A0A087XV62_POEFO Loading...

Ankyrin repeat domain 13B

Ubiquitin-binding protein that specifically recognizes and binds 'Lys-63'-linked ubiquitin. Does not bind 'Lys-48'-linked ubiquitin. Positively regulates the internalization of ligand-activated EGFR by binding to the Ub moiety of ubiquitinated EGFR at the cell membrane.

AlphaFold DB , UniProt , Accession A0A087XV62, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 693 aa.

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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	35.9	Very low	29.8	Very low	233 Å²	233	144.4 Å²	144.4	100%	1.148	82%	0.823	S	S	*	*				0	108.9	0	-70.1	144.2	167.9	0	0	105.3
2	K	31.8	Very low	29.7	Very low	180 Å²	180	145.9 Å²	145.9	78%	0.783	82%	0.824	S	S	*	*				72	128.7	71.3	-72.5	-169.8	147.8	-91.2	0	112
3	D	31.8	Very low	29.4	Very low	129 Å²	129	141.4 Å²	141.4	69%	0.69	81%	0.808	S	S	*	*			cis	-161.5	145.2	-10.3	-88.7	-36.9	0	0	0	109
4	G	29.3	Very low	29.5	Very low	87 Å²	87	140.4 Å²	140.4	90%	0.897	81%	0.809	S	S	*	*			trans	66.2	160.7	159.7	0	0	0	0	0	119.5
5	G	28.8	Very low	29.4	Very low	67 Å²	67	143.1 Å²	143.1	69%	0.691	81%	0.811	S	S	*	*			cis	154.1	147.8	-9.6	0	0	0	0	0	114.2
6	H	29.2	Very low	29.2	Very low	190 Å²	190	141.6 Å²	141.6	88%	0.88	81%	0.813	S	S	*	*			trans	83.1	117.3	170.6	-64.4	-77.9	0	0	0	120.8
7	D	30.6	Very low	29.4	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	81%	0.811	S	S	*	*			trans	-67.4	165.7	156.2	-42.4	-98.3	0	0	0	112.6
8	Y	27.7	Very low	29.5	Very low	228 Å²	228	145.6 Å²	145.6	89%	0.894	82%	0.815	S	S	*	*			trans	-150.8	133.7	136.6	-115	-73.9	0	0	0	112.3
9	V	29.4	Very low	29.4	Very low	125 Å²	125	142.9 Å²	142.9	76%	0.758	81%	0.814	S	S	*	*			trans	-86.6	123.4	179	175.5	0	0	0	0	110.5	V11	V9-V11 PolarHBondContact O-N 3.26Å
10	G	26.4	Very low	29.2	Very low	72 Å²	72	143.9 Å²	143.9	74%	0.742	82%	0.816	S	S	*	*			trans	-84.2	101.1	176.9	0	0	0	0	0	113
11	V	26.4	Very low	29.3	Very low	132 Å²	132	143.1 Å²	143.1	80%	0.8	82%	0.819	S	S	*	*			trans	-76.5	121.1	173.6	178.7	0	0	0	0	110.3	V9	V9-V11 PolarHBondContact O-N 3.26Å
12	I	29.5	Very low	29	Very low	163 Å²	163	143.9 Å²	143.9	84%	0.836	81%	0.809	S	S	*	*			trans	-88.8	115	172.7	-60.3	179.9	0	0	0	109.4
13	S	25.7	Very low	28.8	Very low	87 Å²	87	138.8 Å²	138.8	61%	0.608	81%	0.807	S	S	*	*			trans	-89.7	137.5	177.2	-174.5	0	0	0	0	111.6	Q15	S13-Q15 VanDerWaalsContact C-N 3.34Å; S13-Q15 PolarHBondContact O-N 2.91Å
14	P	29.8	Very low	28.8	Very low	127 Å²	127	140.3 Å²	140.3	83%	0.825	81%	0.814	S	S	*	*	S	Bend	trans	-83.5	66.3	-173.3	34.8	-37.3	0	0	0	113.4
15	Q	28.8	Very low	28.8	Very low	181 Å²	181	144 Å²	144	85%	0.846	81%	0.813	S	S	*	*			trans	-137.8	92.3	169.2	-71.5	-165.4	-4.8	0	0	112.6	S13	S13-Q15 VanDerWaalsContact C-N 3.34Å; S13-Q15 PolarHBondContact O-N 2.91Å
16	S	26.7	Very low	28.8	Very low	120 Å²	120	149.8 Å²	149.8	84%	0.839	82%	0.819	S	S	*	*			trans	-156.3	50.2	166.7	46.7	0	0	0	0	112.6
17	I	31.6	Very low	29.1	Very low	151 Å²	151	149.6 Å²	149.6	77%	0.774	82%	0.819	S	S	*	*			trans	-115.5	145.1	166.1	-55.8	180	0	0	0	107.6
18	F	30.9	Very low	29.2	Very low	203 Å²	203	151.3 Å²	151.3	89%	0.89	82%	0.822	S	S	*	*			trans	75.3	83.2	-172.3	-65.4	-82.8	0	0	0	117.1
19	A	27.5	Very low	29.3	Very low	95 Å²	95	144 Å²	144	79%	0.785	82%	0.816	S	S	*	*			trans	-155.3	70.1	156.5	0	0	0	0	0	113.5
20	N	26.5	Very low	29.7	Very low	162 Å²	162	143.4 Å²	143.4	87%	0.866	82%	0.824	S	S	*	*			trans	-167.3	92.6	148.2	-116.4	-19.2	0	0	0	113.8
21	C	32.1	Very low	29.9	Very low	128 Å²	128	148 Å²	148	87%	0.865	83%	0.832	S	S	*	*			trans	-155.9	81.6	166	-94.3	0	0	0	0	109.2
22	R	28.7	Very low	30	Very low	250 Å²	250	151.5 Å²	151.5	94%	0.943	83%	0.832	S	S	*	*			trans	-167.2	143.8	167	-109.9	162.2	-165.6	-173.8	3.9	111.2
23	G	28.2	Very low	30.2	Very low	73 Å²	73	149 Å²	149	75%	0.753	82%	0.821	S	S	*	*			trans	82.5	144	-164.5	0	0	0	0	0	111
24	I	30.8	Very low	30.7	Very low	161 Å²	161	149.9 Å²	149.9	83%	0.826	82%	0.824	S	S	*	*			cis	-132.3	135.4	9.6	-55.6	172.6	0	0	0	109
25	N	29.3	Very low	31.1	Very low	164 Å²	164	154.4 Å²	154.4	88%	0.877	83%	0.825	S	S	*	*			trans	-105.9	119.6	162.6	-88.8	2.9	0	0	0	109.2
26	K	30.1	Very low	31.4	Very low	189 Å²	189	153.6 Å²	153.6	82%	0.822	82%	0.823	S	S	*	*			trans	-160.6	134.5	150.4	-124.1	-172	175.3	-156.5	0	110.1
27	E	35.4	Very low	32	Very low	185 Å²	185	155.9 Å²	155.9	86%	0.864	82%	0.824	S	S	*	*			trans	-86.1	139.5	172.5	-55.9	172.7	129.5	0	0	109.3
28	E	32.1	Very low	32.6	Very low	181 Å²	181	153.2 Å²	153.2	85%	0.846	82%	0.819	S	S	*	*			trans	-167	148.2	156.1	-120.3	163.9	-134.4	0	0	112.2
29	G	29.1	Very low	33.4	Very low	74 Å²	74	147.6 Å²	147.6	76%	0.763	81%	0.809	S	S	*	*			trans	58.3	93.4	151.3	0	0	0	0	0	119.4
30	A	38.3	Very low	34.4	Very low	114 Å²	114	152.9 Å²	152.9	94%	0.942	82%	0.815	S	S	*	*			trans	-72.4	129.3	161.8	0	0	0	0	0	111.5
31	N	30.1	Very low	36.1	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	80%	0.798	S	S	*	*			trans	-145.2	136.1	157.7	-161.6	-1.3	0	0	0	109.1
32	Y	28.1	Very low	37.9	Very low	206 Å²	206	147 Å²	147	81%	0.808	77%	0.771	S	S	*	*			trans	-123	94.5	-161.5	-163.6	-83.2	0	0	0	110.8	P34	Y32-P34 WeakPolarHBondContact O-CD 3.35Å
33	D	33.7	Very low	40.1	Very low	112 Å²	112	141.8 Å²	141.8	60%	0.599	76%	0.761	S	S	*	*			trans	-77.9	117.3	171.3	-173.5	-26.2	0	0	0	109.9	R35	D33-R35 PolarHBondContact O-N 3.15Å; D33-R35 WeakPolarHBondContact OD1-CB 3.46Å; D33-R35 PolarHBondContact OD1-N 2.91Å
34	P	36.4	Very low	42.3	Very low	104 Å²	104	139.8 Å²	139.8	68%	0.675	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	1	-177.3	-19.4	34.1	0	0	0	115.7	Y32	Y32-P34 WeakPolarHBondContact O-CD 3.35Å
35	R	39	Very low	44.5	Very low	223 Å²	223	134.2 Å²	134.2	84%	0.842	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	0.1	-169	-63.3	-173.9	174.2	-173	-0.2	116.2	D33	D33-R35 PolarHBondContact O-N 3.15Å; D33-R35 WeakPolarHBondContact OD1-CB 3.46Å; D33-R35 PolarHBondContact OD1-N 2.91Å
36	M	34.2	Very low	47	Very low	163 Å²	163	130.7 Å²	130.7	80%	0.803	69%	0.691	S	S	*	*			trans	-107.3	59.1	-178	-80.3	-69	-172.5	0	0	114.2	S38	M36-S38 PolarHBondContact O-N 2.8Å; M36-S38 VanDerWaalsContact O-N 3.08Å
37	I	40.1	Very low	49.6	Very low	169 Å²	169	129 Å²	129	87%	0.867	68%	0.679	S	S	*	*			trans	-82.9	59.9	159.3	-46.6	-178.7	0	0	0	109.1
38	S	44.3	Very low	52.1	Low	95 Å²	95	121.6 Å²	121.6	66%	0.664	64%	0.643	S	S	*	*			trans	-74.1	123.7	159.9	-173	0	0	0	0	107.2	M36 K40	M36-S38 PolarHBondContact O-N 2.8Å; M36-S38 VanDerWaalsContact O-N 3.08Å; S38-K40 PolarHBondContact O-N 2.8Å
39	A	46.9	Very low	54.9	Low	84 Å²	84	114.8 Å²	114.8	69%	0.694	62%	0.615	S	S	*	*			trans	-58.5	123.5	-179.4	0	0	0	0	0	109.6	K41	A39-K41 VanDerWaalsContact C-N 3.32Å; A39-K41 PolarHBondContact O-N 2.76Å
40	K	49.8	Very low	57.9	Low	206 Å²	206	111.5 Å²	111.5	90%	0.896	58%	0.58	S	S	*	*			trans	-67.5	92.9	174.8	-67.6	-174	179.7	-178.4	0	108.4	S38 T42	S38-K40 PolarHBondContact O-N 2.8Å; K40-T42 PolarHBondContact O-N 3.34Å
41	K	61.4	Low	60.6	Low	118 Å²	118	106.1 Å²	106.1	51%	0.513	54%	0.535	S	S	.	.			trans	-48.8	136.3	168.5	-73.3	-161.3	162.5	-164.4	0	108.8	A39 E45	A39-K41 VanDerWaalsContact C-N 3.32Å; A39-K41 PolarHBondContact O-N 2.76Å; K41-E45 WeakPolarHBondContact CA-OE2 3.38Å; K41-E45 HydrophobicContact CB-CB 4.39Å; K41-E45 HydrophobicContact CB-CG 4.29Å; K41-E45 HydrophobicContact CD-CG 4.02Å; K41-E45 VanDerWaalsContact CE-OE1 3.25Å; K41-E45 WeakPolarHBondContact CE-OE1 3.44Å; K41-E45 HydrophobicContact CG-CG 4.24Å; K41-E45 IonicContact NZ-OE1 3.11Å
42	T	70.8	Confident	63.5	Low	48 Å²	48	99.5 Å²	99.5	29%	0.294	50%	0.498	S	S	.	.			trans	-66.5	158.6	176.8	69.3	0	0	0	0	109.8	K40 E44 E45 S46	K40-T42 PolarHBondContact O-N 3.34Å; T42-E44 PolarHBondContact O-N 3.43Å; T42-E44 VanDerWaalsContact O-N 3.11Å; T42-E45 PolarHBondContact O-N 2.93Å; T42-E45 WeakPolarHBondContact OG1-CB 3.03Å; T42-E45 PolarHBondContact OG1-N 3.35Å; T42-S46 PolarHBondContact O-N 3.24Å
43	L	73.6	Confident	66.6	Low	142 Å²	142	90.4 Å²	90.4	74%	0.743	46%	0.463	S	S	*	.	H	α-helix	trans	-55.8	-30.2	175.4	-177.5	62.6	0	0	0	111.6	R47	L43-R47 WeakPolarHBondContact O-CB 3.3Å; L43-R47 PolarHBondContact O-N 3.4Å; L43-R47 VanDerWaalsContact O-N 3.12Å
44	E	74.4	Confident	69.5	Low	31 Å²	31	85 Å²	85	15%	0.145	44%	0.435	C	S	.	.	H	α-helix	trans	-81.4	-42	-179	-64.9	163.6	-174.2	0	0	112	T42 S46 R47 Y48 E404 F407	T42-E44 PolarHBondContact O-N 3.43Å; T42-E44 VanDerWaalsContact O-N 3.11Å; E44-S46 PolarHBondContact O-N 3.02Å; E44-R47 PolarHBondContact O-N 3.37Å; E44-R47 VanDerWaalsContact O-N 3.08Å; E44-Y48 PolarHBondContact O-N 2.7Å; E44-E404 WeakPolarHBondContact OE1-CA 3.36Å; E44-E404 WeakPolarHBondContact OE2-CA 3.22Å; E44-F407 HydrophobicContact CB-CB 4.14Å; E44-F407 HydrophobicContact CB-CD2 4.29Å; E44-F407 HydrophobicContact CB-CG 4.37Å; E44-F407 HydrophobicContact CG-CB 3.65Å; E44-F407 HydrophobicContact CG-CG 4.4Å
45	E	78.3	Confident	72.2	Confident	43 Å²	43	81.2 Å²	81.2	20%	0.201	41%	0.407	C	S	.	.	H	α-helix	trans	-58.9	-33.1	169.5	-176.5	-177.6	178.6	0	0	111.5	K41 T42 P49 Y52	K41-E45 WeakPolarHBondContact CA-OE2 3.38Å; K41-E45 HydrophobicContact CB-CB 4.39Å; K41-E45 HydrophobicContact CB-CG 4.29Å; K41-E45 HydrophobicContact CD-CG 4.02Å; K41-E45 VanDerWaalsContact CE-OE1 3.25Å; K41-E45 WeakPolarHBondContact CE-OE1 3.44Å; K41-E45 HydrophobicContact CG-CG 4.24Å; K41-E45 IonicContact NZ-OE1 3.11Å; T42-E45 PolarHBondContact O-N 2.93Å; T42-E45 WeakPolarHBondContact OG1-CB 3.03Å; T42-E45 PolarHBondContact OG1-N 3.35Å; E45-P49 WeakPolarHBondContact O-CA 3.21Å; E45-P49 WeakPolarHBondContact O-CB 3.39Å; E45-Y52 HydrophobicContact CB-CD1 3.64Å; E45-Y52 HydrophobicContact CB-CD2 4.47Å; E45-Y52 HydrophobicContact CB-CE1 3.78Å; E45-Y52 HydrophobicContact CB-CG 4.02Å; E45-Y52 HydrophobicContact CG-CD1 3.6Å; E45-Y52 HydrophobicContact CG-CE1 3.79Å; E45-Y52 HydrophobicContact CG-CG 4.38Å
46	S	79.9	Confident	74.7	Confident	90 Å²	90	74.4 Å²	74.4	63%	0.629	39%	0.385	S	S	*	.	H	α-helix	trans	-78.6	-24.2	175.4	-168.4	0	0	0	0	114.1	T42 E44	T42-S46 PolarHBondContact O-N 3.24Å; E44-S46 PolarHBondContact O-N 3.02Å
47	R	84.8	Confident	77.5	Confident	153 Å²	153	69.7 Å²	69.7	58%	0.577	36%	0.362	S	S	*	.	H	α-helix	trans	-101.9	-32	-173	-174.3	178.5	176.4	177.5	1.7	113.4	L43 E44 P49	L43-R47 WeakPolarHBondContact O-CB 3.3Å; L43-R47 PolarHBondContact O-N 3.4Å; L43-R47 VanDerWaalsContact O-N 3.12Å; E44-R47 PolarHBondContact O-N 3.37Å; E44-R47 VanDerWaalsContact O-N 3.08Å; R47-P49 VanDerWaalsContact C-CD 3.49Å
48	Y	89	Confident	80.1	Confident	30 Å²	30	64.7 Å²	64.7	12%	0.118	33%	0.334	C	S	.	.	S	Bend	trans	-133.9	55.9	-179	-59.4	-68.7	0	0	0	110.4	E44 V50 H51 Y52 L77 P79 F407	E44-Y48 PolarHBondContact O-N 2.7Å; Y48-V50 VanDerWaalsContact C-N 3.33Å; Y48-V50 PolarHBondContact O-N 3.13Å; Y48-H51 PolarHBondContact O-N 3.22Å; Y48-Y52 WeakPolarHBondContact O-CB 3.46Å; Y48-Y52 PolarHBondContact O-N 3.03Å; Y48-L77 WeakPolarHBondContact CE1-O 3.44Å; Y48-P79 HydrophobicContact CD2-CG 4.36Å; Y48-P79 HydrophobicContact CE2-CG 3.55Å; Y48-F407 AromaticContact CD2-CD1 3.86Å; Y48-F407 HydrophobicContact CD2-CD1 3.86Å; Y48-F407 HydrophobicContact CD2-CG 4.49Å; Y48-F407 HydrophobicContact CG-CD1 4.21Å; Y48-F407 HydrophobicContact CG-CE1 4.46Å
49	P	89.7	Confident	82.4	Confident	39 Å²	39	63 Å²	63	25%	0.253	32%	0.316	S	S	.	.	H	α-helix	trans	-56.5	-43.6	-169.9	20.5	-32.8	0	0	0	113	E45 R47 Y52 L53	E45-P49 WeakPolarHBondContact O-CA 3.21Å; E45-P49 WeakPolarHBondContact O-CB 3.39Å; R47-P49 VanDerWaalsContact C-CD 3.49Å; P49-Y52 PolarHBondContact O-N 2.94Å; P49-L53 VanDerWaalsContact O-CG 3.31Å; P49-L53 WeakPolarHBondContact O-CG 3.28Å; P49-L53 PolarHBondContact O-N 3.13Å
50	V	93.3	Very high	84.7	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-64.7	-50	180	-163.7	0	0	0	0	110.7	Y48 Y52 L53 V54 L62 T72 P84 L100	Y48-V50 VanDerWaalsContact C-N 3.33Å; Y48-V50 PolarHBondContact O-N 3.13Å; V50-Y52 VanDerWaalsContact C-N 3.32Å; V50-Y52 PolarHBondContact O-N 2.61Å; V50-L53 PolarHBondContact O-N 2.83Å; V50-V54 WeakPolarHBondContact O-CG2 3.37Å; V50-V54 PolarHBondContact O-N 2.93Å; V50-L62 HydrophobicContact CG1-CD1 3.51Å; V50-T72 HydrophobicContact CG2-CG2 3.37Å; V50-P84 HydrophobicContact CB-CB 4.28Å; V50-P84 HydrophobicContact CB-CG 3.94Å; V50-P84 HydrophobicContact CG1-CB 3.65Å; V50-P84 HydrophobicContact CG1-CG 3.67Å; V50-L100 HydrophobicContact CG1-CD2 4.05Å
51	H	93.9	Very high	86.7	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-63.8	-35.4	178.5	-51	78.7	0	0	0	112.4	Y48 V54 W55 S76 R82 P84 L87 F407	Y48-H51 PolarHBondContact O-N 3.22Å; H51-V54 PolarHBondContact O-N 3.47Å; H51-W55 VanDerWaalsContact O-CB 3.27Å; H51-W55 WeakPolarHBondContact O-CB 3.32Å; H51-W55 PolarHBondContact O-N 2.89Å; H51-S76 PolarHBondContact CE1-O 2.89Å; H51-S76 PolarHBondContact NE2-O 2.97Å; H51-R82 PolarHBondContact NE2-O 2.71Å; H51-P84 WeakPolarHBondContact NE2-CD 3.3Å; H51-L87 HydrophobicContact CB-CD2 3.76Å; H51-L87 WeakPolarHBondContact O-CD2 3.4Å; H51-F407 HydrophobicContact CB-CE1 3.7Å; H51-F407 HydrophobicContact CB-CZ 3.83Å
52	Y	92.3	Very high	88.2	Confident	29 Å²	29	57.1 Å²	57.1	11%	0.114	27%	0.271	C	S	.	.	H	α-helix	trans	-68.1	-39	176.4	-176	-100.2	0	0	0	112.2	E45 Y48 P49 V50 H56 A403 F407	E45-Y52 HydrophobicContact CB-CD1 3.64Å; E45-Y52 HydrophobicContact CB-CD2 4.47Å; E45-Y52 HydrophobicContact CB-CE1 3.78Å; E45-Y52 HydrophobicContact CB-CG 4.02Å; E45-Y52 HydrophobicContact CG-CD1 3.6Å; E45-Y52 HydrophobicContact CG-CE1 3.79Å; E45-Y52 HydrophobicContact CG-CG 4.38Å; Y48-Y52 WeakPolarHBondContact O-CB 3.46Å; Y48-Y52 PolarHBondContact O-N 3.03Å; P49-Y52 PolarHBondContact O-N 2.94Å; V50-Y52 VanDerWaalsContact C-N 3.32Å; V50-Y52 PolarHBondContact O-N 2.61Å; Y52-H56 AromaticContact CD2-CD2 3.97Å; Y52-H56 AromaticContact CE1-CD2 3.89Å; Y52-H56 AromaticContact CE2-CD2 3.57Å; Y52-H56 AromaticContact CE2-NE2 3.27Å; Y52-H56 VanDerWaalsContact CE2-NE2 3.27Å; Y52-H56 WeakPolarHBondContact CE2-NE2 3.39Å; Y52-H56 AromaticContact CZ-CD2 3.51Å; Y52-H56 AromaticContact CZ-NE2 3.39Å; Y52-H56 PolarHBondContact O-CD2 3.32Å; Y52-H56 PolarHBondContact O-N 3.41Å; Y52-H56 PolarHBondContact OH-NE2 3.44Å; Y52-A403 HydrophobicContact CE2-CB 4.42Å; Y52-F407 HydrophobicContact CD2-CE2 4.38Å
