydrophobicContact CD2-CD2 4.3Å; C941-L945 PolarHBondContact O-N 3.34Å; L942-L945 PolarHBondContact O-N 3.43Å; L945-S947 PolarHBondContact O-N 2.8Å; L945-A948 PolarHBondContact O-N 3.26Å; L945-A949 VanDerWaalsContact O-CB 3.29Å; L945-A949 WeakPolarHBondContact O-CB 3.46Å; L945-A949 PolarHBondContact O-N 3.14Å
946	R	86.5	Confident	75.7	Confident	117 Å²	117	46.6 Å²	46.6	44%	0.442	27%	0.271	S	S	.	.	H	α-helix	trans	-56.9	-49.6	178.6	-173.3	177.4	-155.1	-165.5	-0.5	111.8	D829 Q831 L942 D943 T944 A948 F950	D829-R946 VanDerWaalsContact CG-NE 3.29Å; D829-R946 WeakPolarHBondContact OD1-CD 3.38Å; D829-R946 VanDerWaalsContact OD1-CG 3.3Å; D829-R946 WeakPolarHBondContact OD1-CG 3.39Å; D829-R946 IonicContact OD1-CZ 3.45Å; D829-R946 IonicContact OD1-NE 3.15Å; D829-R946 PolarHBondContact OD1-NE 2.96Å; D829-R946 IonicContact OD1-NH2 2.71Å; D829-R946 IonicContact OD2-CZ 2.99Å; D829-R946 VanDerWaalsContact OD2-CZ 3.25Å; D829-R946 IonicContact OD2-NE 2.75Å; D829-R946 PolarHBondContact OD2-NE 3.32Å; D829-R946 IonicContact OD2-NH2 2.73Å; D829-R946 PolarHBondContact OD2-NH2 3.29Å; Q831-R946 HydrophobicContact CG-CB 4.18Å; Q831-R946 HydrophobicContact CG-CG 4.26Å; L942-R946 WeakPolarHBondContact O-CB 3.43Å; L942-R946 PolarHBondContact O-N 3.44Å; D943-R946 PolarHBondContact O-N 2.99Å; T944-R946 PolarHBondContact O-N 2.87Å; R946-A948 VanDerWaalsContact C-N 3.29Å; R946-A948 PolarHBondContact O-N 3.06Å; R946-F950 HydrophobicContact CG-CD2 4.23Å; R946-F950 PolarHBondContact O-N 3.4Å
947	S	84	Confident	73.1	Confident	65 Å²	65	53.4 Å²	53.4	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-30.4	-178.5	69.7	0	0	0	0	113.6	D943 T944 L945 C951	D943-S947 WeakPolarHBondContact O-CB 3.38Å; D943-S947 PolarHBondContact O-N 3.22Å; D943-S947 PolarHBondContact O-OG 3.28Å; T944-S947 PolarHBondContact O-N 3.33Å; T944-S947 PolarHBondContact O-OG 3.12Å; L945-S947 PolarHBondContact O-N 2.8Å; S947-C951 VanDerWaalsContact O-CB 3.27Å; S947-C951 WeakPolarHBondContact O-CB 3.28Å; S947-C951 PolarHBondContact O-SG 3.22Å
948	A	84.9	Confident	70.2	Confident	7 Å²	7	62.6 Å²	62.6	6%	0.058	35%	0.348	C	S	.	.	H	α-helix	trans	-85.2	-39.5	178.4	0	0	0	0	0	113.2	V650 T734 T944 L945 R946	V650-A948 HydrophobicContact CB-CB 4.34Å; V650-A948 HydrophobicContact CG1-CB 4.25Å; V650-A948 HydrophobicContact CG2-CB 3.97Å; T734-A948 HydrophobicContact CG2-CB 3.43Å; T734-A948 VanDerWaalsContact CG2-CB 3.43Å; T944-A948 PolarHBondContact O-N 3.46Å; T944-A948 VanDerWaalsContact O-N 3.12Å; L945-A948 PolarHBondContact O-N 3.26Å; R946-A948 VanDerWaalsContact C-N 3.29Å; R946-A948 PolarHBondContact O-N 3.06Å
949	A	84.6	Confident	67.2	Low	0 Å²	0	67.3 Å²	67.3	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-84.1	-24.5	-172	0	0	0	0	0	114.9	F645 Q646 T734 L945	F645-A949 HydrophobicContact CD2-CB 3.67Å; F645-A949 HydrophobicContact CE2-CB 3.59Å; F645-A949 HydrophobicContact CG-CB 4.43Å; F645-A949 HydrophobicContact CZ-CB 4.29Å; Q646-A949 PolarHBondContact N-O 3Å; T734-A949 HydrophobicContact CG2-CB 4.07Å; L945-A949 VanDerWaalsContact O-CB 3.29Å; L945-A949 WeakPolarHBondContact O-CB 3.46Å; L945-A949 PolarHBondContact O-N 3.14Å