53	L	93.6	Very high	89.3	Confident	14 Å²	14	59.4 Å²	59.4	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-40.4	172.2	-68.6	175.7	0	0	0	111.7	P49 V50 N57 K58 Q61 L62 E65	P49-L53 VanDerWaalsContact O-CG 3.31Å; P49-L53 WeakPolarHBondContact O-CG 3.28Å; P49-L53 PolarHBondContact O-N 3.13Å; V50-L53 PolarHBondContact O-N 2.83Å; L53-N57 PolarHBondContact O-N 3.19Å; L53-K58 HydrophobicContact CB-CB 4.47Å; L53-K58 HydrophobicContact CD2-CB 4.01Å; L53-K58 HydrophobicContact CD2-CD 3.75Å; L53-K58 WeakPolarHBondContact O-CB 3.22Å; L53-K58 PolarHBondContact O-N 3Å; L53-Q61 HydrophobicContact CD1-CB 4.46Å; L53-Q61 HydrophobicContact CD2-CB 3.87Å; L53-L62 HydrophobicContact CB-CB 4.32Å; L53-L62 HydrophobicContact CB-CD1 4.41Å; L53-E65 HydrophobicContact CD1-CB 4Å; L53-E65 HydrophobicContact CD1-CG 4.31Å
54	V	94.5	Very high	90.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-47.6	173.5	171.7	0	0	0	0	111.5	V50 H51 H56 N57 L62 P84 L87 A88 Y93 C96 L100	V50-V54 WeakPolarHBondContact O-CG2 3.37Å; V50-V54 PolarHBondContact O-N 2.93Å; H51-V54 PolarHBondContact O-N 3.47Å; V54-H56 PolarHBondContact O-N 3.28Å; V54-N57 WeakPolarHBondContact O-CA 3.47Å; V54-N57 PolarHBondContact O-N 2.96Å; V54-L62 HydrophobicContact CG2-CD1 4.19Å; V54-L62 HydrophobicContact CG2-CD2 3.82Å; V54-P84 HydrophobicContact CG2-CB 4.3Å; V54-L87 HydrophobicContact CB-CD2 4.38Å; V54-L87 HydrophobicContact CG1-CB 4.18Å; V54-L87 HydrophobicContact CG1-CD2 4.17Å; V54-L87 HydrophobicContact CG1-CG 3.91Å; V54-A88 HydrophobicContact CG1-CB 3.69Å; V54-Y93 WeakPolarHBondContact O-CD2 3.41Å; V54-Y93 VanDerWaalsContact O-CE2 3.26Å; V54-Y93 WeakPolarHBondContact O-CE2 3.45Å; V54-C96 HydrophobicContact CG2-CB 4.41Å; V54-L100 HydrophobicContact CG2-CD1 3.96Å
55	W	91.9	Very high	90.8	Very high	23 Å²	23	61 Å²	61	9%	0.087	28%	0.281	C	S	.	.	H	α-helix	trans	-54.8	-39.3	-179.1	179.6	-89.5	0	0	0	112.8	H51 N57 L87 L91 L401 Y406 F407 I419	H51-W55 VanDerWaalsContact O-CB 3.27Å; H51-W55 WeakPolarHBondContact O-CB 3.32Å; H51-W55 PolarHBondContact O-N 2.89Å; W55-N57 VanDerWaalsContact C-N 3.33Å; W55-L87 HydrophobicContact CE3-CD1 4.17Å; W55-L91 HydrophobicContact CE3-CD1 4.07Å; W55-L401 HydrophobicContact CH2-CB 4.38Å; W55-L401 WeakPolarHBondContact CZ2-O 3.49Å; W55-Y406 AromaticContact CE3-CD1 3.98Å; W55-Y406 HydrophobicContact CE3-CD1 3.98Å; W55-Y406 HydrophobicContact CE3-CD2 4.34Å; W55-Y406 HydrophobicContact CE3-CE1 4.36Å; W55-Y406 AromaticContact CE3-CG 3.99Å; W55-Y406 HydrophobicContact CE3-CG 3.99Å; W55-Y406 AromaticContact CH2-CD2 3.75Å; W55-Y406 HydrophobicContact CH2-CD2 3.75Å; W55-Y406 AromaticContact CH2-CG 3.72Å; W55-Y406 HydrophobicContact CH2-CG 3.72Å; W55-Y406 AromaticContact CZ3-CD1 3.79Å; W55-Y406 HydrophobicContact CZ3-CD1 3.79Å; W55-Y406 AromaticContact CZ3-CD2 3.37Å; W55-Y406 HydrophobicContact CZ3-CD2 3.37Å; W55-Y406 HydrophobicContact CZ3-CE1 4.24Å; W55-Y406 AromaticContact CZ3-CE2 3.83Å; W55-Y406 HydrophobicContact CZ3-CE2 3.83Å; W55-Y406 AromaticContact CZ3-CG 3.34Å; W55-Y406 HydrophobicContact CZ3-CG 3.34Å; W55-F407 HydrophobicContact CB-CE2 4.28Å; W55-F407 HydrophobicContact CB-CZ 4.36Å; W55-F407 HydrophobicContact CD2-CE2 4.47Å; W55-F407 HydrophobicContact CG-CE2 4.28Å; W55-I419 HydrophobicContact CH2-CG2 3.69Å; W55-I419 HydrophobicContact CZ3-CD1 4.33Å; W55-I419 HydrophobicContact CZ3-CG2 3.71Å
56	H	91.6	Very high	91.3	Very high	81 Å²	81	59.8 Å²	59.8	38%	0.375	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	12.2	176.8	-70	-69.5	0	0	0	114.1	Y52 V54 K58	Y52-H56 AromaticContact CD2-CD2 3.97Å; Y52-H56 AromaticContact CE1-CD2 3.89Å; Y52-H56 AromaticContact CE2-CD2 3.57Å; Y52-H56 AromaticContact CE2-NE2 3.27Å; Y52-H56 VanDerWaalsContact CE2-NE2 3.27Å; Y52-H56 WeakPolarHBondContact CE2-NE2 3.39Å; Y52-H56 AromaticContact CZ-CD2 3.51Å; Y52-H56 AromaticContact CZ-NE2 3.39Å; Y52-H56 PolarHBondContact O-CD2 3.32Å; Y52-H56 PolarHBondContact O-N 3.41Å; Y52-H56 PolarHBondContact OH-NE2 3.44Å; V54-H56 PolarHBondContact O-N 3.28Å; H56-K58 HydrophobicContact CB-CD 3.74Å; H56-K58 HydrophobicContact CB-CG 3.78Å; H56-K58 PolarHBondContact O-N 3.1Å; H56-K58 VanDerWaalsContact O-N 3.14Å
57	N	93.6	Very high	91.6	Very high	63 Å²	63	59.1 Å²	59.1	34%	0.337	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	35	-175	-160.1	13	0	0	0	114	L53 V54 W55 H59 Y93 C96	L53-N57 PolarHBondContact O-N 3.19Å; V54-N57 WeakPolarHBondContact O-CA 3.47Å; V54-N57 PolarHBondContact O-N 2.96Å; W55-N57 VanDerWaalsContact C-N 3.33Å; N57-H59 PolarHBondContact O-N 2.97Å; N57-Y93 HydrophobicContact CB-CD1 4.33Å; N57-Y93 HydrophobicContact CB-CD2 3.78Å; N57-Y93 HydrophobicContact CB-CE1 4.27Å; N57-Y93 HydrophobicContact CB-CE2 3.69Å; N57-Y93 HydrophobicContact CB-CG 4.11Å; N57-C96 PolarHBondContact OD1-SG 2.85Å
58	K	93.8	Very high	91.5	Very high	64 Å²	64	57.5 Å²	57.5	28%	0.278	28%	0.282	S	S	.	.			trans	-80.6	51	-176	-67.1	168	173.6	172.8	0	111.2	L53 H56 R60 Q61 L62	L53-K58 HydrophobicContact CB-CB 4.47Å; L53-K58 HydrophobicContact CD2-CB 4.01Å; L53-K58 HydrophobicContact CD2-CD 3.75Å; L53-K58 WeakPolarHBondContact O-CB 3.22Å; L53-K58 PolarHBondContact O-N 3Å; H56-K58 HydrophobicContact CB-CD 3.74Å; H56-K58 HydrophobicContact CB-CG 3.78Å; H56-K58 PolarHBondContact O-N 3.1Å; H56-K58 VanDerWaalsContact O-N 3.14Å; K58-R60 VanDerWaalsContact C-N 3.31Å; K58-R60 PolarHBondContact O-N 2.96Å; K58-R60 VanDerWaalsContact O-N 3.14Å; K58-Q61 HydrophobicContact CB-CB 4.2Å; K58-Q61 WeakPolarHBondContact O-CA 3.48Å; K58-Q61 WeakPolarHBondContact O-CB 3.48Å; K58-Q61 PolarHBondContact O-N 3.32Å; K58-L62 PolarHBondContact O-N 2.99Å
59	H	93.8	Very high	90.9	Very high	59 Å²	59	58.1 Å²	58.1	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-51.5	-41.1	-170.8	73	107.9	0	0	0	114.1	N57 Q61 L62 E63 D95 I99	N57-H59 PolarHBondContact O-N 2.97Å; H59-Q61 VanDerWaalsContact C-N 3.27Å; H59-Q61 PolarHBondContact O-N 2.82Å; H59-L62 WeakPolarHBondContact O-CB 3.47Å; H59-L62 PolarHBondContact O-N 3Å; H59-E63 WeakPolarHBondContact O-CB 3.17Å; H59-E63 PolarHBondContact O-N 3Å; H59-D95 HydrophobicContact CB-CB 4.22Å; H59-I99 HydrophobicContact CB-CD1 3.83Å; H59-I99 WeakPolarHBondContact O-CD1 3.15Å
60	R	94.5	Very high	89.7	Confident	179 Å²	179	63.8 Å²	63.8	68%	0.675	31%	0.314	S	S	*	.	H	α-helix	trans	-69.1	-15.4	175.4	-62.1	-175.8	-176.3	171.8	0.5	115.5	K58 K64	K58-R60 VanDerWaalsContact C-N 3.31Å; K58-R60 PolarHBondContact O-N 2.96Å; K58-R60 VanDerWaalsContact O-N 3.14Å; R60-K64 WeakPolarHBondContact O-CD 3.14Å; R60-K64 WeakPolarHBondContact O-CG 3.4Å
61	Q	92.4	Very high	88.5	Confident	105 Å²	105	72.5 Å²	72.5	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-95	-38.1	173.1	-64.4	-178.1	-3	0	0	109.9	L53 K58 H59 E63 K64 E65	L53-Q61 HydrophobicContact CD1-CB 4.46Å; L53-Q61 HydrophobicContact CD2-CB 3.87Å; K58-Q61 HydrophobicContact CB-CB 4.2Å; K58-Q61 WeakPolarHBondContact O-CA 3.48Å; K58-Q61 WeakPolarHBondContact O-CB 3.48Å; K58-Q61 PolarHBondContact O-N 3.32Å; H59-Q61 VanDerWaalsContact C-N 3.27Å; H59-Q61 PolarHBondContact O-N 2.82Å; Q61-E63 PolarHBondContact O-N 2.78Å; Q61-K64 PolarHBondContact O-N 3.15Å; Q61-K64 VanDerWaalsContact O-N 3.15Å; Q61-E65 PolarHBondContact O-N 2.74Å
62	L	93.3	Very high	87.9	Confident	1 Å²	1	74.1 Å²	74.1	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-54.6	-50.1	171.1	179.9	65.1	0	0	0	111.8	V50 L53 V54 K58 H59 K64 E65 L66 C96 I99 L100	V50-L62 HydrophobicContact CG1-CD1 3.51Å; L53-L62 HydrophobicContact CB-CB 4.32Å; L53-L62 HydrophobicContact CB-CD1 4.41Å; V54-L62 HydrophobicContact CG2-CD1 4.19Å; V54-L62 HydrophobicContact CG2-CD2 3.82Å; K58-L62 PolarHBondContact O-N 2.99Å; H59-L62 WeakPolarHBondContact O-CB 3.47Å; H59-L62 PolarHBondContact O-N 3Å; L62-K64 VanDerWaalsContact C-N 3.3Å; L62-K64 PolarHBondContact O-N 3.07Å; L62-E65 PolarHBondContact O-N 3.25Å; L62-L66 HydrophobicContact CD1-CD1 3.83Å; L62-L66 HydrophobicContact CD1-CG 4.29Å; L62-L66 HydrophobicContact CG-CD1 3.92Å; L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.44Å; L62-L66 PolarHBondContact O-N 2.91Å; L62-C96 HydrophobicContact CD2-CB 3.89Å; L62-I99 HydrophobicContact CD2-CG2 4.46Å; L62-I99 HydrophobicContact CG-CG2 4.3Å; L62-L100 HydrophobicContact CD1-CD2 4.38Å; L62-L100 HydrophobicContact CD2-CD1 4.4Å; L62-L100 HydrophobicContact CD2-CG 4.22Å
63	E	92.6	Very high	87.6	Confident	97 Å²	97	77.1 Å²	77.1	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-55.1	-42.9	174.5	-176.8	179.5	-142.6	0	0	112.3	H59 Q61 A67 I99	H59-E63 WeakPolarHBondContact O-CB 3.17Å; H59-E63 PolarHBondContact O-N 3Å; Q61-E63 PolarHBondContact O-N 2.78Å; E63-A67 WeakPolarHBondContact O-CB 3.02Å; E63-A67 PolarHBondContact O-N 3.05Å; E63-I99 HydrophobicContact CB-CD1 4.17Å; E63-I99 HydrophobicContact CB-CG2 4.2Å
64	K	91.1	Very high	87.4	Confident	140 Å²	140	77.5 Å²	77.5	61%	0.609	39%	0.386	S	S	*	.	H	α-helix	trans	-70.6	-42.3	179.1	-70.3	-180	-178.9	-170.5	0	112.6	R60 Q61 L62 L66 A67 T68	R60-K64 WeakPolarHBondContact O-CD 3.14Å; R60-K64 WeakPolarHBondContact O-CG 3.4Å; Q61-K64 PolarHBondContact O-N 3.15Å; Q61-K64 VanDerWaalsContact O-N 3.15Å; L62-K64 VanDerWaalsContact C-N 3.3Å; L62-K64 PolarHBondContact O-N 3.07Å; K64-L66 VanDerWaalsContact C-N 3.34Å; K64-A67 PolarHBondContact O-N 2.85Å; K64-T68 VanDerWaalsContact O-CB 3.25Å; K64-T68 WeakPolarHBondContact O-CB 3.31Å; K64-T68 PolarHBondContact O-N 3.13Å; K64-T68 PolarHBondContact O-OG1 3.33Å
65	E	88.9	Confident	87.4	Confident	67 Å²	67	79 Å²	79	31%	0.313	39%	0.393	S	S	.	.	H	α-helix	trans	-61.5	-46.1	179	-165.7	75.5	170.7	0	0	110.2	L53 Q61 L62 A67 T68 S69	L53-E65 HydrophobicContact CD1-CB 4Å; L53-E65 HydrophobicContact CD1-CG 4.31Å; Q61-E65 PolarHBondContact O-N 2.74Å; L62-E65 PolarHBondContact O-N 3.25Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.38Å; E65-T68 PolarHBondContact O-N 3.16Å; E65-S69 WeakPolarHBondContact O-CB 3.43Å; E65-S69 PolarHBondContact O-N 2.94Å
66	L	88.7	Confident	87.4	Confident	16 Å²	16	79.6 Å²	79.6	8%	0.084	40%	0.4	C	S	.	.	H	α-helix	trans	-70.9	-24.8	178.6	-64.7	172.1	0	0	0	113.8	L62 K64 T72 V74 I99 L100 H103	L62-L66 HydrophobicContact CD1-CD1 3.83Å; L62-L66 HydrophobicContact CD1-CG 4.29Å; L62-L66 HydrophobicContact CG-CD1 3.92Å; L62-L66 WeakPolarHBondContact O-CB 3.37Å; L62-L66 VanDerWaalsContact O-CG 3.25Å; L62-L66 WeakPolarHBondContact O-CG 3.44Å; L62-L66 PolarHBondContact O-N 2.91Å; K64-L66 VanDerWaalsContact C-N 3.34Å; L66-T72 HydrophobicContact CD2-CG2 3.71Å; L66-V74 HydrophobicContact CD2-CG1 3.67Å; L66-I99 HydrophobicContact CD1-CG2 3.95Å; L66-L100 HydrophobicContact CD1-CD2 3.97Å; L66-H103 HydrophobicContact CD1-CB 4.33Å; L66-H103 PolarHBondContact O-CE1 3.19Å; L66-H103 PolarHBondContact O-ND1 2.63Å
67	A	86.1	Confident	87.4	Confident	77 Å²	77	80.4 Å²	80.4	64%	0.636	41%	0.407	S	S	*	.	H	α-helix	trans	-87.3	-19.9	173	0	0	0	0	0	114.1	E63 K64 E65	E63-A67 WeakPolarHBondContact O-CB 3.02Å; E63-A67 PolarHBondContact O-N 3.05Å; K64-A67 PolarHBondContact O-N 2.85Å; E65-A67 VanDerWaalsContact C-N 3.34Å; E65-A67 PolarHBondContact O-N 3.38Å
68	T	83.8	Confident	87.3	Confident	118 Å²	118	77.7 Å²	77.7	72%	0.724	39%	0.392	S	S	*	.	H	α-helix	trans	-97.6	-35	-176.8	-51.3	0	0	0	0	112.3	K64 E65	K64-T68 VanDerWaalsContact O-CB 3.25Å; K64-T68 WeakPolarHBondContact O-CB 3.31Å; K64-T68 PolarHBondContact O-N 3.13Å; K64-T68 PolarHBondContact O-OG1 3.33Å; E65-T68 PolarHBondContact O-N 3.16Å
69	S	75.8	Confident	87	Confident	43 Å²	43	76.1 Å²	76.1	30%	0.301	39%	0.389	S	S	.	.			trans	-101.1	100	-178.3	176.2	0	0	0	0	111	E65 Q71 T72	E65-S69 WeakPolarHBondContact O-CB 3.43Å; E65-S69 PolarHBondContact O-N 2.94Å; S69-Q71 PolarHBondContact O-N 3.11Å; S69-T72 WeakPolarHBondContact CB-OG1 3.39Å; S69-T72 PolarHBondContact O-N 3.2Å; S69-T72 PolarHBondContact OG-N 3.15Å; S69-T72 PolarHBondContact OG-OG1 3.44Å
70	E	65.1	Low	86.7	Confident	159 Å²	159	75.3 Å²	75.3	74%	0.743	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-5.7	171.1	-79.8	-158.8	-152.9	0	0	114.1	R254	E70-R254 IonicContact OE2-CZ 2.68Å; E70-R254 IonicContact OE2-NE 2.75Å; E70-R254 PolarHBondContact OE2-NE 3.46Å; E70-R254 IonicContact OE2-NH2 2.78Å; E70-R254 PolarHBondContact OE2-NH2 3.41Å
71	Q	66.6	Low	86.4	Confident	186 Å²	186	67.3 Å²	67.3	87%	0.869	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	9.9	-169.9	-149.7	155.2	11.3	0	0	113	S69 D73	S69-Q71 PolarHBondContact O-N 3.11Å; Q71-D73 PolarHBondContact O-N 3.06Å
72	T	82	Confident	86.5	Confident	35 Å²	35	63.1 Å²	63.1	22%	0.215	34%	0.336	C	S	.	.			trans	-77.6	114.7	174.4	-67	0	0	0	0	111	V50 L66 S69 V74	V50-T72 HydrophobicContact CG2-CG2 3.37Å; L66-T72 HydrophobicContact CD2-CG2 3.71Å; S69-T72 WeakPolarHBondContact CB-OG1 3.39Å; S69-T72 PolarHBondContact O-N 3.2Å; S69-T72 PolarHBondContact OG-N 3.15Å; S69-T72 PolarHBondContact OG-OG1 3.44Å; T72-V74 PolarHBondContact O-N 3.22Å
73	D	86.1	Confident	86.6	Confident	92 Å²	92	63.1 Å²	63.1	49%	0.492	34%	0.337	S	S	.	.			trans	-75.2	105.9	175.8	178.8	19	0	0	0	111.8	Q71 E75 S76	Q71-D73 PolarHBondContact O-N 3.06Å; D73-E75 PolarHBondContact O-N 3.36Å; D73-E75 WeakPolarHBondContact OD1-CA 3.1Å; D73-E75 WeakPolarHBondContact OD1-CB 3.31Å; D73-E75 PolarHBondContact OD1-N 2.87Å; D73-S76 WeakPolarHBondContact O-CB 3.33Å; D73-S76 PolarHBondContact O-N 3.29Å; D73-S76 PolarHBondContact O-OG 3.1Å; D73-S76 WeakPolarHBondContact OD2-CA 3.49Å; D73-S76 PolarHBondContact OD2-N 2.82Å
74	V	90.3	Very high	86.8	Confident	23 Å²	23	58.5 Å²	58.5	14%	0.139	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-10.3	174.8	-61.4	0	0	0	0	113.6	L66 T72 P84 H103 A105	L66-V74 HydrophobicContact CD2-CG1 3.67Å; T72-V74 PolarHBondContact O-N 3.22Å; V74-P84 WeakPolarHBondContact O-CD 3.45Å; V74-H103 HydrophobicContact CG1-CB 4.49Å; V74-A105 HydrophobicContact CB-CB 4.37Å; V74-A105 HydrophobicContact CG2-CB 4.3Å
75	E	93.1	Very high	87	Confident	31 Å²	31	51.9 Å²	51.9	15%	0.145	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	2.2	178.7	-64.5	-58.5	143.1	0	0	113.3	D73 A105 D106 K109	D73-E75 PolarHBondContact O-N 3.36Å; D73-E75 WeakPolarHBondContact OD1-CA 3.1Å; D73-E75 WeakPolarHBondContact OD1-CB 3.31Å; D73-E75 PolarHBondContact OD1-N 2.87Å; E75-A105 WeakPolarHBondContact OE1-CA 3.4Å; E75-D106 PolarHBondContact OE1-N 2.87Å; E75-K109 VanDerWaalsContact CD-NZ 3.29Å; E75-K109 VanDerWaalsContact CG-NZ 3.29Å; E75-K109 WeakPolarHBondContact OE2-CD 3.48Å; E75-K109 WeakPolarHBondContact OE2-CE 3.45Å; E75-K109 WeakPolarHBondContact OE2-CG 3.49Å; E75-K109 IonicContact OE2-NZ 3.42Å; E75-K109 PolarHBondContact OE2-NZ 3.11Å
76	S	91.8	Very high	87.3	Confident	35 Å²	35	48.7 Å²	48.7	25%	0.245	27%	0.271	C	S	.	.			trans	-59.4	140.5	-179.6	54.6	0	0	0	0	112.4	H51 D73 P84	H51-S76 PolarHBondContact CE1-O 2.89Å; H51-S76 PolarHBondContact NE2-O 2.97Å; D73-S76 WeakPolarHBondContact O-CB 3.33Å; D73-S76 PolarHBondContact O-N 3.29Å; D73-S76 PolarHBondContact O-OG 3.1Å; D73-S76 WeakPolarHBondContact OD2-CA 3.49Å; D73-S76 PolarHBondContact OD2-N 2.82Å; S76-P84 WeakPolarHBondContact O-CD 3.33Å
77	L	93	Very high	87.6	Confident	98 Å²	98	47.9 Å²	47.9	51%	0.513	27%	0.267	S	S	.	.			trans	-99.7	133.2	-174.8	-63.3	-178.7	0	0	0	112.5	Y48 R82 T83	Y48-L77 WeakPolarHBondContact CE1-O 3.44Å; L77-R82 WeakPolarHBondContact CA-O 3.28Å; L77-T83 HydrophobicContact CD2-CG2 3.8Å
78	D	90.9	Very high	88	Confident	7 Å²	7	44.2 Å²	44.2	4%	0.037	24%	0.237	C	C	.	.			trans	-72.7	175.1	170.3	80.3	2.2	0	0	0	112.1	R80 G81 R82 Y406 F407	D78-R80 PolarHBondContact O-N 2.97Å; D78-R80 VanDerWaalsContact OD1-C 3.31Å; D78-R80 VanDerWaalsContact OD1-CA 3.31Å; D78-R80 WeakPolarHBondContact OD1-CA 3.24Å; D78-R80 WeakPolarHBondContact OD1-CB 3.49Å; D78-R80 PolarHBondContact OD1-N 2.88Å; D78-G81 PolarHBondContact O-N 3.2Å; D78-G81 PolarHBondContact OD1-N 3.36Å; D78-R82 PolarHBondContact N-O 3.03Å; D78-R82 PolarHBondContact OD1-N 2.97Å; D78-Y406 VanDerWaalsContact OD2-CE1 3.23Å; D78-Y406 WeakPolarHBondContact OD2-CE1 3.25Å; D78-Y406 PolarHBondContact OD2-OH 2.95Å; D78-F407 HydrophobicContact CB-CE1 4.37Å
79	P	88.3	Confident	88.5	Confident	31 Å²	31	38.6 Å²	38.6	20%	0.201	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.5	178.6	-24.9	36	0	0	0	115.2	Y48 F407	Y48-P79 HydrophobicContact CD2-CG 4.36Å; Y48-P79 HydrophobicContact CE2-CG 3.55Å; P79-F407 VanDerWaalsContact CG-O 3.32Å; P79-F407 WeakPolarHBondContact CG-O 3.39Å
80	R	85.6	Confident	89.3	Confident	41 Å²	41	37.1 Å²	37.1	16%	0.155	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-7.5	177.3	-58.4	-172.7	-178.3	-125.8	-12.1	111.9	D78 R112 Y406 R417 D418	D78-R80 PolarHBondContact O-N 2.97Å; D78-R80 VanDerWaalsContact OD1-C 3.31Å; D78-R80 VanDerWaalsContact OD1-CA 3.31Å; D78-R80 WeakPolarHBondContact OD1-CA 3.24Å; D78-R80 WeakPolarHBondContact OD1-CB 3.49Å; D78-R80 PolarHBondContact OD1-N 2.88Å; R80-R112 WeakPolarHBondContact O-CB 3.42Å; R80-R112 VanDerWaalsContact O-CD 3.22Å; R80-R112 WeakPolarHBondContact O-CD 3.48Å; R80-Y406 PolarHBondContact NE-O 3.49Å; R80-R417 PolarHBondContact NH1-O 3.01Å; R80-D418 WeakPolarHBondContact CD-OD1 3.39Å; R80-D418 IonicContact CZ-OD1 3.4Å; R80-D418 IonicContact NE-OD1 2.71Å; R80-D418 IonicContact NH1-OD1 3.2Å; R80-D418 PolarHBondContact NH1-OD1 3.25Å
81	G	89.8	Confident	90.5	Very high	12 Å²	12	29.8 Å²	29.8	12%	0.124	16%	0.158	C	C	.	.	S	Bend	trans	76.3	39.2	-178.2	0	0	0	0	0	113	D78 N111 R112	D78-G81 PolarHBondContact O-N 3.2Å; D78-G81 PolarHBondContact OD1-N 3.36Å; G81-N111 WeakPolarHBondContact O-CA 3.39Å; G81-R112 PolarHBondContact O-N 2.79Å
82	R	92.9	Very high	91.6	Very high	16 Å²	16	22.3 Å²	22.3	6%	0.06	13%	0.13	C	C	.	.			trans	-100.8	141.3	165.7	-67.7	-174.8	173.5	98.2	6.2	110.4	H51 L77 D78 H86 Y406 D418	H51-R82 PolarHBondContact NE2-O 2.71Å; L77-R82 WeakPolarHBondContact CA-O 3.28Å; D78-R82 PolarHBondContact N-O 3.03Å; D78-R82 PolarHBondContact OD1-N 2.97Å; R82-H86 HydrophobicContact CB-CB 3.8Å; R82-H86 HydrophobicContact CG-CB 4.09Å; R82-Y406 PolarHBondContact NH1-OH 2.81Å; R82-Y406 VanDerWaalsContact NH1-OH 3.07Å; R82-D418 IonicContact CZ-OD1 3.1Å; R82-D418 IonicContact CZ-OD2 2.76Å; R82-D418 IonicContact NH1-OD1 3.38Å; R82-D418 PolarHBondContact NH1-OD1 3.38Å; R82-D418 IonicContact NH1-OD2 3.25Å; R82-D418 PolarHBondContact NH1-OD2 3.22Å; R82-D418 IonicContact NH2-OD1 2.93Å; R82-D418 IonicContact NH2-OD2 3.5Å; R82-D418 PolarHBondContact NH2-OD2 3.4Å
83	T	96	Very high	92.2	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.012	13%	0.131	C	C	.	.			trans	-71.7	164.4	162	67.6	0	0	0	0	109.9	L77 L85 H86 L87	L77-T83 HydrophobicContact CD2-CG2 3.8Å; T83-L85 PolarHBondContact O-N 2.97Å; T83-H86 WeakPolarHBondContact O-CB 3.28Å; T83-H86 PolarHBondContact O-N 2.88Å; T83-H86 VanDerWaalsContact O-N 3.17Å; T83-H86 PolarHBondContact OG1-N 2.68Å; T83-H86 PolarHBondContact OG1-ND1 2.7Å; T83-L87 PolarHBondContact O-N 2.91Å
84	P	96.1	Very high	92.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58.7	-31.7	174.5	-18.8	31.2	0	0	0	112.2	V50 H51 V54 V74 S76 L87 A88 L100	V50-P84 HydrophobicContact CB-CB 4.28Å; V50-P84 HydrophobicContact CB-CG 3.94Å; V50-P84 HydrophobicContact CG1-CB 3.65Å; V50-P84 HydrophobicContact CG1-CG 3.67Å; H51-P84 WeakPolarHBondContact NE2-CD 3.3Å; V54-P84 HydrophobicContact CG2-CB 4.3Å; V74-P84 WeakPolarHBondContact O-CD 3.45Å; S76-P84 WeakPolarHBondContact O-CD 3.33Å; P84-L87 PolarHBondContact O-N 2.91Å; P84-A88 WeakPolarHBondContact O-CB 3.49Å; P84-A88 PolarHBondContact O-N 2.85Å; P84-L100 HydrophobicContact CB-CD1 3.92Å; P84-L100 HydrophobicContact CB-CD2 3.96Å
85	L	97	Very high	92.8	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.4	-42.9	176.8	178.2	60.2	0	0	0	111.7	T83 L87 A88 V89 A97 L100 L101 A105 V117	T83-L85 PolarHBondContact O-N 2.97Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.33Å; L85-A88 PolarHBondContact O-N 2.7Å; L85-V89 HydrophobicContact CD1-CG2 4.34Å; L85-V89 WeakPolarHBondContact O-CB 3.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.39Å; L85-V89 PolarHBondContact O-N 2.87Å; L85-A97 HydrophobicContact CD1-CB 4.08Å; L85-L100 HydrophobicContact CB-CB 4.46Å; L85-L100 HydrophobicContact CB-CD1 4.38Å; L85-L100 HydrophobicContact CD1-CB 4.3Å; L85-L101 HydrophobicContact CD1-CD1 4.43Å; L85-L101 HydrophobicContact CD1-CD2 4.13Å; L85-L101 HydrophobicContact CD1-CG 3.93Å; L85-L101 HydrophobicContact CD2-CD2 3.6Å; L85-L101 HydrophobicContact CD2-CG 4.29Å; L85-A105 HydrophobicContact CB-CB 4.13Å; L85-A105 HydrophobicContact CD2-CB 3.83Å; L85-V117 HydrophobicContact CD1-CG1 4.37Å; L85-V117 HydrophobicContact CD2-CG1 3.9Å; L85-V117 HydrophobicContact CD2-CG2 4.03Å; L85-V117 HydrophobicContact CG-CG1 3.73Å; L85-V117 HydrophobicContact CG-CG2 4.2Å
86	H	95.4	Very high	92.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.7	-44.4	170	-78.6	99.9	0	0	0	111.5	R82 T83 V89 T90 K109 W115 V117	R82-H86 HydrophobicContact CB-CB 3.8Å; R82-H86 HydrophobicContact CG-CB 4.09Å; T83-H86 WeakPolarHBondContact O-CB 3.28Å; T83-H86 PolarHBondContact O-N 2.88Å; T83-H86 VanDerWaalsContact O-N 3.17Å; T83-H86 PolarHBondContact OG1-N 2.68Å; T83-H86 PolarHBondContact OG1-ND1 2.7Å; H86-V89 PolarHBondContact O-N 3.37Å; H86-T90 WeakPolarHBondContact O-CB 3.2Å; H86-T90 PolarHBondContact O-N 3.36Å; H86-T90 PolarHBondContact O-OG1 2.77Å; H86-T90 VanDerWaalsContact O-OG1 3.05Å; H86-K109 PolarHBondContact CE1-O 3.46Å; H86-K109 PolarHBondContact NE2-O 2.91Å; H86-W115 PolarHBondContact NE2-O 2.74Å; H86-V117 PolarHBondContact NE2-N 2.89Å
87	L	94.2	Very high	93.1	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-63.6	-44.3	179	-177	59.6	0	0	0	111.9	H51 V54 W55 T83 P84 L85 V89 T90 L91 Y406 F407 I419	H51-L87 HydrophobicContact CB-CD2 3.76Å; H51-L87 WeakPolarHBondContact O-CD2 3.4Å; V54-L87 HydrophobicContact CB-CD2 4.38Å; V54-L87 HydrophobicContact CG1-CB 4.18Å; V54-L87 HydrophobicContact CG1-CD2 4.17Å; V54-L87 HydrophobicContact CG1-CG 3.91Å; W55-L87 HydrophobicContact CE3-CD1 4.17Å; T83-L87 PolarHBondContact O-N 2.91Å; P84-L87 PolarHBondContact O-N 2.91Å; L85-L87 VanDerWaalsContact C-N 3.3Å; L85-L87 PolarHBondContact O-N 3.33Å; L87-V89 VanDerWaalsContact C-N 3.31Å; L87-V89 PolarHBondContact O-N 3.46Å; L87-T90 PolarHBondContact O-N 3.49Å; L87-L91 HydrophobicContact CD1-CD1 3.76Å; L87-L91 HydrophobicContact CD1-CG 4.09Å; L87-L91 HydrophobicContact CG-CD1 4.01Å; L87-L91 WeakPolarHBondContact O-CB 3.38Å; L87-L91 WeakPolarHBondContact O-CG 3.4Å; L87-L91 PolarHBondContact O-N 2.86Å; L87-Y406 HydrophobicContact CD1-CE1 4.32Å; L87-F407 HydrophobicContact CD2-CZ 4.43Å; L87-I419 HydrophobicContact CD1-CD1 3.33Å
88	A	95.1	Very high	93.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.3	-40.3	176.4	0	0	0	0	0	111.7	V54 P84 L85 G92 Y93 C96 A97 L100	V54-A88 HydrophobicContact CG1-CB 3.69Å; P84-A88 WeakPolarHBondContact O-CB 3.49Å; P84-A88 PolarHBondContact O-N 2.85Å; L85-A88 PolarHBondContact O-N 2.7Å; A88-G92 PolarHBondContact O-N 3.42Å; A88-Y93 PolarHBondContact O-N 3.05Å; A88-C96 HydrophobicContact CB-CB 3.96Å; A88-A97 HydrophobicContact CB-CB 4.13Å; A88-L100 HydrophobicContact CB-CD1 4.11Å
89	V	94.3	Very high	93.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-67.7	-52.1	176.8	166.2	0	0	0	0	111.4	L85 H86 L87 L91 G92 A97 V117 E120 A121 T124 L129 V133	L85-V89 HydrophobicContact CD1-CG2 4.34Å; L85-V89 WeakPolarHBondContact O-CB 3.39Å; L85-V89 WeakPolarHBondContact O-CG2 3.39Å; L85-V89 PolarHBondContact O-N 2.87Å; H86-V89 PolarHBondContact O-N 3.37Å; L87-V89 VanDerWaalsContact C-N 3.31Å; L87-V89 PolarHBondContact O-N 3.46Å; V89-L91 PolarHBondContact O-N 2.81Å; V89-G92 PolarHBondContact O-N 2.68Å; V89-A97 HydrophobicContact CG2-CB 4.47Å; V89-V117 HydrophobicContact CG2-CG1 3.83Å; V89-E120 HydrophobicContact CG1-CB 4.15Å; V89-A121 VanDerWaalsContact CG1-CA 3.47Å; V89-A121 HydrophobicContact CG1-CB 3.73Å; V89-T124 HydrophobicContact CG1-CG2 4.36Å; V89-T124 VanDerWaalsContact O-CG2 3.28Å; V89-T124 WeakPolarHBondContact O-CG2 3.44Å; V89-L129 HydrophobicContact CB-CD2 4.48Å; V89-L129 HydrophobicContact CG1-CD2 4.17Å; V89-L129 HydrophobicContact CG2-CD1 4.22Å; V89-V133 HydrophobicContact CG2-CG2 4.21Å
90	T	91.4	Very high	93.7	Very high	12 Å²	12	18 Å²	18	7%	0.074	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-27.8	179.2	-55.4	0	0	0	0	112.8	H86 L87 I419	H86-T90 WeakPolarHBondContact O-CB 3.2Å; H86-T90 PolarHBondContact O-N 3.36Å; H86-T90 PolarHBondContact O-OG1 2.77Å; H86-T90 VanDerWaalsContact O-OG1 3.05Å; L87-T90 PolarHBondContact O-N 3.49Å; T90-I419 HydrophobicContact CG2-CB 4.46Å; T90-I419 HydrophobicContact CG2-CD1 3.87Å; T90-I419 HydrophobicContact CG2-CG1 3.78Å
91	L	90.3	Very high	94.1	Very high	5 Å²	5	16.2 Å²	16.2	3%	0.026	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.4	175.2	-66.1	177.9	0	0	0	114.9	W55 L87 V89 Y93 T396 I419	W55-L91 HydrophobicContact CE3-CD1 4.07Å; L87-L91 HydrophobicContact CD1-CD1 3.76Å; L87-L91 HydrophobicContact CD1-CG 4.09Å; L87-L91 HydrophobicContact CG-CD1 4.01Å; L87-L91 WeakPolarHBondContact O-CB 3.38Å; L87-L91 WeakPolarHBondContact O-CG 3.4Å; L87-L91 PolarHBondContact O-N 2.86Å; V89-L91 PolarHBondContact O-N 2.81Å; L91-Y93 VanDerWaalsContact C-N 3.33Å; L91-Y93 HydrophobicContact CB-CD1 4.28Å; L91-Y93 HydrophobicContact CB-CD2 3.75Å; L91-Y93 HydrophobicContact CB-CE1 4.23Å; L91-Y93 HydrophobicContact CB-CE2 3.7Å; L91-Y93 HydrophobicContact CB-CG 4.04Å; L91-Y93 HydrophobicContact CD1-CD2 4.13Å; L91-Y93 HydrophobicContact CD1-CE2 3.67Å; L91-Y93 HydrophobicContact CG-CE2 4.29Å; L91-Y93 VanDerWaalsContact O-CD1 3.25Å; L91-Y93 WeakPolarHBondContact O-CD1 3.17Å; L91-Y93 VanDerWaalsContact O-CE1 3.31Å; L91-Y93 WeakPolarHBondContact O-CE1 3.42Å; L91-T396 WeakPolarHBondContact O-CB 2.99Å; L91-T396 WeakPolarHBondContact O-CG2 3.42Å; L91-T396 PolarHBondContact O-OG1 3.03Å; L91-I419 HydrophobicContact CD2-CB 4.18Å; L91-I419 HydrophobicContact CD2-CD1 3.87Å; L91-I419 HydrophobicContact CD2-CG2 4.25Å; L91-I419 HydrophobicContact CG-CD1 4.05Å
92	G	90	Very high	94.1	Very high	28 Å²	28	21.2 Å²	21.2	29%	0.289	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	72	19.9	-179.2	0	0	0	0	0	114.6	A88 V89 L94	A88-G92 PolarHBondContact O-N 3.42Å; V89-G92 PolarHBondContact O-N 2.68Å; G92-L94 PolarHBondContact O-N 2.64Å; G92-L94 VanDerWaalsContact O-N 3.1Å
93	Y	93.9	Very high	94	Very high	59 Å²	59	24 Å²	24	23%	0.231	12%	0.119	C	C	.	.			trans	-89.2	75.3	-173.2	-63.1	-17.3	0	0	0	111.8	V54 N57 A88 L91 D95 C96 A97	V54-Y93 WeakPolarHBondContact O-CD2 3.41Å; V54-Y93 VanDerWaalsContact O-CE2 3.26Å; V54-Y93 WeakPolarHBondContact O-CE2 3.45Å; N57-Y93 HydrophobicContact CB-CD1 4.33Å; N57-Y93 HydrophobicContact CB-CD2 3.78Å; N57-Y93 HydrophobicContact CB-CE1 4.27Å; N57-Y93 HydrophobicContact CB-CE2 3.69Å; N57-Y93 HydrophobicContact CB-CG 4.11Å; A88-Y93 PolarHBondContact O-N 3.05Å; L91-Y93 VanDerWaalsContact C-N 3.33Å; L91-Y93 HydrophobicContact CB-CD1 4.28Å; L91-Y93 HydrophobicContact CB-CD2 3.75Å; L91-Y93 HydrophobicContact CB-CE1 4.23Å; L91-Y93 HydrophobicContact CB-CE2 3.7Å; L91-Y93 HydrophobicContact CB-CG 4.04Å; L91-Y93 HydrophobicContact CD1-CD2 4.13Å; L91-Y93 HydrophobicContact CD1-CE2 3.67Å; L91-Y93 HydrophobicContact CG-CE2 4.29Å; L91-Y93 VanDerWaalsContact O-CD1 3.25Å; L91-Y93 WeakPolarHBondContact O-CD1 3.17Å; L91-Y93 VanDerWaalsContact O-CE1 3.31Å; L91-Y93 WeakPolarHBondContact O-CE1 3.42Å; Y93-D95 VanDerWaalsContact C-N 3.27Å; Y93-D95 PolarHBondContact O-N 2.77Å; Y93-D95 VanDerWaalsContact O-N 3.16Å; Y93-C96 PolarHBondContact O-N 2.82Å; Y93-A97 PolarHBondContact O-N 3.43Å