950	F	82.8	Confident	64.4	Low	35 Å²	35	77.2 Å²	77.2	15%	0.154	45%	0.447	C	S	.	.	S	Bend	trans	-124	-10.2	-170.6	-59.2	-68.3	0	0	0	116	P643 F645 L826 K827 D829 R946	P643-F950 HydrophobicContact CB-CD1 3.88Å; P643-F950 HydrophobicContact CB-CE1 4.35Å; P643-F950 HydrophobicContact CG-CD1 4.3Å; P643-F950 HydrophobicContact CG-CE1 4.46Å; P643-F950 WeakPolarHBondContact O-CE1 3.46Å; F645-F950 HydrophobicContact CB-CE1 4.01Å; F645-F950 HydrophobicContact CB-CZ 4.19Å; F645-F950 HydrophobicContact CD2-CZ 4.03Å; L826-F950 WeakPolarHBondContact O-CZ 3.36Å; K827-F950 WeakPolarHBondContact O-CZ 3.23Å; D829-F950 HydrophobicContact CB-CD2 4.1Å; D829-F950 HydrophobicContact CB-CE1 4.28Å; D829-F950 HydrophobicContact CB-CE2 3.8Å; D829-F950 HydrophobicContact CB-CG 4.49Å; D829-F950 HydrophobicContact CB-CZ 3.88Å; R946-F950 HydrophobicContact CG-CD2 4.23Å; R946-F950 PolarHBondContact O-N 3.4Å
951	C	70.6	Confident	63.1	Low	63 Å²	63	80.5 Å²	80.5	43%	0.426	47%	0.466	S	S	.	.			trans	-67.6	137.3	178.2	-78.2	0	0	0	0	112.1	R648 S947	R648-C951 PolarHBondContact NH1-O 3.42Å; S947-C951 VanDerWaalsContact O-CB 3.27Å; S947-C951 WeakPolarHBondContact O-CB 3.28Å; S947-C951 PolarHBondContact O-SG 3.22Å
952	P	56.4	Low	61.7	Low	117 Å²	117	84.6 Å²	84.6	76%	0.76	49%	0.49	S	S	*	.			trans	-59.9	145.8	169	-22.8	34.1	0	0	0	112.1	G954	P952-G954 PolarHBondContact O-N 2.55Å
953	T	47.6	Very low	60.2	Low	123 Å²	123	89.2 Å²	89.2	76%	0.755	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	107.7	167.3	42.1	0	0	0	0	108.9
954	G	39.7	Very low	58.8	Low	66 Å²	66	91.8 Å²	91.8	68%	0.68	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-175.7	-31.5	-178.9	0	0	0	0	0	115.2	P952	P952-G954 PolarHBondContact O-N 2.55Å
955	Y	35.8	Very low	57.1	Low	246 Å²	246	96.2 Å²	96.2	97%	0.965	56%	0.558	S	S	*	*			trans	-122.4	86.7	173.2	-76.2	-83	0	0	0	110.8
956	G	32.1	Very low	55.1	Low	47 Å²	47	102.6 Å²	102.6	49%	0.485	60%	0.595	S	S	.	*			trans	-121.5	127.1	162.3	0	0	0	0	0	108.5	F958	G956-F958 VanDerWaalsContact C-N 3.31Å; G956-F958 WeakPolarHBondContact O-CD2 3.41Å; G956-F958 PolarHBondContact O-N 3.46Å
957	D	34.4	Very low	52.8	Low	144 Å²	144	101.6 Å²	101.6	77%	0.77	61%	0.606	S	S	*	*			trans	-65.3	91.6	171	-58.6	-41.2	0	0	0	108.6	A959	D957-A959 VanDerWaalsContact C-N 3.29Å; D957-A959 PolarHBondContact O-N 3.44Å
958	F	27.2	Very low	50.4	Low	197 Å²	197	104.4 Å²	104.4	86%	0.864	62%	0.617	S	S	*	*			trans	-73.4	90.7	165.1	-73.3	-79.3	0	0	0	107.7	G956 V960	G956-F958 VanDerWaalsContact C-N 3.31Å; G956-F958 WeakPolarHBondContact O-CD2 3.41Å; G956-F958 PolarHBondContact O-N 3.46Å; F958-V960 PolarHBondContact O-N 3.48Å
959	A	29.7	Very low	47.6	Very low	99 Å²	99	112.5 Å²	112.5	82%	0.818	66%	0.664	S	S	*	*			trans	-64.6	114.6	169.6	0	0	0	0	0	109.3	D957	D957-A959 VanDerWaalsContact C-N 3.29Å; D957-A959 PolarHBondContact O-N 3.44Å
960	V	29.8	Very low	44.2	Very low	213 Å²	213	122.7 Å²	122.7	100%	1.291	72%	0.724	S	S	*	*			trans	-85.7	0	156	-179.6	0	0	0	0	107.3	F958	F958-V960 PolarHBondContact O-N 3.48Å

Retrieved 960 of 960 residues in 375.7 ms (Link to these results)

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