94	L	93.9	Very high	93.6	Very high	45 Å²	45	26.3 Å²	26.3	24%	0.236	14%	0.142	C	C	.	.	H	α-helix	trans	-47.8	-42	-177.5	-172.3	69.7	0	0	0	114.1	G92 A97 R98 E128 L129 L132	G92-L94 PolarHBondContact O-N 2.64Å; G92-L94 VanDerWaalsContact O-N 3.1Å; L94-A97 PolarHBondContact O-N 2.95Å; L94-R98 WeakPolarHBondContact O-CB 3.16Å; L94-R98 PolarHBondContact O-N 2.68Å; L94-E128 HydrophobicContact CD2-CB 4.38Å; L94-L129 HydrophobicContact CD1-CB 4.14Å; L94-L129 HydrophobicContact CD1-CD1 3.83Å; L94-L132 HydrophobicContact CD1-CB 4.31Å; L94-L132 HydrophobicContact CD1-CD2 3.67Å; L94-L132 HydrophobicContact CG-CD2 4.45Å
95	D	95.3	Very high	93.5	Very high	64 Å²	64	26.3 Å²	26.3	34%	0.342	14%	0.142	S	C	.	.	H	α-helix	trans	-70.9	-40.2	179.5	-67.9	-31	0	0	0	112.6	H59 Y93 R98 I99	H59-D95 HydrophobicContact CB-CB 4.22Å; Y93-D95 VanDerWaalsContact C-N 3.27Å; Y93-D95 PolarHBondContact O-N 2.77Å; Y93-D95 VanDerWaalsContact O-N 3.16Å; D95-R98 PolarHBondContact O-N 3.46Å; D95-R98 IonicContact OD1-CZ 3.42Å; D95-R98 VanDerWaalsContact OD1-CZ 3.3Å; D95-R98 IonicContact OD1-NH1 2.75Å; D95-R98 PolarHBondContact OD1-NH1 3.32Å; D95-R98 IonicContact OD1-NH2 2.77Å; D95-R98 PolarHBondContact OD1-NH2 2.91Å; D95-I99 WeakPolarHBondContact O-CD1 3.42Å; D95-I99 WeakPolarHBondContact O-CG1 3.17Å; D95-I99 PolarHBondContact O-N 3.44Å; D95-I99 VanDerWaalsContact O-N 3.11Å
96	C	95.7	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.1	-43.1	173.4	-71.4	0	0	0	0	111.1	V54 N57 L62 A88 Y93 I99 L100	V54-C96 HydrophobicContact CG2-CB 4.41Å; N57-C96 PolarHBondContact OD1-SG 2.85Å; L62-C96 HydrophobicContact CD2-CB 3.89Å; A88-C96 HydrophobicContact CB-CB 3.96Å; Y93-C96 PolarHBondContact O-N 2.82Å; C96-I99 PolarHBondContact O-N 2.94Å; C96-L100 WeakPolarHBondContact O-CD1 3.34Å; C96-L100 WeakPolarHBondContact O-CG 3.49Å; C96-L100 PolarHBondContact O-N 3.38Å; C96-L100 VanDerWaalsContact O-N 3.09Å
97	A	96.3	Very high	92.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.9	-44.6	175.4	0	0	0	0	0	111.5	L85 A88 V89 Y93 L94 I99 L100 L101 L129 L132	L85-A97 HydrophobicContact CD1-CB 4.08Å; A88-A97 HydrophobicContact CB-CB 4.13Å; V89-A97 HydrophobicContact CG2-CB 4.47Å; Y93-A97 PolarHBondContact O-N 3.43Å; L94-A97 PolarHBondContact O-N 2.95Å; A97-I99 PolarHBondContact O-N 3.5Å; A97-L100 PolarHBondContact O-N 3.31Å; A97-L101 WeakPolarHBondContact O-CB 3.42Å; A97-L101 WeakPolarHBondContact O-CG 3.48Å; A97-L101 PolarHBondContact O-N 3.17Å; A97-L129 HydrophobicContact CB-CD1 4.02Å; A97-L132 HydrophobicContact CB-CD2 4.48Å
98	R	95.3	Very high	92.5	Very high	83 Å²	83	31.4 Å²	31.4	31%	0.313	18%	0.176	S	C	.	.	H	α-helix	trans	-59.9	-44.2	178.3	-163.2	-175.7	-49.9	106.1	5.5	112.5	L94 D95 L101 Q102 L132	L94-R98 WeakPolarHBondContact O-CB 3.16Å; L94-R98 PolarHBondContact O-N 2.68Å; D95-R98 PolarHBondContact O-N 3.46Å; D95-R98 IonicContact OD1-CZ 3.42Å; D95-R98 VanDerWaalsContact OD1-CZ 3.3Å; D95-R98 IonicContact OD1-NH1 2.75Å; D95-R98 PolarHBondContact OD1-NH1 3.32Å; D95-R98 IonicContact OD1-NH2 2.77Å; D95-R98 PolarHBondContact OD1-NH2 2.91Å; R98-L101 PolarHBondContact O-N 3.05Å; R98-Q102 WeakPolarHBondContact O-CB 3.21Å; R98-Q102 VanDerWaalsContact O-CG 3.25Å; R98-Q102 WeakPolarHBondContact O-CG 3.36Å; R98-Q102 PolarHBondContact O-N 3.32Å; R98-Q102 PolarHBondContact O-OE1 3.14Å; R98-L132 HydrophobicContact CB-CD2 3.96Å; R98-L132 HydrophobicContact CG-CD1 4.2Å; R98-L132 HydrophobicContact CG-CD2 4.38Å
99	I	94.7	Very high	92.2	Very high	11 Å²	11	35.1 Å²	35.1	6%	0.056	19%	0.192	C	C	.	.	H	α-helix	trans	-64	-46.1	178.3	-67.9	159.3	0	0	0	110.6	H59 L62 E63 L66 D95 C96 A97 L101 Q102 H103	H59-I99 HydrophobicContact CB-CD1 3.83Å; H59-I99 WeakPolarHBondContact O-CD1 3.15Å; L62-I99 HydrophobicContact CD2-CG2 4.46Å; L62-I99 HydrophobicContact CG-CG2 4.3Å; E63-I99 HydrophobicContact CB-CD1 4.17Å; E63-I99 HydrophobicContact CB-CG2 4.2Å; L66-I99 HydrophobicContact CD1-CG2 3.95Å; D95-I99 WeakPolarHBondContact O-CD1 3.42Å; D95-I99 WeakPolarHBondContact O-CG1 3.17Å; D95-I99 PolarHBondContact O-N 3.44Å; D95-I99 VanDerWaalsContact O-N 3.11Å; C96-I99 PolarHBondContact O-N 2.94Å; A97-I99 PolarHBondContact O-N 3.5Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 2.99Å; I99-Q102 WeakPolarHBondContact O-CB 3.38Å; I99-Q102 PolarHBondContact O-N 2.85Å; I99-H103 PolarHBondContact O-CD2 2.81Å; I99-H103 PolarHBondContact O-N 3.45Å
100	L	94.9	Very high	91.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.8	-41	178.9	-71.8	162.8	0	0	0	112.2	V50 V54 L62 L66 P84 L85 A88 C96 A97 H103 G104 A105	V50-L100 HydrophobicContact CG1-CD2 4.05Å; V54-L100 HydrophobicContact CG2-CD1 3.96Å; L62-L100 HydrophobicContact CD1-CD2 4.38Å; L62-L100 HydrophobicContact CD2-CD1 4.4Å; L62-L100 HydrophobicContact CD2-CG 4.22Å; L66-L100 HydrophobicContact CD1-CD2 3.97Å; P84-L100 HydrophobicContact CB-CD1 3.92Å; P84-L100 HydrophobicContact CB-CD2 3.96Å; L85-L100 HydrophobicContact CB-CB 4.46Å; L85-L100 HydrophobicContact CB-CD1 4.38Å; L85-L100 HydrophobicContact CD1-CB 4.3Å; A88-L100 HydrophobicContact CB-CD1 4.11Å; C96-L100 WeakPolarHBondContact O-CD1 3.34Å; C96-L100 WeakPolarHBondContact O-CG 3.49Å; C96-L100 PolarHBondContact O-N 3.38Å; C96-L100 VanDerWaalsContact O-N 3.09Å; A97-L100 PolarHBondContact O-N 3.31Å; L100-H103 CarbonylContact O-C 3.55Å; L100-H103 PolarHBondContact O-N 3.07Å; L100-G104 PolarHBondContact O-N 3.11Å; L100-A105 HydrophobicContact CB-CB 4.15Å; L100-A105 VanDerWaalsContact O-CB 3.26Å; L100-A105 WeakPolarHBondContact O-CB 3.29Å; L100-A105 PolarHBondContact O-N 2.89Å
101	L	93.4	Very high	91.9	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-38.5	174.7	-70	169.9	0	0	0	112.4	L85 A97 R98 I99 H103 G104 V107 L132 Y136	L85-L101 HydrophobicContact CD1-CD1 4.43Å; L85-L101 HydrophobicContact CD1-CD2 4.13Å; L85-L101 HydrophobicContact CD1-CG 3.93Å; L85-L101 HydrophobicContact CD2-CD2 3.6Å; L85-L101 HydrophobicContact CD2-CG 4.29Å; A97-L101 WeakPolarHBondContact O-CB 3.42Å; A97-L101 WeakPolarHBondContact O-CG 3.48Å; A97-L101 PolarHBondContact O-N 3.17Å; R98-L101 PolarHBondContact O-N 3.05Å; I99-L101 VanDerWaalsContact C-N 3.33Å; I99-L101 PolarHBondContact O-N 2.99Å; L101-H103 VanDerWaalsContact C-N 3.32Å; L101-H103 PolarHBondContact O-N 2.95Å; L101-G104 PolarHBondContact O-N 2.81Å; L101-G104 VanDerWaalsContact O-N 3.09Å; L101-V107 HydrophobicContact CD2-CG2 3.48Å; L101-V107 VanDerWaalsContact CD2-CG2 3.48Å; L101-L132 HydrophobicContact CD1-CD1 4.37Å; L101-L132 HydrophobicContact CD1-CD2 4.12Å; L101-L132 HydrophobicContact CD1-CG 3.85Å; L101-Y136 HydrophobicContact CB-CD1 3.74Å; L101-Y136 HydrophobicContact CB-CD2 4.03Å; L101-Y136 HydrophobicContact CB-CE1 3.83Å; L101-Y136 HydrophobicContact CB-CE2 4.12Å; L101-Y136 HydrophobicContact CB-CG 3.84Å; L101-Y136 HydrophobicContact CD1-CD2 3.86Å; L101-Y136 HydrophobicContact CD1-CE2 4.43Å; L101-Y136 HydrophobicContact CD1-CG 4.04Å; L101-Y136 HydrophobicContact CD2-CD1 4.39Å; L101-Y136 HydrophobicContact CD2-CG 4.09Å; L101-Y136 HydrophobicContact CG-CD2 4.42Å; L101-Y136 HydrophobicContact CG-CG 4.21Å; L101-Y136 WeakPolarHBondContact O-CE1 3.38Å
102	Q	90.9	Very high	91.7	Very high	116 Å²	116	48.7 Å²	48.7	54%	0.542	25%	0.246	S	C	.	.	H	α-helix	trans	-65.5	-33.1	173.5	-74.8	170.3	-36.4	0	0	112.7	R98 I99 G104 Y136	R98-Q102 WeakPolarHBondContact O-CB 3.21Å; R98-Q102 VanDerWaalsContact O-CG 3.25Å; R98-Q102 WeakPolarHBondContact O-CG 3.36Å; R98-Q102 PolarHBondContact O-N 3.32Å; R98-Q102 PolarHBondContact O-OE1 3.14Å; I99-Q102 WeakPolarHBondContact O-CB 3.38Å; I99-Q102 PolarHBondContact O-N 2.85Å; Q102-G104 PolarHBondContact O-N 2.86Å; Q102-Y136 VanDerWaalsContact CG-OH 3.31Å; Q102-Y136 WeakPolarHBondContact CG-OH 3.39Å
103	H	90.2	Very high	91.5	Very high	76 Å²	76	51.9 Å²	51.9	35%	0.352	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	10.6	171.7	-77.6	-96	0	0	0	113.8	L66 V74 I99 L100 L101	L66-H103 HydrophobicContact CD1-CB 4.33Å; L66-H103 PolarHBondContact O-CE1 3.19Å; L66-H103 PolarHBondContact O-ND1 2.63Å; V74-H103 HydrophobicContact CG1-CB 4.49Å; I99-H103 PolarHBondContact O-CD2 2.81Å; I99-H103 PolarHBondContact O-N 3.45Å; L100-H103 CarbonylContact O-C 3.55Å; L100-H103 PolarHBondContact O-N 3.07Å; L101-H103 VanDerWaalsContact C-N 3.32Å; L101-H103 PolarHBondContact O-N 2.95Å
104	G	88.4	Confident	91	Very high	49 Å²	49	49.4 Å²	49.4	51%	0.505	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	12.1	167.3	0	0	0	0	0	116.6	L100 L101 Q102 D106	L100-G104 PolarHBondContact O-N 3.11Å; L101-G104 PolarHBondContact O-N 2.81Å; L101-G104 VanDerWaalsContact O-N 3.09Å; Q102-G104 PolarHBondContact O-N 2.86Å; G104-D106 PolarHBondContact O-N 2.97Å
105	A	93.5	Very high	90.7	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.24	C	C	.	.			trans	-58.6	134.8	176.2	0	0	0	0	0	112	V74 E75 L85 L100 Q140	V74-A105 HydrophobicContact CB-CB 4.37Å; V74-A105 HydrophobicContact CG2-CB 4.3Å; E75-A105 WeakPolarHBondContact OE1-CA 3.4Å; L85-A105 HydrophobicContact CB-CB 4.13Å; L85-A105 HydrophobicContact CD2-CB 3.83Å; L100-A105 HydrophobicContact CB-CB 4.15Å; L100-A105 VanDerWaalsContact O-CB 3.26Å; L100-A105 WeakPolarHBondContact O-CB 3.29Å; L100-A105 PolarHBondContact O-N 2.89Å; A105-Q140 PolarHBondContact O-NE2 3.08Å
106	D	89.3	Confident	90.5	Very high	31 Å²	31	45.7 Å²	45.7	17%	0.166	23%	0.23	C	C	.	.			trans	-89.1	118.1	-165.5	-173.2	-15.4	0	0	0	112.3	E75 G104 S108 K109 K144	E75-D106 PolarHBondContact OE1-N 2.87Å; G104-D106 PolarHBondContact O-N 2.97Å; D106-S108 PolarHBondContact O-N 3.41Å; D106-S108 WeakPolarHBondContact OD1-CB 3.4Å; D106-S108 PolarHBondContact OD1-N 3.05Å; D106-S108 PolarHBondContact OD1-OG 3.22Å; D106-S108 PolarHBondContact OD2-OG 3.41Å; D106-K109 HydrophobicContact CB-CG 3.71Å; D106-K109 WeakPolarHBondContact O-CB 3.28Å; D106-K109 WeakPolarHBondContact O-CG 3.48Å; D106-K109 PolarHBondContact O-N 2.94Å; D106-K144 IonicContact OD1-NZ 2.7Å; D106-K144 PolarHBondContact OD1-NZ 3.33Å; D106-K144 IonicContact OD2-NZ 3.65Å; D106-K144 PolarHBondContact OD2-NZ 2.86Å
107	V	90.3	Very high	90.3	Very high	3 Å²	3	45.7 Å²	45.7	2%	0.018	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.6	-178.3	177.3	0	0	0	0	112.3	L101 K109 V117 L118 V133 R137	L101-V107 HydrophobicContact CD2-CG2 3.48Å; L101-V107 VanDerWaalsContact CD2-CG2 3.48Å; V107-K109 VanDerWaalsContact C-N 3.29Å; V107-K109 PolarHBondContact O-N 2.81Å; V107-V117 HydrophobicContact CG1-CB 4.38Å; V107-L118 HydrophobicContact CG1-CB 4.34Å; V107-V133 HydrophobicContact CG1-CG1 3.5Å; V107-V133 HydrophobicContact CG2-CG1 4.36Å; V107-R137 HydrophobicContact CB-CB 4.48Å; V107-R137 HydrophobicContact CG1-CB 3.94Å
108	S	85.4	Confident	90	Very high	74 Å²	74	46.9 Å²	46.9	52%	0.517	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-1.3	-178.1	63	0	0	0	0	114.4	D106 K144	D106-S108 PolarHBondContact O-N 3.41Å; D106-S108 WeakPolarHBondContact OD1-CB 3.4Å; D106-S108 PolarHBondContact OD1-N 3.05Å; D106-S108 PolarHBondContact OD1-OG 3.22Å; D106-S108 PolarHBondContact OD2-OG 3.41Å; S108-K144 PolarHBondContact OG-NZ 2.92Å; S108-K144 VanDerWaalsContact OG-NZ 3.08Å
109	K	88.3	Confident	89.7	Confident	77 Å²	77	44.8 Å²	44.8	34%	0.335	23%	0.23	S	C	.	.			trans	-69.8	137.7	178.2	-69.5	-84.1	-177	113.9	0	111.5	E75 H86 D106 V107 T116 V117	E75-K109 VanDerWaalsContact CD-NZ 3.29Å; E75-K109 VanDerWaalsContact CG-NZ 3.29Å; E75-K109 WeakPolarHBondContact OE2-CD 3.48Å; E75-K109 WeakPolarHBondContact OE2-CE 3.45Å; E75-K109 WeakPolarHBondContact OE2-CG 3.49Å; E75-K109 IonicContact OE2-NZ 3.42Å; E75-K109 PolarHBondContact OE2-NZ 3.11Å; H86-K109 PolarHBondContact CE1-O 3.46Å; H86-K109 PolarHBondContact NE2-O 2.91Å; D106-K109 HydrophobicContact CB-CG 3.71Å; D106-K109 WeakPolarHBondContact O-CB 3.28Å; D106-K109 WeakPolarHBondContact O-CG 3.48Å; D106-K109 PolarHBondContact O-N 2.94Å; V107-K109 VanDerWaalsContact C-N 3.29Å; V107-K109 PolarHBondContact O-N 2.81Å; K109-T116 VanDerWaalsContact O-CA 3.28Å; K109-T116 WeakPolarHBondContact O-CA 3.46Å; K109-V117 PolarHBondContact O-N 3.29Å
110	E	88.9	Confident	89.4	Confident	100 Å²	100	45.1 Å²	45.1	47%	0.467	23%	0.232	S	C	.	.	B	Isolated β-bridge	trans	-92.2	144.1	170.9	-66.9	-175.1	179.7	0	0	111.7	G114 W115 T116 Q292	E110-G114 WeakPolarHBondContact OE2-CA 3.44Å; E110-W115 CarbonylContact C-O 3.59Å; E110-W115 VanDerWaalsContact CA-O 3.31Å; E110-W115 WeakPolarHBondContact CA-O 3.49Å; E110-T116 HydrophobicContact CG-CG2 3.83Å; E110-Q292 PolarHBondContact OE1-NE2 2.75Å; E110-Q292 VanDerWaalsContact OE1-NE2 3.11Å
111	N	90.1	Very high	89.3	Confident	12 Å²	12	45.1 Å²	45.1	6%	0.064	23%	0.232	C	C	.	.			trans	-79.7	177	166.6	67.8	37.4	0	0	0	112	G81 N113 G114 W115 E120	G81-N111 WeakPolarHBondContact O-CA 3.39Å; N111-N113 PolarHBondContact O-N 2.93Å; N111-N113 WeakPolarHBondContact OD1-CA 3.48Å; N111-N113 WeakPolarHBondContact OD1-CB 3.32Å; N111-N113 PolarHBondContact OD1-N 2.78Å; N111-G114 PolarHBondContact O-N 2.85Å; N111-G114 PolarHBondContact OD1-N 3.4Å; N111-W115 PolarHBondContact N-O 3.43Å; N111-W115 PolarHBondContact ND2-O 3.49Å; N111-W115 PolarHBondContact OD1-N 2.84Å; N111-E120 PolarHBondContact ND2-OE1 2.85Å
112	R	87.8	Confident	89.1	Confident	190 Å²	190	45.2 Å²	45.2	72%	0.717	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-26.6	178.4	-176.6	172.2	-179.6	166.7	-0	115.4	R80 G81	R80-R112 WeakPolarHBondContact O-CB 3.42Å; R80-R112 VanDerWaalsContact O-CD 3.22Å; R80-R112 WeakPolarHBondContact O-CD 3.48Å; G81-R112 PolarHBondContact O-N 2.79Å
113	N	84.3	Confident	88.8	Confident	95 Å²	95	40 Å²	40	51%	0.508	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-6.8	-179.4	-62.3	-27.8	0	0	0	112.9	N111 R336	N111-N113 PolarHBondContact O-N 2.93Å; N111-N113 WeakPolarHBondContact OD1-CA 3.48Å; N111-N113 WeakPolarHBondContact OD1-CB 3.32Å; N111-N113 PolarHBondContact OD1-N 2.78Å; N113-R336 PolarHBondContact O-NH1 3.03Å
114	G	85	Confident	88.6	Confident	8 Å²	8	37.2 Å²	37.2	8%	0.082	20%	0.197	C	C	.	.	S	Bend	trans	83.7	27.8	-176.1	0	0	0	0	0	114.1	E110 N111	E110-G114 WeakPolarHBondContact OE2-CA 3.44Å; N111-G114 PolarHBondContact O-N 2.85Å; N111-G114 PolarHBondContact OD1-N 3.4Å
115	W	86.7	Confident	88.5	Confident	6 Å²	6	41.2 Å²	41.2	2%	0.023	20%	0.197	C	C	.	.			trans	-108.6	137.5	172.7	-61.1	108.7	0	0	0	110.5	H86 E110 N111 Q119 E120 V288 T290 R336 R338 L425	H86-W115 PolarHBondContact NE2-O 2.74Å; E110-W115 CarbonylContact C-O 3.59Å; E110-W115 VanDerWaalsContact CA-O 3.31Å; E110-W115 WeakPolarHBondContact CA-O 3.49Å; N111-W115 PolarHBondContact N-O 3.43Å; N111-W115 PolarHBondContact ND2-O 3.49Å; N111-W115 PolarHBondContact OD1-N 2.84Å; W115-Q119 HydrophobicContact CE3-CB 4.1Å; W115-Q119 HydrophobicContact CE3-CG 4.48Å; W115-E120 HydrophobicContact CB-CG 4.3Å; W115-E120 WeakPolarHBondContact CB-OE1 3.35Å; W115-V288 HydrophobicContact CZ3-CG1 4.09Å; W115-T290 HydrophobicContact CE3-CG2 4.12Å; W115-T290 WeakPolarHBondContact CH2-OG1 3.44Å; W115-T290 HydrophobicContact CZ3-CG2 3.71Å; W115-T290 WeakPolarHBondContact CZ3-OG1 3.42Å; W115-R336 HydrophobicContact CH2-CB 3.65Å; W115-R336 HydrophobicContact CZ2-CB 3.93Å; W115-R338 HydrophobicContact CH2-CG 3.75Å; W115-R338 HydrophobicContact CZ2-CG 3.76Å; W115-R338 HydrophobicContact CZ3-CG 4.29Å; W115-L425 HydrophobicContact CH2-CD1 4.23Å; W115-L425 HydrophobicContact CZ2-CD1 3.75Å; W115-L425 HydrophobicContact CZ2-CD2 4.4Å
116	T	90.2	Very high	88.3	Confident	24 Å²	24	43.5 Å²	43.5	15%	0.147	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-80.7	161.7	176	60.3	0	0	0	0	112.9	K109 E110 L118 Q119 E120	K109-T116 VanDerWaalsContact O-CA 3.28Å; K109-T116 WeakPolarHBondContact O-CA 3.46Å; E110-T116 HydrophobicContact CG-CG2 3.83Å; T116-L118 PolarHBondContact O-N 2.92Å; T116-Q119 PolarHBondContact O-N 2.86Å; T116-Q119 WeakPolarHBondContact OG1-CG 3.34Å; T116-Q119 PolarHBondContact OG1-OE1 3.39Å; T116-E120 PolarHBondContact O-N 2.86Å; T116-E120 VanDerWaalsContact O-N 3.08Å
117	V	92.8	Very high	88.4	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-51.5	-42.6	176.4	-178.1	0	0	0	0	112.1	L85 H86 V89 V107 K109 A121 V133	L85-V117 HydrophobicContact CD1-CG1 4.37Å; L85-V117 HydrophobicContact CD2-CG1 3.9Å; L85-V117 HydrophobicContact CD2-CG2 4.03Å; L85-V117 HydrophobicContact CG-CG1 3.73Å; L85-V117 HydrophobicContact CG-CG2 4.2Å; H86-V117 PolarHBondContact NE2-N 2.89Å; V89-V117 HydrophobicContact CG2-CG1 3.83Å; V107-V117 HydrophobicContact CG1-CB 4.38Å; K109-V117 PolarHBondContact O-N 3.29Å; V117-A121 WeakPolarHBondContact O-CB 3.33Å; V117-A121 PolarHBondContact O-N 3.4Å; V117-V133 HydrophobicContact CG1-CG1 4.05Å; V117-V133 HydrophobicContact CG1-CG2 4.45Å
118	L	90.2	Very high	88.5	Confident	26 Å²	26	48.7 Å²	48.7	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-65	-38.4	178.2	176.1	60.9	0	0	0	112.7	V107 T116 A121 V122 V133 L134	V107-L118 HydrophobicContact CG1-CB 4.34Å; T116-L118 PolarHBondContact O-N 2.92Å; L118-A121 WeakPolarHBondContact O-CB 3.28Å; L118-A121 PolarHBondContact O-N 2.99Å; L118-V122 HydrophobicContact CD1-CG2 4.44Å; L118-V122 PolarHBondContact O-N 2.94Å; L118-V133 HydrophobicContact CB-CG1 3.98Å; L118-V133 HydrophobicContact CD1-CG1 4.09Å; L118-L134 HydrophobicContact CD1-CD2 3.7Å; L118-L134 HydrophobicContact CD1-CG 3.79Å; L118-L134 HydrophobicContact CD2-CD2 3.66Å; L118-L134 HydrophobicContact CG-CD2 4.35Å
119	Q	88.1	Confident	88.9	Confident	39 Å²	39	45.2 Å²	45.2	18%	0.182	21%	0.213	C	C	.	.	H	α-helix	trans	-70.4	-38.9	-178.8	-70.1	156.3	-13.6	0	0	111	W115 T116 A121 S123 V288	W115-Q119 HydrophobicContact CE3-CB 4.1Å; W115-Q119 HydrophobicContact CE3-CG 4.48Å; T116-Q119 PolarHBondContact O-N 2.86Å; T116-Q119 WeakPolarHBondContact OG1-CG 3.34Å; T116-Q119 PolarHBondContact OG1-OE1 3.39Å; Q119-A121 VanDerWaalsContact C-N 3.34Å; Q119-S123 PolarHBondContact O-N 2.68Å; Q119-V288 HydrophobicContact CB-CG1 3.93Å; Q119-V288 HydrophobicContact CG-CG1 3.79Å
120	E	89.7	Confident	89	Confident	17 Å²	17	41.5 Å²	41.5	8%	0.079	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-34.4	169.8	-60.2	-63.6	178.2	0	0	112.1	V89 N111 W115 T116 S123 T124 R338	V89-E120 HydrophobicContact CG1-CB 4.15Å; N111-E120 PolarHBondContact ND2-OE1 2.85Å; W115-E120 HydrophobicContact CB-CG 4.3Å; W115-E120 WeakPolarHBondContact CB-OE1 3.35Å; T116-E120 PolarHBondContact O-N 2.86Å; T116-E120 VanDerWaalsContact O-N 3.08Å; E120-S123 WeakPolarHBondContact O-CB 3.34Å; E120-S123 PolarHBondContact O-N 2.99Å; E120-T124 WeakPolarHBondContact O-CG2 3.35Å; E120-T124 PolarHBondContact O-N 2.88Å; E120-R338 IonicContact OE1-NH1 2.77Å; E120-R338 PolarHBondContact OE1-NH1 3.02Å; E120-R338 VanDerWaalsContact OE1-NH1 3.13Å; E120-R338 IonicContact OE2-CZ 3.34Å; E120-R338 IonicContact OE2-NH1 3.3Å; E120-R338 PolarHBondContact OE2-NH1 2.83Å; E120-R338 IonicContact OE2-NH2 2.76Å; E120-R338 PolarHBondContact OE2-NH2 3.22Å; E120-R338 VanDerWaalsContact OE2-NH2 3.1Å
121	A	91.2	Very high	89.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-45.5	176.5	0	0	0	0	0	112.1	V89 V117 L118 Q119 S123 T124 V130 V133	V89-A121 VanDerWaalsContact CG1-CA 3.47Å; V89-A121 HydrophobicContact CG1-CB 3.73Å; V117-A121 WeakPolarHBondContact O-CB 3.33Å; V117-A121 PolarHBondContact O-N 3.4Å; L118-A121 WeakPolarHBondContact O-CB 3.28Å; L118-A121 PolarHBondContact O-N 2.99Å; Q119-A121 VanDerWaalsContact C-N 3.34Å; A121-S123 PolarHBondContact O-N 2.96Å; A121-T124 WeakPolarHBondContact O-CB 3.42Å; A121-T124 PolarHBondContact O-N 3.05Å; A121-T124 PolarHBondContact O-OG1 3.21Å; A121-V130 HydrophobicContact CB-CG2 4.23Å; A121-V130 WeakPolarHBondContact O-CG2 3.41Å; A121-V133 HydrophobicContact CB-CB 4.33Å; A121-V133 HydrophobicContact CB-CG1 4.46Å; A121-V133 HydrophobicContact CB-CG2 4.21Å
122	V	88.9	Confident	89.3	Confident	6 Å²	6	40.2 Å²	40.2	4%	0.036	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-38.7	174.2	172.1	0	0	0	0	111.1	L118 T124 R125 V130 R283 L284 V288 H341	L118-V122 HydrophobicContact CD1-CG2 4.44Å; L118-V122 PolarHBondContact O-N 2.94Å; V122-T124 PolarHBondContact O-N 3.08Å; V122-R125 PolarHBondContact O-N 2.75Å; V122-R125 VanDerWaalsContact O-N 3.14Å; V122-V130 HydrophobicContact CG2-CG1 4.33Å; V122-V130 HydrophobicContact CG2-CG2 4.05Å; V122-R283 VanDerWaalsContact CG1-O 3.3Å; V122-R283 WeakPolarHBondContact CG1-O 3.45Å; V122-R283 HydrophobicContact CG2-CB 4.39Å; V122-L284 HydrophobicContact CG1-CD2 4.48Å; V122-V288 HydrophobicContact CB-CG2 3.98Å; V122-V288 HydrophobicContact CG1-CG2 3.48Å; V122-V288 VanDerWaalsContact CG1-CG2 3.48Å; V122-H341 VanDerWaalsContact CG1-CD2 3.46Å; V122-H341 WeakPolarHBondContact CG1-CD2 3.25Å; V122-H341 WeakPolarHBondContact O-CB 3.28Å
123	S	85.7	Confident	89.5	Confident	7 Å²	7	31.2 Å²	31.2	5%	0.049	15%	0.154	C	C	.	.	H	α-helix	trans	-65.4	-16.7	175.5	-79.2	0	0	0	0	115.6	Q119 E120 A121 R125 R338 D340	Q119-S123 PolarHBondContact O-N 2.68Å; E120-S123 WeakPolarHBondContact O-CB 3.34Å; E120-S123 PolarHBondContact O-N 2.99Å; A121-S123 PolarHBondContact O-N 2.96Å; S123-R125 VanDerWaalsContact C-N 3.31Å; S123-R338 VanDerWaalsContact CB-NH2 3.25Å; S123-R338 VanDerWaalsContact OG-CZ 3.26Å; S123-R338 PolarHBondContact OG-NE 3.09Å; S123-R338 PolarHBondContact OG-NH2 2.98Å; S123-D340 VanDerWaalsContact CB-OD2 3.25Å; S123-D340 WeakPolarHBondContact CB-OD2 3.45Å; S123-D340 PolarHBondContact OG-OD2 2.74Å
124	T	85.4	Confident	89.7	Confident	18 Å²	18	26.7 Å²	26.7	11%	0.11	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.7	172.7	69.5	0	0	0	0	113.9	V89 E120 A121 V122 D126 L129	V89-T124 HydrophobicContact CG1-CG2 4.36Å; V89-T124 VanDerWaalsContact O-CG2 3.28Å; V89-T124 WeakPolarHBondContact O-CG2 3.44Å; E120-T124 WeakPolarHBondContact O-CG2 3.35Å; E120-T124 PolarHBondContact O-N 2.88Å; A121-T124 WeakPolarHBondContact O-CB 3.42Å; A121-T124 PolarHBondContact O-N 3.05Å; A121-T124 PolarHBondContact O-OG1 3.21Å; V122-T124 PolarHBondContact O-N 3.08Å; T124-D126 PolarHBondContact O-N 2.85Å; T124-D126 PolarHBondContact OG1-N 3.08Å; T124-D126 VanDerWaalsContact OG1-N 3.15Å; T124-L129 HydrophobicContact CG2-CD2 3.91Å
125	R	87.4	Confident	89.8	Confident	133 Å²	133	29.5 Å²	29.5	50%	0.502	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	8.9	-168.4	-52.5	170.6	173.8	150	3.1	115.6	V122 S123 P127 D340 H341	V122-R125 PolarHBondContact O-N 2.75Å; V122-R125 VanDerWaalsContact O-N 3.14Å; S123-R125 VanDerWaalsContact C-N 3.31Å; R125-P127 WeakPolarHBondContact O-CD 3.35Å; R125-D340 PolarHBondContact NH2-O 2.77Å; R125-H341 HydrophobicContact CG-CB 3.9Å; R125-H341 PolarHBondContact NE-O 2.82Å
126	D	89.5	Confident	89.9	Confident	47 Å²	47	30.3 Å²	30.3	25%	0.251	14%	0.142	S	C	.	.			trans	-84.2	112.2	176.3	179.5	-9.5	0	0	0	110.9	T124 E128 L129 V130	T124-D126 PolarHBondContact O-N 2.85Å; T124-D126 PolarHBondContact OG1-N 3.08Å; T124-D126 VanDerWaalsContact OG1-N 3.15Å; D126-E128 VanDerWaalsContact C-N 3.34Å; D126-E128 PolarHBondContact O-N 3.19Å; D126-E128 PolarHBondContact OD1-N 2.99Å; D126-L129 HydrophobicContact CB-CB 3.81Å; D126-L129 PolarHBondContact O-N 3Å; D126-L129 PolarHBondContact OD1-N 2.95Å; D126-L129 WeakPolarHBondContact OD2-CB 3.42Å; D126-V130 WeakPolarHBondContact O-CG2 3.47Å; D126-V130 PolarHBondContact O-N 3.15Å
127	P	90.8	Very high	89.7	Confident	57 Å²	57	31 Å²	31	37%	0.37	14%	0.142	S	C	.	.	H	α-helix	trans	-68.1	-29.5	-179.6	29.4	-35.2	0	0	0	113.3	R125 R131 V280 L284	R125-P127 WeakPolarHBondContact O-CD 3.35Å; P127-R131 WeakPolarHBondContact O-CB 3.34Å; P127-R131 PolarHBondContact O-N 2.99Å; P127-V280 HydrophobicContact CB-CG1 3.86Å; P127-L284 HydrophobicContact CB-CD1 3.9Å
128	E	92.7	Very high	89.2	Confident	87 Å²	87	32.4 Å²	32.4	41%	0.407	15%	0.149	S	C	.	.	H	α-helix	trans	-77.5	-34.5	-179.8	-69.4	-56.2	121.8	0	0	111.4	L94 D126 R131 L132	L94-E128 HydrophobicContact CD2-CB 4.38Å; D126-E128 VanDerWaalsContact C-N 3.34Å; D126-E128 PolarHBondContact O-N 3.19Å; D126-E128 PolarHBondContact OD1-N 2.99Å; E128-R131 IonicContact OE1-CZ 3.84Å; E128-R131 VanDerWaalsContact OE1-CZ 3.25Å; E128-R131 IonicContact OE1-NE 3.02Å; E128-R131 PolarHBondContact OE1-NE 3.45Å; E128-R131 IonicContact OE1-NH2 3.65Å; E128-R131 PolarHBondContact OE1-NH2 3.37Å; E128-R131 IonicContact OE2-NE 3.55Å; E128-R131 PolarHBondContact OE2-NE 3.41Å; E128-L132 VanDerWaalsContact O-CB 3.28Å; E128-L132 WeakPolarHBondContact O-CB 3.39Å; E128-L132 PolarHBondContact O-N 3.38Å
129	L	92.8	Very high	88.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-43.4	170.3	-170.5	63.4	0	0	0	111.5	V89 L94 A97 T124 D126 L132 V133	V89-L129 HydrophobicContact CB-CD2 4.48Å; V89-L129 HydrophobicContact CG1-CD2 4.17Å; V89-L129 HydrophobicContact CG2-CD1 4.22Å; L94-L129 HydrophobicContact CD1-CB 4.14Å; L94-L129 HydrophobicContact CD1-CD1 3.83Å; A97-L129 HydrophobicContact CB-CD1 4.02Å; T124-L129 HydrophobicContact CG2-CD2 3.91Å; D126-L129 HydrophobicContact CB-CB 3.81Å; D126-L129 PolarHBondContact O-N 3Å; D126-L129 PolarHBondContact OD1-N 2.95Å; D126-L129 WeakPolarHBondContact OD2-CB 3.42Å; L129-L132 PolarHBondContact O-N 3.15Å; L129-V133 WeakPolarHBondContact O-CB 3.39Å; L129-V133 VanDerWaalsContact O-CG2 3.28Å; L129-V133 WeakPolarHBondContact O-CG2 3.29Å; L129-V133 PolarHBondContact O-N 3.35Å
130	V	91.9	Very high	88.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-46.9	174.1	170.6	0	0	0	0	111.2	A121 V122 D126 L132 V133 L134 V280 L284	A121-V130 HydrophobicContact CB-CG2 4.23Å; A121-V130 WeakPolarHBondContact O-CG2 3.41Å; V122-V130 HydrophobicContact CG2-CG1 4.33Å; V122-V130 HydrophobicContact CG2-CG2 4.05Å; D126-V130 WeakPolarHBondContact O-CG2 3.47Å; D126-V130 PolarHBondContact O-N 3.15Å; V130-L132 VanDerWaalsContact C-N 3.33Å; V130-L132 PolarHBondContact O-N 2.93Å; V130-V133 PolarHBondContact O-N 3.17Å; V130-L134 HydrophobicContact CG1-CD1 3.7Å; V130-L134 HydrophobicContact CG1-CG 4.21Å; V130-L134 WeakPolarHBondContact O-CB 3.5Å; V130-L134 WeakPolarHBondContact O-CG 3.47Å; V130-L134 PolarHBondContact O-N 3.39Å; V130-V280 HydrophobicContact CB-CG1 4.39Å; V130-V280 HydrophobicContact CG1-CG1 4.09Å; V130-L284 HydrophobicContact CG2-CD2 4.23Å
131	R	92.1	Very high	88.1	Confident	61 Å²	61	37 Å²	37	23%	0.23	16%	0.163	C	C	.	.	H	α-helix	trans	-55.6	-46	175.4	-172.4	-160.5	-58.8	-79.2	4.1	111.5	P127 E128 R135 P275 D277 V280	P127-R131 WeakPolarHBondContact O-CB 3.34Å; P127-R131 PolarHBondContact O-N 2.99Å; E128-R131 IonicContact OE1-CZ 3.84Å; E128-R131 VanDerWaalsContact OE1-CZ 3.25Å; E128-R131 IonicContact OE1-NE 3.02Å; E128-R131 PolarHBondContact OE1-NE 3.45Å; E128-R131 IonicContact OE1-NH2 3.65Å; E128-R131 PolarHBondContact OE1-NH2 3.37Å; E128-R131 IonicContact OE2-NE 3.55Å; E128-R131 PolarHBondContact OE2-NE 3.41Å; R131-R135 VanDerWaalsContact O-CB 3.25Å; R131-R135 WeakPolarHBondContact O-CB 3.39Å; R131-R135 PolarHBondContact O-N 3.36Å; R131-P275 HydrophobicContact CG-CG 4.06Å; R131-D277 IonicContact CZ-OD1 3.32Å; R131-D277 IonicContact NH1-OD1 3.58Å; R131-D277 PolarHBondContact NH1-OD1 3.25Å; R131-D277 IonicContact NH2-OD1 2.78Å; R131-D277 PolarHBondContact NH2-OD1 2.81Å; R131-V280 HydrophobicContact CB-CG2 4.16Å
132	L	92.7	Very high	87.4	Confident	24 Å²	24	38.7 Å²	38.7	13%	0.126	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-47.9	177.6	178	65.7	0	0	0	111.9	L94 A97 R98 L101 E128 L129 V130 R135 Y136	L94-L132 HydrophobicContact CD1-CB 4.31Å; L94-L132 HydrophobicContact CD1-CD2 3.67Å; L94-L132 HydrophobicContact CG-CD2 4.45Å; A97-L132 HydrophobicContact CB-CD2 4.48Å; R98-L132 HydrophobicContact CB-CD2 3.96Å; R98-L132 HydrophobicContact CG-CD1 4.2Å; R98-L132 HydrophobicContact CG-CD2 4.38Å; L101-L132 HydrophobicContact CD1-CD1 4.37Å; L101-L132 HydrophobicContact CD1-CD2 4.12Å; L101-L132 HydrophobicContact CD1-CG 3.85Å; E128-L132 VanDerWaalsContact O-CB 3.28Å; E128-L132 WeakPolarHBondContact O-CB 3.39Å; E128-L132 PolarHBondContact O-N 3.38Å; L129-L132 PolarHBondContact O-N 3.15Å; V130-L132 VanDerWaalsContact C-N 3.33Å; V130-L132 PolarHBondContact O-N 2.93Å; L132-R135 PolarHBondContact O-N 3.39Å; L132-Y136 HydrophobicContact CD1-CD2 3.89Å; L132-Y136 HydrophobicContact CD1-CE2 3.72Å; L132-Y136 WeakPolarHBondContact O-CD2 3.05Å; L132-Y136 PolarHBondContact O-N 2.8Å; L132-Y136 VanDerWaalsContact O-N 3.13Å
133	V	91.6	Very high	86.9	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.8	-38.8	-176.4	175.4	0	0	0	0	111.7	V89 V107 V117 L118 A121 L129 V130 Y136 R137	V89-V133 HydrophobicContact CG2-CG2 4.21Å; V107-V133 HydrophobicContact CG1-CG1 3.5Å; V107-V133 HydrophobicContact CG2-CG1 4.36Å; V117-V133 HydrophobicContact CG1-CG1 4.05Å; V117-V133 HydrophobicContact CG1-CG2 4.45Å; L118-V133 HydrophobicContact CB-CG1 3.98Å; L118-V133 HydrophobicContact CD1-CG1 4.09Å; A121-V133 HydrophobicContact CB-CB 4.33Å; A121-V133 HydrophobicContact CB-CG1 4.46Å; A121-V133 HydrophobicContact CB-CG2 4.21Å; L129-V133 WeakPolarHBondContact O-CB 3.39Å; L129-V133 VanDerWaalsContact O-CG2 3.28Å; L129-V133 WeakPolarHBondContact O-CG2 3.29Å; L129-V133 PolarHBondContact O-N 3.35Å; V130-V133 PolarHBondContact O-N 3.17Å; V133-Y136 PolarHBondContact O-N 3.48Å; V133-R137 WeakPolarHBondContact O-CB 3.26Å; V133-R137 PolarHBondContact O-N 2.99Å
134	L	87.8	Confident	86.5	Confident	1 Å²	1	44 Å²	44	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-49.7	170.4	-75.4	170	0	0	0	111.4	L118 V130 Y136 R137 D138 P275 V280	L118-L134 HydrophobicContact CD1-CD2 3.7Å; L118-L134 HydrophobicContact CD1-CG 3.79Å; L118-L134 HydrophobicContact CD2-CD2 3.66Å; L118-L134 HydrophobicContact CG-CD2 4.35Å; V130-L134 HydrophobicContact CG1-CD1 3.7Å; V130-L134 HydrophobicContact CG1-CG 4.21Å; V130-L134 WeakPolarHBondContact O-CB 3.5Å; V130-L134 WeakPolarHBondContact O-CG 3.47Å; V130-L134 PolarHBondContact O-N 3.39Å; L134-Y136 VanDerWaalsContact C-N 3.28Å; L134-Y136 PolarHBondContact O-N 3.46Å; L134-R137 WeakPolarHBondContact O-CA 3.36Å; L134-R137 VanDerWaalsContact O-CB 3.28Å; L134-R137 WeakPolarHBondContact O-CB 3.42Å; L134-R137 PolarHBondContact O-N 2.9Å; L134-D138 PolarHBondContact O-N 2.73Å; L134-P275 HydrophobicContact CB-CB 4.34Å; L134-P275 HydrophobicContact CB-CG 3.98Å; L134-P275 HydrophobicContact CD1-CB 4.3Å; L134-P275 HydrophobicContact CD1-CG 4.47Å; L134-V280 HydrophobicContact CD1-CG2 4.07Å
135	R	88.3	Confident	86	Confident	67 Å²	67	44.6 Å²	44.6	25%	0.253	20%	0.2	S	C	.	.	H	α-helix	trans	-56.5	-39.9	179.3	175.3	157.5	-175.5	-155	-6.3	113	R131 L132 Y139 L270 T273 Q274	R131-R135 VanDerWaalsContact O-CB 3.25Å; R131-R135 WeakPolarHBondContact O-CB 3.39Å; R131-R135 PolarHBondContact O-N 3.36Å; L132-R135 PolarHBondContact O-N 3.39Å; R135-Y139 WeakPolarHBondContact O-CB 3.3Å; R135-Y139 PolarHBondContact O-N 2.98Å; R135-L270 HydrophobicContact CG-CD1 3.82Å; R135-L270 PolarHBondContact NE-O 2.87Å; R135-L270 PolarHBondContact NH2-O 3.3Å; R135-T273 WeakPolarHBondContact CD-O 3.21Å; R135-T273 VanDerWaalsContact CG-O 3.28Å; R135-T273 WeakPolarHBondContact CG-O 3.41Å; R135-T273 PolarHBondContact NE-O 3.27Å; R135-Q274 VanDerWaalsContact CZ-OE1 3.28Å
136	Y	88.2	Confident	85.5	Confident	23 Å²	23	39.1 Å²	39.1	9%	0.09	18%	0.181	C	C	.	.	H	α-helix	trans	-78.8	-30.6	174.4	-83.3	-94.5	0	0	0	113.7	L101 Q102 L132 V133 L134 D138 Q140 L270	L101-Y136 HydrophobicContact CB-CD1 3.74Å; L101-Y136 HydrophobicContact CB-CD2 4.03Å; L101-Y136 HydrophobicContact CB-CE1 3.83Å; L101-Y136 HydrophobicContact CB-CE2 4.12Å; L101-Y136 HydrophobicContact CB-CG 3.84Å; L101-Y136 HydrophobicContact CD1-CD2 3.86Å; L101-Y136 HydrophobicContact CD1-CE2 4.43Å; L101-Y136 HydrophobicContact CD1-CG 4.04Å; L101-Y136 HydrophobicContact CD2-CD1 4.39Å; L101-Y136 HydrophobicContact CD2-CG 4.09Å; L101-Y136 HydrophobicContact CG-CD2 4.42Å; L101-Y136 HydrophobicContact CG-CG 4.21Å; L101-Y136 WeakPolarHBondContact O-CE1 3.38Å; Q102-Y136 VanDerWaalsContact CG-OH 3.31Å; Q102-Y136 WeakPolarHBondContact CG-OH 3.39Å; L132-Y136 HydrophobicContact CD1-CD2 3.89Å; L132-Y136 HydrophobicContact CD1-CE2 3.72Å; L132-Y136 WeakPolarHBondContact O-CD2 3.05Å; L132-Y136 PolarHBondContact O-N 2.8Å; L132-Y136 VanDerWaalsContact O-N 3.13Å; V133-Y136 PolarHBondContact O-N 3.48Å; L134-Y136 VanDerWaalsContact C-N 3.28Å; L134-Y136 PolarHBondContact O-N 3.46Å; Y136-D138 VanDerWaalsContact C-N 3.3Å; Y136-D138 PolarHBondContact O-N 2.86Å; Y136-Q140 VanDerWaalsContact O-CB 3.27Å; Y136-Q140 WeakPolarHBondContact O-CB 3.25Å; Y136-Q140 VanDerWaalsContact O-CG 3.22Å; Y136-Q140 WeakPolarHBondContact O-CG 3.48Å; Y136-Q140 PolarHBondContact O-N 3.48Å; Y136-L270 HydrophobicContact CD1-CD1 4.34Å; Y136-L270 HydrophobicContact CD2-CD1 4.34Å; Y136-L270 HydrophobicContact CE1-CD1 4.31Å; Y136-L270 HydrophobicContact CE1-CD2 4.11Å; Y136-L270 HydrophobicContact CE2-CD1 4.3Å; Y136-L270 HydrophobicContact CE2-CD2 4.38Å; Y136-L270 HydrophobicContact CG-CD1 4.38Å
137	R	86.1	Confident	84.9	Confident	39 Å²	39	39.4 Å²	39.4	15%	0.147	19%	0.189	C	C	.	.	H	α-helix	trans	-53	-51	167.8	175.5	-161.4	67.9	174.6	-0.9	109.7	V107 V133 L134 Q140 R141 E578	V107-R137 HydrophobicContact CB-CB 4.48Å; V107-R137 HydrophobicContact CG1-CB 3.94Å; V133-R137 WeakPolarHBondContact O-CB 3.26Å; V133-R137 PolarHBondContact O-N 2.99Å; L134-R137 WeakPolarHBondContact O-CA 3.36Å; L134-R137 VanDerWaalsContact O-CB 3.28Å; L134-R137 WeakPolarHBondContact O-CB 3.42Å; L134-R137 PolarHBondContact O-N 2.9Å; R137-Q140 PolarHBondContact O-N 2.75Å; R137-R141 WeakPolarHBondContact O-CB 3.42Å; R137-R141 PolarHBondContact O-N 2.79Å; R137-E578 IonicContact CZ-OE1 3.67Å; R137-E578 IonicContact NH1-OE1 3.13Å; R137-E578 PolarHBondContact NH1-OE1 3.24Å; R137-E578 IonicContact NH2-OE1 3.92Å; R137-E578 PolarHBondContact NH2-OE1 2.9Å
138	D	81.4	Confident	84.3	Confident	28 Å²	28	37.9 Å²	37.9	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-74	-38.5	-170.6	-63.4	-30.9	0	0	0	112.4	L134 Y136 T142 T273	L134-D138 PolarHBondContact O-N 2.73Å; Y136-D138 VanDerWaalsContact C-N 3.3Å; Y136-D138 PolarHBondContact O-N 2.86Å; D138-T142 VanDerWaalsContact O-CB 3.29Å; D138-T142 WeakPolarHBondContact O-CB 3.42Å; D138-T142 PolarHBondContact O-N 3.14Å; D138-T142 PolarHBondContact O-OG1 3.28Å; D138-T273 HydrophobicContact CB-CG2 4.11Å
139	Y	83.4	Confident	83.6	Confident	54 Å²	54	34 Å²	34	21%	0.212	17%	0.166	C	C	.	.	H	α-helix	trans	-57.7	-48.8	166.5	172.8	-100.7	0	0	0	112.2	R135 T142 A143 L250 L269 L270	R135-Y139 WeakPolarHBondContact O-CB 3.3Å; R135-Y139 PolarHBondContact O-N 2.98Å; Y139-T142 PolarHBondContact O-N 3.05Å; Y139-A143 VanDerWaalsContact O-CB 3.31Å; Y139-A143 WeakPolarHBondContact O-CB 3.39Å; Y139-A143 PolarHBondContact O-N 2.61Å; Y139-L250 HydrophobicContact CE2-CD2 4.19Å; Y139-L269 HydrophobicContact CD2-CB 4.14Å; Y139-L269 HydrophobicContact CD2-CD2 3.86Å; Y139-L269 HydrophobicContact CD2-CG 3.9Å; Y139-L269 HydrophobicContact CE2-CB 4.17Å; Y139-L269 HydrophobicContact CE2-CD2 3.96Å; Y139-L269 HydrophobicContact CE2-CG 4.27Å; Y139-L270 HydrophobicContact CD1-CD1 4.43Å; Y139-L270 HydrophobicContact CD2-CB 3.76Å; Y139-L270 HydrophobicContact CD2-CD1 4.25Å; Y139-L270 HydrophobicContact CE2-CB 4.21Å; Y139-L270 HydrophobicContact CG-CB 4.25Å; Y139-L270 HydrophobicContact CG-CD1 3.85Å
140	Q	83.1	Confident	83	Confident	21 Å²	21	36.4 Å²	36.4	10%	0.098	18%	0.182	C	C	.	.	H	α-helix	trans	-67.8	-41.3	-180	-72.9	175.6	0.1	0	0	112.4	A105 Y136 R137 T142 A143 K144	A105-Q140 PolarHBondContact O-NE2 3.08Å; Y136-Q140 VanDerWaalsContact O-CB 3.27Å; Y136-Q140 WeakPolarHBondContact O-CB 3.25Å; Y136-Q140 VanDerWaalsContact O-CG 3.22Å; Y136-Q140 WeakPolarHBondContact O-CG 3.48Å; Y136-Q140 PolarHBondContact O-N 3.48Å; R137-Q140 PolarHBondContact O-N 2.75Å; Q140-T142 VanDerWaalsContact C-N 3.31Å; Q140-T142 PolarHBondContact O-N 3.46Å; Q140-A143 PolarHBondContact O-N 3.35Å; Q140-K144 VanDerWaalsContact O-CB 3.24Å; Q140-K144 WeakPolarHBondContact O-CB 3.38Å; Q140-K144 WeakPolarHBondContact O-CG 3.41Å; Q140-K144 PolarHBondContact O-N 3.07Å
141	R	78.6	Confident	82.5	Confident	103 Å²	103	40.6 Å²	40.6	39%	0.389	21%	0.207	S	C	.	.	H	α-helix	trans	-57.7	-45.2	173.6	-176.1	-174.3	-100.3	-162.5	-8.4	109.8	R137 R145 E581	R137-R141 WeakPolarHBondContact O-CB 3.42Å; R137-R141 PolarHBondContact O-N 2.79Å; R141-R145 WeakPolarHBondContact O-CB 3.5Å; R141-R145 PolarHBondContact O-N 2.89Å; R141-E581 IonicContact CZ-OE1 3.48Å; R141-E581 IonicContact CZ-OE2 3.66Å; R141-E581 IonicContact NH1-OE1 2.79Å; R141-E581 IonicContact NH1-OE2 3.46Å; R141-E581 PolarHBondContact NH1-OE2 3.42Å; R141-E581 IonicContact NH2-OE1 3.6Å; R141-E581 PolarHBondContact NH2-OE1 2.85Å; R141-E581 IonicContact NH2-OE2 2.75Å; R141-E581 PolarHBondContact NH2-OE2 2.99Å; R141-E581 VanDerWaalsContact NH2-OE2 3.16Å
142	T	76.3	Confident	81.8	Confident	37 Å²	37	38 Å²	38	23%	0.227	20%	0.198	C	C	.	.	H	α-helix	trans	-73.2	-39.9	-179.5	-51.4	0	0	0	0	113	D138 Y139 Q140 R145 L146 L269	D138-T142 VanDerWaalsContact O-CB 3.29Å; D138-T142 WeakPolarHBondContact O-CB 3.42Å; D138-T142 PolarHBondContact O-N 3.14Å; D138-T142 PolarHBondContact O-OG1 3.28Å; Y139-T142 PolarHBondContact O-N 3.05Å; Q140-T142 VanDerWaalsContact C-N 3.31Å; Q140-T142 PolarHBondContact O-N 3.46Å; T142-R145 WeakPolarHBondContact O-CB 3.31Å; T142-R145 PolarHBondContact O-N 3.17Å; T142-L146 HydrophobicContact CG2-CD1 4.33Å; T142-L146 WeakPolarHBondContact O-CG 3.37Å; T142-L146 PolarHBondContact O-N 3.07Å; T142-L269 HydrophobicContact CG2-CD1 3.87Å; T142-L269 HydrophobicContact CG2-CD2 4.13Å
143	A	78.1	Confident	81.2	Confident	22 Å²	22	37.2 Å²	37.2	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-44.7	174.8	0	0	0	0	0	111.8	Y139 Q140 A147	Y139-A143 VanDerWaalsContact O-CB 3.31Å; Y139-A143 WeakPolarHBondContact O-CB 3.39Å; Y139-A143 PolarHBondContact O-N 2.61Å; Q140-A143 PolarHBondContact O-N 3.35Å; A143-A147 VanDerWaalsContact O-CB 3.25Å; A143-A147 WeakPolarHBondContact O-CB 3.32Å; A143-A147 PolarHBondContact O-N 2.79Å
144	K	77.3	Confident	80.9	Confident	102 Å²	102	40.1 Å²	40.1	44%	0.443	21%	0.207	S	C	.	.	H	α-helix	trans	-60.3	-44.2	172.4	-73.1	170	175.3	176	0	111.1	D106 S108 Q140 A147 G148	D106-K144 IonicContact OD1-NZ 2.7Å; D106-K144 PolarHBondContact OD1-NZ 3.33Å; D106-K144 IonicContact OD2-NZ 3.65Å; D106-K144 PolarHBondContact OD2-NZ 2.86Å; S108-K144 PolarHBondContact OG-NZ 2.92Å; S108-K144 VanDerWaalsContact OG-NZ 3.08Å; Q140-K144 VanDerWaalsContact O-CB 3.24Å; Q140-K144 WeakPolarHBondContact O-CB 3.38Å; Q140-K144 WeakPolarHBondContact O-CG 3.41Å; Q140-K144 PolarHBondContact O-N 3.07Å; K144-A147 PolarHBondContact O-N 2.82Å; K144-G148 PolarHBondContact O-N 2.86Å; K144-G148 VanDerWaalsContact O-N 3.15Å
145	R	76.3	Confident	80.6	Confident	30 Å²	30	45.6 Å²	45.6	11%	0.113	23%	0.228	C	C	.	.	H	α-helix	trans	-55.4	-56.3	175.2	163.7	161.5	-170.3	-126.8	5.4	112.1	R141 T142 A147 G148 I149 E240 I459	R141-R145 WeakPolarHBondContact O-CB 3.5Å; R141-R145 PolarHBondContact O-N 2.89Å; T142-R145 WeakPolarHBondContact O-CB 3.31Å; T142-R145 PolarHBondContact O-N 3.17Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 2.77Å; R145-G148 PolarHBondContact O-N 2.8Å; R145-I149 WeakPolarHBondContact O-CG1 3.49Å; R145-E240 IonicContact CZ-OE1 3.93Å; R145-E240 IonicContact CZ-OE2 2.64Å; R145-E240 IonicContact NH1-OE1 3.81Å; R145-E240 PolarHBondContact NH1-OE1 2.78Å; R145-E240 IonicContact NH1-OE2 3.7Å; R145-E240 PolarHBondContact NH1-OE2 2.88Å; R145-E240 VanDerWaalsContact NH2-CD 3.31Å; R145-E240 IonicContact NH2-OE1 2.9Å; R145-E240 PolarHBondContact NH2-OE1 2.73Å; R145-E240 IonicContact NH2-OE2 3.28Å; R145-E240 PolarHBondContact NH2-OE2 3.16Å; R145-I459 HydrophobicContact CB-CG2 3.48Å; R145-I459 VanDerWaalsContact CB-CG2 3.48Å; R145-I459 HydrophobicContact CG-CG2 3.38Å
146	L	76.2	Confident	80.4	Confident	19 Å²	19	42.4 Å²	42.4	10%	0.099	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-44.1	-179.5	-68.6	171.3	0	0	0	111.1	T142 G148 I149 L242 L247 L250	T142-L146 HydrophobicContact CG2-CD1 4.33Å; T142-L146 WeakPolarHBondContact O-CG 3.37Å; T142-L146 PolarHBondContact O-N 3.07Å; L146-G148 VanDerWaalsContact C-N 3.25Å; L146-G148 PolarHBondContact O-N 3.08Å; L146-I149 HydrophobicContact CD2-CD1 4.01Å; L146-I149 WeakPolarHBondContact O-CB 3.48Å; L146-I149 WeakPolarHBondContact O-CG1 3.49Å; L146-I149 PolarHBondContact O-N 3.4Å; L146-I149 VanDerWaalsContact O-N 3.11Å; L146-L242 HydrophobicContact CD2-CB 4.14Å; L146-L242 HydrophobicContact CD2-CD2 4.07Å; L146-L247 HydrophobicContact CB-CD2 3.71Å; L146-L247 HydrophobicContact CB-CG 4.28Å; L146-L247 WeakPolarHBondContact O-CD1 3.41Å; L146-L250 HydrophobicContact CD1-CD1 4.44Å
147	A	78.3	Confident	80.3	Confident	53 Å²	53	48.4 Å²	48.4	44%	0.438	24%	0.238	S	C	.	.	H	α-helix	trans	-64.2	-26.9	-176.6	0	0	0	0	0	113.8	A143 K144 R145 L247	A143-A147 VanDerWaalsContact O-CB 3.25Å; A143-A147 WeakPolarHBondContact O-CB 3.32Å; A143-A147 PolarHBondContact O-N 2.79Å; K144-A147 PolarHBondContact O-N 2.82Å; R145-A147 VanDerWaalsContact C-N 3.35Å; R145-A147 PolarHBondContact O-N 2.77Å; A147-L247 HydrophobicContact CB-CD2 4.01Å
148	G	77.2	Confident	80.4	Confident	24 Å²	24	53.1 Å²	53.1	25%	0.247	26%	0.262	C	S	.	.	H	α-helix	trans	-73	-23.6	175.3	0	0	0	0	0	114.6	K144 R145 L146 V151 L152	K144-G148 PolarHBondContact O-N 2.86Å; K144-G148 VanDerWaalsContact O-N 3.15Å; R145-G148 PolarHBondContact O-N 2.8Å; L146-G148 VanDerWaalsContact C-N 3.25Å; L146-G148 PolarHBondContact O-N 3.08Å; G148-V151 PolarHBondContact O-N 3.33Å; G148-L152 WeakPolarHBondContact O-CB 3.28Å; G148-L152 PolarHBondContact O-N 2.87Å
149	I	78.5	Confident	80.5	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-47.7	-169	-62	172	0	0	0	113.1	R145 L146 V151 L152 L153 A225 L242 V244	R145-I149 WeakPolarHBondContact O-CG1 3.49Å; L146-I149 HydrophobicContact CD2-CD1 4.01Å; L146-I149 WeakPolarHBondContact O-CB 3.48Å; L146-I149 WeakPolarHBondContact O-CG1 3.49Å; L146-I149 PolarHBondContact O-N 3.4Å; L146-I149 VanDerWaalsContact O-N 3.11Å; I149-V151 PolarHBondContact O-N 2.89Å; I149-L152 WeakPolarHBondContact O-CB 3.46Å; I149-L152 PolarHBondContact O-N 2.99Å; I149-L153 HydrophobicContact CG2-CD1 3.75Å; I149-L153 HydrophobicContact CG2-CG 3.91Å; I149-L153 WeakPolarHBondContact O-CB 3.36Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.2Å; I149-L153 PolarHBondContact O-N 2.86Å; I149-A225 HydrophobicContact CG2-CB 3.96Å; I149-L242 HydrophobicContact CD1-CB 3.51Å; I149-L242 HydrophobicContact CD1-CD1 3.63Å; I149-L242 HydrophobicContact CD1-CG 4.15Å; I149-V244 HydrophobicContact CG2-CG2 4.49Å
150	P	80	Confident	80.6	Confident	52 Å²	52	56.2 Å²	56.2	34%	0.338	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-40.2	-177.9	-23.9	35.8	0	0	0	113.3	L152 E154 V244 L247	P150-L152 VanDerWaalsContact C-N 3.28Å; P150-L152 PolarHBondContact O-N 3.11Å; P150-E154 PolarHBondContact O-N 2.85Å; P150-E154 VanDerWaalsContact O-N 3.11Å; P150-V244 HydrophobicContact CG-CG1 3.73Å; P150-V244 HydrophobicContact CG-CG2 4.01Å; P150-L247 HydrophobicContact CG-CD1 4.38Å
151	V	80.7	Confident	80.8	Confident	88 Å²	88	58.6 Å²	58.6	53%	0.533	29%	0.292	S	S	.	.	H	α-helix	trans	-65.6	-36.8	177.2	-179.4	0	0	0	0	110.8	G148 I149 R155	G148-V151 PolarHBondContact O-N 3.33Å; I149-V151 PolarHBondContact O-N 2.89Å; V151-R155 WeakPolarHBondContact O-CG 3.31Å; V151-R155 PolarHBondContact O-N 3.38Å
152	L	77.3	Confident	81.3	Confident	7 Å²	7	54 Å²	54	4%	0.037	28%	0.275	C	S	.	.	H	α-helix	trans	-74.1	-42.4	179.6	175.5	61.4	0	0	0	112.8	G148 I149 P150 E154 R155 L156 P452 D455 L456 I459	G148-L152 WeakPolarHBondContact O-CB 3.28Å; G148-L152 PolarHBondContact O-N 2.87Å; I149-L152 WeakPolarHBondContact O-CB 3.46Å; I149-L152 PolarHBondContact O-N 2.99Å; P150-L152 VanDerWaalsContact C-N 3.28Å; P150-L152 PolarHBondContact O-N 3.11Å; L152-E154 PolarHBondContact O-N 2.9Å; L152-R155 PolarHBondContact O-N 2.94Å; L152-R155 VanDerWaalsContact O-N 3.15Å; L152-L156 HydrophobicContact CD1-CD1 4.46Å; L152-L156 HydrophobicContact CD1-CG 4.34Å; L152-L156 HydrophobicContact CG-CD1 4.35Å; L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 3.21Å; L152-P452 WeakPolarHBondContact CD1-O 3.36Å; L152-D455 HydrophobicContact CD1-CB 4.33Å; L152-L456 HydrophobicContact CD1-CB 4Å; L152-L456 HydrophobicContact CD2-CB 3.67Å; L152-L456 HydrophobicContact CD2-CD1 3.68Å; L152-L456 HydrophobicContact CD2-CG 4.2Å; L152-L456 HydrophobicContact CG-CB 4.29Å; L152-I459 HydrophobicContact CD2-CD1 3.74Å
153	L	81.3	Confident	81.9	Confident	7 Å²	7	53.5 Å²	53.5	4%	0.037	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-35.8	172	-72.4	-179.3	0	0	0	111.4	I149 R157 Q193 F218 G220	I149-L153 HydrophobicContact CG2-CD1 3.75Å; I149-L153 HydrophobicContact CG2-CG 3.91Å; I149-L153 WeakPolarHBondContact O-CB 3.36Å; I149-L153 VanDerWaalsContact O-CG 3.31Å; I149-L153 WeakPolarHBondContact O-CG 3.2Å; I149-L153 PolarHBondContact O-N 2.86Å; L153-R157 WeakPolarHBondContact O-CB 3.44Å; L153-R157 PolarHBondContact O-N 3.23Å; L153-R157 VanDerWaalsContact O-N 3.1Å; L153-Q193 HydrophobicContact CD2-CB 4.31Å; L153-Q193 PolarHBondContact O-NE2 3.46Å; L153-F218 HydrophobicContact CD2-CE1 3.59Å; L153-F218 HydrophobicContact CD2-CZ 3.69Å; L153-G220 VanDerWaalsContact CD2-CA 3.45Å
154	E	83.9	Confident	82.3	Confident	61 Å²	61	52.9 Å²	52.9	29%	0.285	26%	0.263	S	S	.	.	H	α-helix	trans	-67	-47	172.2	-172.2	58	-144.6	0	0	112	P150 L152 L156 R157 Q158	P150-E154 PolarHBondContact O-N 2.85Å; P150-E154 VanDerWaalsContact O-N 3.11Å; L152-E154 PolarHBondContact O-N 2.9Å; E154-L156 PolarHBondContact O-N 2.93Å; E154-R157 WeakPolarHBondContact O-CB 3.35Å; E154-R157 PolarHBondContact O-N 3.41Å; E154-R157 IonicContact OE1-CZ 3.16Å; E154-R157 IonicContact OE1-NE 3.34Å; E154-R157 PolarHBondContact OE1-NE 2.82Å; E154-R157 IonicContact OE1-NH2 2.8Å; E154-R157 PolarHBondContact OE1-NH2 2.92Å; E154-R157 IonicContact OE2-CZ 3.16Å; E154-R157 IonicContact OE2-NE 2.79Å; E154-R157 PolarHBondContact OE2-NE 2.82Å; E154-R157 IonicContact OE2-NH2 2.76Å; E154-R157 PolarHBondContact OE2-NH2 2.61Å; E154-Q158 WeakPolarHBondContact O-CG 3.22Å; E154-Q158 PolarHBondContact O-N 3.46Å; E154-Q158 PolarHBondContact OE1-NE2 2.93Å
155	R	83	Confident	82.9	Confident	115 Å²	115	49.8 Å²	49.8	43%	0.434	25%	0.25	S	S	.	.	H	α-helix	trans	-60.5	-42.6	177.1	-73.1	178.2	178.3	-169.1	-2.4	112.7	V151 L152 R157 Q158 A159 P452 D455	V151-R155 WeakPolarHBondContact O-CG 3.31Å; V151-R155 PolarHBondContact O-N 3.38Å; L152-R155 PolarHBondContact O-N 2.94Å; L152-R155 VanDerWaalsContact O-N 3.15Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R155-Q158 PolarHBondContact O-N 2.72Å; R155-A159 PolarHBondContact O-N 3.29Å; R155-P452 HydrophobicContact CB-CB 3.9Å; R155-P452 HydrophobicContact CB-CG 4.1Å; R155-D455 IonicContact CZ-OD2 3.49Å; R155-D455 IonicContact NH1-OD2 3.51Å; R155-D455 PolarHBondContact NH1-OD2 2.75Å
156	L	83.5	Confident	83.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-62.9	-42.2	176.2	-69.1	172.2	0	0	0	111	L152 E154 Q158 A159 K190 G192 F218 P452 I453 L456	L152-L156 HydrophobicContact CD1-CD1 4.46Å; L152-L156 HydrophobicContact CD1-CG 4.34Å; L152-L156 HydrophobicContact CG-CD1 4.35Å; L152-L156 WeakPolarHBondContact O-CG 3.48Å; L152-L156 PolarHBondContact O-N 3.21Å; E154-L156 PolarHBondContact O-N 2.93Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 3.46Å; L156-A159 PolarHBondContact O-N 2.87Å; L156-K190 WeakPolarHBondContact O-CE 3.2Å; L156-K190 PolarHBondContact O-NZ 2.81Å; L156-G192 CarbonylContact C-O 3.59Å; L156-G192 VanDerWaalsContact C-O 3.24Å; L156-F218 HydrophobicContact CD1-CD1 4.21Å; L156-F218 HydrophobicContact CD1-CE1 3.77Å; L156-P452 HydrophobicContact CD2-CB 4.4Å; L156-I453 HydrophobicContact CD2-CG1 3.82Å; L156-L456 HydrophobicContact CD1-CD2 4.28Å
157	R	86.6	Confident	83.7	Confident	149 Å²	149	52.6 Å²	52.6	56%	0.562	26%	0.263	S	S	*	.	H	α-helix	trans	-61.2	-33	175.1	-168.9	175.8	71.4	164.2	6.1	113.3	L153 E154 R155 Q193	L153-R157 WeakPolarHBondContact O-CB 3.44Å; L153-R157 PolarHBondContact O-N 3.23Å; L153-R157 VanDerWaalsContact O-N 3.1Å; E154-R157 WeakPolarHBondContact O-CB 3.35Å; E154-R157 PolarHBondContact O-N 3.41Å; E154-R157 IonicContact OE1-CZ 3.16Å; E154-R157 IonicContact OE1-NE 3.34Å; E154-R157 PolarHBondContact OE1-NE 2.82Å; E154-R157 IonicContact OE1-NH2 2.8Å; E154-R157 PolarHBondContact OE1-NH2 2.92Å; E154-R157 IonicContact OE2-CZ 3.16Å; E154-R157 IonicContact OE2-NE 2.79Å; E154-R157 PolarHBondContact OE2-NE 2.82Å; E154-R157 IonicContact OE2-NH2 2.76Å; E154-R157 PolarHBondContact OE2-NH2 2.61Å; R155-R157 VanDerWaalsContact C-N 3.35Å; R157-Q193 HydrophobicContact CB-CG 3.82Å; R157-Q193 HydrophobicContact CG-CG 4.36Å
158	Q	86.6	Confident	83.8	Confident	138 Å²	138	53.9 Å²	53.9	65%	0.645	26%	0.257	S	S	*	.	H	α-helix	trans	-84.5	-30.1	-179.7	-69.6	176.4	9.4	0	0	113.6	E154 R155 L156	E154-Q158 WeakPolarHBondContact O-CG 3.22Å; E154-Q158 PolarHBondContact O-N 3.46Å; E154-Q158 PolarHBondContact OE1-NE2 2.93Å; R155-Q158 PolarHBondContact O-N 2.72Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 3.46Å
159	A	84.5	Confident	84.1	Confident	9 Å²	9	54.6 Å²	54.6	7%	0.074	25%	0.254	C	S	.	.	S	Bend	trans	-60.9	144.7	171.3	0	0	0	0	0	110.5	R155 L156 K190 Q449	R155-A159 PolarHBondContact O-N 3.29Å; L156-A159 PolarHBondContact O-N 2.87Å; A159-K190 PolarHBondContact O-NZ 3.32Å; A159-Q449 HydrophobicContact CB-CG 4.43Å
160	Q	85.6	Confident	83.9	Confident	138 Å²	138	56.9 Å²	56.9	65%	0.645	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-68	162.1	173.2	-58.4	177.3	14.9	0	0	111.1	K190	Q160-K190 WeakPolarHBondContact O-CD 3.45Å; Q160-K190 PolarHBondContact O-NZ 3.22Å
161	D	88	Confident	83.6	Confident	72 Å²	72	56.8 Å²	56.8	39%	0.385	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-85.7	137.5	178.9	-74.1	7.8	0	0	0	110.8	K190 S191 G192	D161-K190 WeakPolarHBondContact CA-O 3.37Å; D161-K190 IonicContact OD1-NZ 3.51Å; D161-K190 PolarHBondContact OD1-NZ 2.9Å; D161-S191 WeakPolarHBondContact OD1-CA 3.31Å; D161-S191 WeakPolarHBondContact OD2-CA 3.24Å; D161-S191 VanDerWaalsContact OD2-CB 3.28Å; D161-S191 WeakPolarHBondContact OD2-CB 3.37Å; D161-S191 PolarHBondContact OD2-OG 2.97Å; D161-G192 PolarHBondContact OD1-N 3.1Å; D161-G192 PolarHBondContact OD2-N 3.42Å
162	F	87.9	Confident	83.1	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	156.6	-177.3	70.7	-86.1	0	0	0	114.2	V164 K190 L444 Q449 I453 N501 I554	F162-V164 HydrophobicContact CD2-CB 4.21Å; F162-V164 HydrophobicContact CD2-CG1 4.04Å; F162-V164 HydrophobicContact CE2-CB 4.32Å; F162-V164 HydrophobicContact CE2-CG1 3.67Å; F162-K190 HydrophobicContact CD1-CB 4.15Å; F162-K190 HydrophobicContact CD1-CD 4.36Å; F162-K190 HydrophobicContact CE1-CB 3.9Å; F162-K190 HydrophobicContact CE1-CD 4.31Å; F162-K190 HydrophobicContact CE1-CG 4.36Å; F162-K190 HydrophobicContact CZ-CB 4.35Å; F162-K190 PolarHBondContact N-O 3.24Å; F162-K190 PolarHBondContact O-N 3.47Å; F162-L444 HydrophobicContact CB-CD2 3.75Å; F162-L444 HydrophobicContact CD1-CD2 4.25Å; F162-L444 HydrophobicContact CD2-CD1 3.78Å; F162-L444 HydrophobicContact CD2-CD2 3.89Å; F162-L444 HydrophobicContact CE2-CD1 3.86Å; F162-L444 HydrophobicContact CG-CD1 4.44Å; F162-L444 HydrophobicContact CG-CD2 3.71Å; F162-Q449 HydrophobicContact CD1-CB 4.43Å; F162-Q449 HydrophobicContact CE1-CB 3.89Å; F162-I453 HydrophobicContact CE1-CD1 3.69Å; F162-I453 HydrophobicContact CZ-CD1 3.42Å; F162-I453 VanDerWaalsContact CZ-CD1 3.42Å; F162-N501 VanDerWaalsContact CA-OD1 3.32Å; F162-N501 WeakPolarHBondContact CA-OD1 3.24Å; F162-I554 WeakPolarHBondContact O-CD1 3.45Å
163	Y	88.9	Confident	82.6	Confident	27 Å²	27	62 Å²	62	11%	0.106	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	137.8	163.5	173.4	-109.3	0	0	0	109.8	E165 R187 V188 W189 N499 L500 N501	Y163-E165 HydrophobicContact CE1-CG 4.03Å; Y163-E165 WeakPolarHBondContact OH-CG 3.43Å; Y163-E165 PolarHBondContact OH-OE1 3.44Å; Y163-R187 HydrophobicContact CE2-CB 4.1Å; Y163-V188 WeakPolarHBondContact CA-O 3.36Å; Y163-V188 WeakPolarHBondContact CD2-O 3.37Å; Y163-W189 AromaticContact CD2-CD1 3.4Å; Y163-W189 VanDerWaalsContact CD2-CD1 3.4Å; Y163-W189 AromaticContact CD2-CD2 3.78Å; Y163-W189 HydrophobicContact CD2-CD2 3.78Å; Y163-W189 AromaticContact CD2-CE2 3.53Å; Y163-W189 AromaticContact CD2-CG 3.73Å; Y163-W189 HydrophobicContact CD2-CG 3.73Å; Y163-W189 HydrophobicContact CD2-CZ2 4.24Å; Y163-W189 AromaticContact CD2-NE1 3.25Å; Y163-W189 AromaticContact CE2-CD2 3.87Å; Y163-W189 HydrophobicContact CE2-CD2 3.87Å; Y163-W189 AromaticContact CE2-CE2 3.35Å; Y163-W189 HydrophobicContact CE2-CE3 4.46Å; Y163-W189 HydrophobicContact CE2-CG 4.32Å; Y163-W189 HydrophobicContact CE2-CH2 4.24Å; Y163-W189 AromaticContact CE2-CZ2 3.57Å; Y163-W189 HydrophobicContact CE2-CZ2 3.57Å; Y163-W189 AromaticContact CE2-NE1 3.48Å; Y163-N499 VanDerWaalsContact CD1-O 3.25Å; Y163-N499 WeakPolarHBondContact CD1-O 3.4Å; Y163-N499 HydrophobicContact CE1-CB 4.35Å; Y163-N499 WeakPolarHBondContact CE1-O 3.48Å; Y163-L500 WeakPolarHBondContact O-CA 3.31Å; Y163-N501 PolarHBondContact N-OD1 3.34Å; Y163-N501 PolarHBondContact O-N 3.41Å; Y163-N501 PolarHBondContact O-OD1 3.3Å
164	V	87.6	Confident	81.9	Confident	9 Å²	9	63.6 Å²	63.6	6%	0.055	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.4	172.3	69.4	0	0	0	0	111.3	F162 V188 L444 F497 L500	F162-V164 HydrophobicContact CD2-CB 4.21Å; F162-V164 HydrophobicContact CD2-CG1 4.04Å; F162-V164 HydrophobicContact CE2-CB 4.32Å; F162-V164 HydrophobicContact CE2-CG1 3.67Å; V164-V188 HydrophobicContact CG1-CB 3.99Å; V164-V188 PolarHBondContact N-O 2.95Å; V164-V188 PolarHBondContact O-N 2.94Å; V164-L444 HydrophobicContact CB-CD1 4.17Å; V164-L444 HydrophobicContact CG1-CD1 4.43Å; V164-L444 HydrophobicContact CG2-CD1 4.25Å; V164-F497 HydrophobicContact CG2-CB 4.34Å; V164-F497 HydrophobicContact CG2-CD1 4.25Å; V164-L500 HydrophobicContact CB-CD2 3.82Å; V164-L500 HydrophobicContact CG2-CD2 3.54Å; V164-L500 HydrophobicContact CG2-CG 4.21Å
165	E	89.1	Confident	80.7	Confident	38 Å²	38	65.7 Å²	65.7	18%	0.178	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	132.6	166.9	-69.5	174.2	-164.7	0	0	110	Y163 T185 Y186 R187 F497 S498 N499	Y163-E165 HydrophobicContact CE1-CG 4.03Å; Y163-E165 WeakPolarHBondContact OH-CG 3.43Å; Y163-E165 PolarHBondContact OH-OE1 3.44Å; E165-T185 HydrophobicContact CB-CG2 4.08Å; E165-T185 HydrophobicContact CG-CG2 4.31Å; E165-Y186 WeakPolarHBondContact CA-O 3.01Å; E165-R187 HydrophobicContact CG-CG 4.34Å; E165-F497 CarbonylContact O-C 3.53Å; E165-F497 VanDerWaalsContact O-CA 3.29Å; E165-F497 WeakPolarHBondContact O-CA 3.38Å; E165-S498 WeakPolarHBondContact CB-OG 3.37Å; E165-S498 PolarHBondContact N-O 3.3Å; E165-S498 PolarHBondContact O-N 3.38Å; E165-N499 HydrophobicContact CB-CB 4.35Å; E165-N499 HydrophobicContact CG-CB 4.05Å; E165-N499 PolarHBondContact OE1-ND2 3.05Å
166	M	84.6	Confident	79.5	Confident	31 Å²	31	65.6 Å²	65.6	15%	0.153	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	98.6	173.1	175.3	-178.3	53.9	0	0	108.2	W168 Y186 I495 F497	M166-W168 HydrophobicContact SD-CZ2 4.28Å; M166-W168 PolarHBondContact SD-NE1 3.22Å; M166-Y186 HydrophobicContact CE-CD1 4.17Å; M166-Y186 HydrophobicContact CE-CD2 4.49Å; M166-Y186 HydrophobicContact CE-CG 3.86Å; M166-Y186 PolarHBondContact N-O 3.47Å; M166-Y186 PolarHBondContact O-N 3.44Å; M166-I495 HydrophobicContact CG-CG2 3.7Å; M166-I495 HydrophobicContact SD-CG2 4.11Å; M166-F497 HydrophobicContact CB-CD1 4.01Å; M166-F497 HydrophobicContact CB-CE1 3.91Å; M166-F497 HydrophobicContact CG-CD1 4.21Å; M166-F497 HydrophobicContact CG-CE1 3.74Å; M166-F497 HydrophobicContact CG-CZ 4.05Å; M166-F497 HydrophobicContact SD-CE1 3.77Å; M166-F497 HydrophobicContact SD-CZ 3.89Å
167	K	85.2	Confident	78.3	Confident	76 Å²	76	67.8 Å²	67.8	33%	0.33	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	130.5	179.1	-164.1	-175.8	-167.7	-165.2	0	110.6	E169 D184 I495 T496	K167-E169 HydrophobicContact CD-CG 4.02Å; K167-E169 WeakPolarHBondContact CE-OE1 3.04Å; K167-E169 HydrophobicContact CG-CG 4.08Å; K167-E169 IonicContact NZ-OE1 2.74Å; K167-E169 PolarHBondContact NZ-OE1 3.46Å; K167-D184 WeakPolarHBondContact CA-O 3.47Å; K167-I495 WeakPolarHBondContact O-CA 3.3Å; K167-T496 PolarHBondContact N-O 2.88Å; K167-T496 PolarHBondContact O-N 2.93Å
168	W	80.5	Confident	76.9	Confident	80 Å²	80	63.8 Å²	63.8	30%	0.303	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.3	172.6	-71.7	73.5	0	0	0	109.1	M166 S183 D184 Y186 I495	M166-W168 HydrophobicContact SD-CZ2 4.28Å; M166-W168 PolarHBondContact SD-NE1 3.22Å; W168-S183 VanDerWaalsContact O-CA 3.25Å; W168-S183 WeakPolarHBondContact O-CA 3.41Å; W168-D184 PolarHBondContact N-O 2.89Å; W168-D184 PolarHBondContact O-N 3.47Å; W168-Y186 AromaticContact CD1-CD2 3.67Å; W168-Y186 AromaticContact NE1-CD2 3.99Å; W168-I495 HydrophobicContact CD2-CG1 3.96Å; W168-I495 HydrophobicContact CE3-CD1 4.24Å; W168-I495 HydrophobicContact CE3-CG1 3.8Å; W168-I495 HydrophobicContact CH2-CD1 3.4Å; W168-I495 VanDerWaalsContact CH2-CD1 3.4Å; W168-I495 HydrophobicContact CH2-CG1 3.88Å; W168-I495 HydrophobicContact CZ2-CD1 3.74Å; W168-I495 HydrophobicContact CZ2-CG1 4.03Å; W168-I495 HydrophobicContact CZ2-CG2 4.45Å; W168-I495 HydrophobicContact CZ3-CD1 3.68Å; W168-I495 HydrophobicContact CZ3-CG1 3.76Å
169	E	82.1	Confident	75.4	Confident	39 Å²	39	67.2 Å²	67.2	18%	0.182	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.5	180	-55.1	-176.1	135.6	0	0	109.6	K167 T171 R494	K167-E169 HydrophobicContact CD-CG 4.02Å; K167-E169 WeakPolarHBondContact CE-OE1 3.04Å; K167-E169 HydrophobicContact CG-CG 4.08Å; K167-E169 IonicContact NZ-OE1 2.74Å; K167-E169 PolarHBondContact NZ-OE1 3.46Å; E169-T171 HydrophobicContact CB-CG2 4.45Å; E169-R494 HydrophobicContact CB-CB 4.36Å; E169-R494 PolarHBondContact N-O 2.81Å; E169-R494 PolarHBondContact O-N 3.04Å; E169-R494 WeakPolarHBondContact OE2-CD 3.34Å; E169-R494 IonicContact OE2-CZ 2.68Å; E169-R494 IonicContact OE2-NE 2.99Å; E169-R494 IonicContact OE2-NH1 3.09Å; E169-R494 PolarHBondContact OE2-NH1 3.43Å
170	F	76	Confident	74.1	Confident	54 Å²	54	73.2 Å²	73.2	24%	0.237	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	132.5	166.3	-69.7	-112.9	0	0	0	108.3	C181 P182 L487 A493	F170-C181 HydrophobicContact CB-CB 3.8Å; F170-C181 VanDerWaalsContact O-CB 3.26Å; F170-C181 WeakPolarHBondContact O-CB 3.21Å; F170-P182 HydrophobicContact CD2-CG 3.59Å; F170-P182 HydrophobicContact CE2-CG 3.86Å; F170-P182 HydrophobicContact CG-CG 4.06Å; F170-P182 PolarHBondContact N-O 2.85Å; F170-L487 HydrophobicContact CD1-CD1 4Å; F170-L487 HydrophobicContact CE1-CD1 3.57Å; F170-A493 HydrophobicContact CD1-CB 4.33Å; F170-A493 HydrophobicContact CE1-CB 4.19Å
171	T	73.1	Confident	73.1	Confident	50 Å²	50	67.7 Å²	67.7	31%	0.307	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	137.4	-170.6	55.8	0	0	0	0	110.5	E169 L491 N492	E169-T171 HydrophobicContact CB-CG2 4.45Å; T171-L491 CarbonylContact O-C 3.58Å; T171-L491 WeakPolarHBondContact O-CA 3.4Å; T171-N492 PolarHBondContact N-O 3.05Å; T171-N492 PolarHBondContact O-N 3.17Å; T171-N492 PolarHBondContact OG1-O 2.8Å
172	S	70.3	Confident	72.2	Confident	25 Å²	25	64.7 Å²	64.7	18%	0.175	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.5	179.2	-170.1	0	0	0	0	110.8	V174 I490	S172-V174 VanDerWaalsContact C-N 3.32Å; S172-V174 PolarHBondContact OG-N 2.85Å; S172-V174 VanDerWaalsContact OG-N 3.09Å; S172-I490 VanDerWaalsContact CA-O 3.26Å; S172-I490 WeakPolarHBondContact CA-O 3.5Å; S172-I490 VanDerWaalsContact CB-O 3.25Å; S172-I490 WeakPolarHBondContact CB-O 3.4Å; S172-I490 PolarHBondContact OG-O 3.34Å
173	W	66.6	Low	71.9	Confident	180 Å²	180	67.1 Å²	67.1	68%	0.682	34%	0.335	S	S	*	.	S	Bend	trans	-80	-17.3	165.7	66.4	-103.5	0	0	0	112.4	P175 H489 I490	W173-P175 WeakPolarHBondContact O-CD 3.47Å; W173-H489 PolarHBondContact NE1-O 3.03Å; W173-I490 HydrophobicContact CZ2-CG2 3.76Å
174	V	67.4	Low	71.5	Confident	40 Å²	40	66.1 Å²	66.1	24%	0.242	33%	0.332	C	S	.	.	S	Bend	trans	-76.2	124.9	176.5	-172.8	0	0	0	0	108.5	S172 V177 I490	S172-V174 VanDerWaalsContact C-N 3.32Å; S172-V174 PolarHBondContact OG-N 2.85Å; S172-V174 VanDerWaalsContact OG-N 3.09Å; V174-V177 HydrophobicContact CB-CB 4.23Å; V174-V177 HydrophobicContact CB-CG2 3.79Å; V174-V177 HydrophobicContact CG1-CG2 3.66Å; V174-I490 HydrophobicContact CG2-CB 4.13Å; V174-I490 HydrophobicContact CG2-CG2 4.16Å
175	P	57.6	Low	71.5	Confident	105 Å²	105	67.6 Å²	67.6	68%	0.682	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	152.8	174.6	-26.1	35.6	0	0	0	112.3	W173 V177	W173-P175 WeakPolarHBondContact O-CD 3.47Å; P175-V177 PolarHBondContact O-N 3.44Å
176	L	57.8	Low	71.3	Confident	112 Å²	112	68.5 Å²	68.5	59%	0.586	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	-31.6	-178.7	-52.6	175	0	0	0	116.3	S178 R179	L176-S178 PolarHBondContact O-N 2.89Å; L176-R179 WeakPolarHBondContact O-CB 3.31Å; L176-R179 PolarHBondContact O-N 2.89Å
177	V	58.4	Low	71.6	Confident	46 Å²	46	71.8 Å²	71.8	28%	0.279	35%	0.354	S	S	.	.	H	α-helix	trans	-56.6	-34.8	176	176.8	0	0	0	0	111.6	V174 P175 R179 I180 C181 L491	V174-V177 HydrophobicContact CB-CB 4.23Å; V174-V177 HydrophobicContact CB-CG2 3.79Å; V174-V177 HydrophobicContact CG1-CG2 3.66Å; P175-V177 PolarHBondContact O-N 3.44Å; V177-R179 PolarHBondContact O-N 2.79Å; V177-I180 PolarHBondContact O-N 2.89Å; V177-C181 PolarHBondContact O-N 2.92Å; V177-C181 PolarHBondContact O-SG 3.46Å; V177-L491 HydrophobicContact CG1-CD2 4.37Å
178	S	56.7	Low	71.7	Confident	66 Å²	66	68.8 Å²	68.8	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-15.8	173.9	56	0	0	0	0	115.2	L176	L176-S178 PolarHBondContact O-N 2.89Å
179	R	55.3	Low	72.3	Confident	210 Å²	210	66.3 Å²	66.3	79%	0.792	33%	0.332	S	S	*	.	H	α-helix	trans	-85.1	-17.4	172.6	-61.9	-177	175.4	178.1	-1.1	113.2	L176 V177	L176-R179 WeakPolarHBondContact O-CB 3.31Å; L176-R179 PolarHBondContact O-N 2.89Å; V177-R179 PolarHBondContact O-N 2.79Å
180	I	58	Low	72.7	Confident	135 Å²	135	64.5 Å²	64.5	69%	0.692	32%	0.324	S	S	*	.	H	α-helix	trans	-100.1	-23	179.4	-53.1	172.5	0	0	0	110.5	V177	V177-I180 PolarHBondContact O-N 2.89Å
181	C	63.3	Low	73.4	Confident	21 Å²	21	63.3 Å²	63.3	14%	0.142	32%	0.322	C	S	.	.	S	Bend	trans	-52	132.2	169.6	-75.2	0	0	0	0	111.8	F170 V177 L491	F170-C181 HydrophobicContact CB-CB 3.8Å; F170-C181 VanDerWaalsContact O-CB 3.26Å; F170-C181 WeakPolarHBondContact O-CB 3.21Å; V177-C181 PolarHBondContact O-N 2.92Å; V177-C181 PolarHBondContact O-SG 3.46Å; C181-L491 VanDerWaalsContact SG-CD2 3.57Å
182	P	70.6	Confident	74.1	Confident	9 Å²	9	62.2 Å²	62.2	6%	0.058	32%	0.321	C	S	.	.			trans	-70.6	157.3	175.5	33.7	-37.6	0	0	0	110.4	F170 L201 W209	F170-P182 HydrophobicContact CD2-CG 3.59Å; F170-P182 HydrophobicContact CE2-CG 3.86Å; F170-P182 HydrophobicContact CG-CG 4.06Å; F170-P182 PolarHBondContact N-O 2.85Å; P182-L201 HydrophobicContact CB-CD1 4.41Å; P182-L201 HydrophobicContact CB-CD2 4.46Å; P182-W209 HydrophobicContact CB-CD2 3.72Å; P182-W209 HydrophobicContact CB-CE3 4.16Å; P182-W209 HydrophobicContact CB-CG 3.93Å; P182-W209 HydrophobicContact CB-CZ2 4.43Å; P182-W209 HydrophobicContact CG-CD2 3.83Å; P182-W209 VanDerWaalsContact CG-CE2 3.48Å; P182-W209 HydrophobicContact CG-CE3 4.2Å; P182-W209 HydrophobicContact CG-CG 4.44Å; P182-W209 HydrophobicContact CG-CH2 3.98Å; P182-W209 HydrophobicContact CG-CZ2 3.6Å; P182-W209 HydrophobicContact CG-CZ3 4.26Å
183	S	80.1	Confident	75	Confident	57 Å²	57	62.9 Å²	62.9	40%	0.399	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.4	171.6	58.5	0	0	0	0	109.9	W168 R211	W168-S183 VanDerWaalsContact O-CA 3.25Å; W168-S183 WeakPolarHBondContact O-CA 3.41Å; S183-R211 PolarHBondContact O-NH1 2.98Å; S183-R211 PolarHBondContact O-NH2 3.42Å
184	D	82.4	Confident	76.2	Confident	5 Å²	5	55.5 Å²	55.5	3%	0.027	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	165.2	-178.7	-159.1	1.8	0	0	0	110.3	K167 W168 Y186 T199 T200 L201	K167-D184 WeakPolarHBondContact CA-O 3.47Å; W168-D184 PolarHBondContact N-O 2.89Å; W168-D184 PolarHBondContact O-N 3.47Å; D184-Y186 HydrophobicContact CB-CD2 4.47Å; D184-Y186 HydrophobicContact CB-CE2 4.18Å; D184-Y186 VanDerWaalsContact OD2-CE2 3.24Å; D184-Y186 WeakPolarHBondContact OD2-CE2 3.09Å; D184-T199 PolarHBondContact OD2-OG1 3.25Å; D184-T200 WeakPolarHBondContact OD1-CB 3.35Å; D184-T200 PolarHBondContact OD1-N 2.82Å; D184-T200 PolarHBondContact OD1-OG1 3.36Å; D184-T200 PolarHBondContact OD2-N 3.47Å; D184-L201 HydrophobicContact CB-CB 4.11Å; D184-L201 WeakPolarHBondContact OD2-CB 3.45Å; D184-L201 PolarHBondContact OD2-N 2.99Å
185	T	86.7	Confident	77.3	Confident	40 Å²	40	53.9 Å²	53.9	25%	0.245	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	96.2	178.2	-55.7	0	0	0	0	109	E165 R187	E165-T185 HydrophobicContact CB-CG2 4.08Å; E165-T185 HydrophobicContact CG-CG2 4.31Å; T185-R187 PolarHBondContact O-N 3.33Å
186	Y	85.7	Confident	78.9	Confident	57 Å²	57	50.6 Å²	50.6	22%	0.224	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	116.3	178	-78.3	-111.5	0	0	0	108.3	E165 M166 W168 D184 V197 D198 T199	E165-Y186 WeakPolarHBondContact CA-O 3.01Å; M166-Y186 HydrophobicContact CE-CD1 4.17Å; M166-Y186 HydrophobicContact CE-CD2 4.49Å; M166-Y186 HydrophobicContact CE-CG 3.86Å; M166-Y186 PolarHBondContact N-O 3.47Å; M166-Y186 PolarHBondContact O-N 3.44Å; W168-Y186 AromaticContact CD1-CD2 3.67Å; W168-Y186 AromaticContact NE1-CD2 3.99Å; D184-Y186 HydrophobicContact CB-CD2 4.47Å; D184-Y186 HydrophobicContact CB-CE2 4.18Å; D184-Y186 VanDerWaalsContact OD2-CE2 3.24Å; D184-Y186 WeakPolarHBondContact OD2-CE2 3.09Å; Y186-V197 HydrophobicContact CD1-CG1 3.85Å; Y186-D198 VanDerWaalsContact CA-O 3.31Å; Y186-D198 WeakPolarHBondContact CA-O 3.4Å; Y186-T199 PolarHBondContact OH-OG1 3.18Å
187	R	89.3	Confident	80.3	Confident	100 Å²	100	45.9 Å²	45.9	38%	0.377	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	122.3	178.6	-49.8	-172.8	-165.2	141.2	7	108.3	Y163 E165 T185 W189 V197 D198	Y163-R187 HydrophobicContact CE2-CB 4.1Å; E165-R187 HydrophobicContact CG-CG 4.34Å; T185-R187 PolarHBondContact O-N 3.33Å; R187-W189 HydrophobicContact CB-CE3 4.38Å; R187-W189 HydrophobicContact CB-CH2 3.49Å; R187-W189 VanDerWaalsContact CB-CH2 3.49Å; R187-W189 HydrophobicContact CB-CZ2 4.26Å; R187-W189 HydrophobicContact CB-CZ3 3.55Å; R187-W189 HydrophobicContact CG-CH2 4.41Å; R187-W189 WeakPolarHBondContact O-CZ3 3.35Å; R187-V197 CarbonylContact O-C 3.59Å; R187-V197 WeakPolarHBondContact O-CA 3.42Å; R187-D198 HydrophobicContact CB-CB 4.27Å; R187-D198 PolarHBondContact N-O 3.29Å; R187-D198 VanDerWaalsContact N-O 3.11Å; R187-D198 PolarHBondContact O-N 3.17Å
188	V	88.9	Confident	81.8	Confident	14 Å²	14	44.3 Å²	44.3	9%	0.085	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.5	-172.5	-175.8	0	0	0	0	109.4	Y163 V164 L195 R196 V197	Y163-V188 WeakPolarHBondContact CA-O 3.36Å; Y163-V188 WeakPolarHBondContact CD2-O 3.37Å; V164-V188 HydrophobicContact CG1-CB 3.99Å; V164-V188 PolarHBondContact N-O 2.95Å; V164-V188 PolarHBondContact O-N 2.94Å; V188-L195 HydrophobicContact CG1-CD1 3.72Å; V188-R196 WeakPolarHBondContact CA-O 3.24Å; V188-V197 HydrophobicContact CG1-CG2 4.35Å; V188-V197 HydrophobicContact CG2-CG1 4.32Å; V188-V197 HydrophobicContact CG2-CG2 4.25Å
189	W	91.6	Very high	83.1	Confident	28 Å²	28	41.5 Å²	41.5	11%	0.106	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.5	169.7	-59	-102.1	0	0	0	108.5	Y163 R187 L195 R196 D198 I554 V558 F559	Y163-W189 AromaticContact CD2-CD1 3.4Å; Y163-W189 VanDerWaalsContact CD2-CD1 3.4Å; Y163-W189 AromaticContact CD2-CD2 3.78Å; Y163-W189 HydrophobicContact CD2-CD2 3.78Å; Y163-W189 AromaticContact CD2-CE2 3.53Å; Y163-W189 AromaticContact CD2-CG 3.73Å; Y163-W189 HydrophobicContact CD2-CG 3.73Å; Y163-W189 HydrophobicContact CD2-CZ2 4.24Å; Y163-W189 AromaticContact CD2-NE1 3.25Å; Y163-W189 AromaticContact CE2-CD2 3.87Å; Y163-W189 HydrophobicContact CE2-CD2 3.87Å; Y163-W189 AromaticContact CE2-CE2 3.35Å; Y163-W189 HydrophobicContact CE2-CE3 4.46Å; Y163-W189 HydrophobicContact CE2-CG 4.32Å; Y163-W189 HydrophobicContact CE2-CH2 4.24Å; Y163-W189 AromaticContact CE2-CZ2 3.57Å; Y163-W189 HydrophobicContact CE2-CZ2 3.57Å; Y163-W189 AromaticContact CE2-NE1 3.48Å; R187-W189 HydrophobicContact CB-CE3 4.38Å; R187-W189 HydrophobicContact CB-CH2 3.49Å; R187-W189 VanDerWaalsContact CB-CH2 3.49Å; R187-W189 HydrophobicContact CB-CZ2 4.26Å; R187-W189 HydrophobicContact CB-CZ3 3.55Å; R187-W189 HydrophobicContact CG-CH2 4.41Å; R187-W189 WeakPolarHBondContact O-CZ3 3.35Å; W189-L195 CarbonylContact O-C 3.53Å; W189-L195 WeakPolarHBondContact O-CA 3.47Å; W189-R196 HydrophobicContact CE3-CB 4.15Å; W189-R196 HydrophobicContact CE3-CG 3.85Å; W189-R196 HydrophobicContact CZ3-CG 4.12Å; W189-R196 PolarHBondContact N-O 2.92Å; W189-R196 PolarHBondContact O-N 2.73Å; W189-D198 HydrophobicContact CH2-CB 4.43Å; W189-D198 HydrophobicContact CZ3-CB 4.06Å; W189-D198 VanDerWaalsContact CZ3-CG 3.45Å; W189-D198 WeakPolarHBondContact CZ3-OD1 3.32Å; W189-I554 HydrophobicContact CB-CG2 4.32Å; W189-V558 HydrophobicContact CB-CG1 3.99Å; W189-V558 HydrophobicContact CD2-CG1 3.87Å; W189-V558 HydrophobicContact CE3-CG1 4.4Å; W189-V558 HydrophobicContact CG-CG1 3.7Å; W189-F559 HydrophobicContact CB-CE1 4.14Å; W189-F559 HydrophobicContact CB-CZ 4.09Å; W189-F559 WeakPolarHBondContact O-CE1 3.37Å
190	K	90.6	Very high	84.4	Confident	1 Å²	1	33.8 Å²	33.8	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	124.8	170.2	-179.2	-93.5	157.4	-166.2	0	108.9	L156 A159 Q160 D161 F162 G192 C194 L195 I453 I554	L156-K190 WeakPolarHBondContact O-CE 3.2Å; L156-K190 PolarHBondContact O-NZ 2.81Å; A159-K190 PolarHBondContact O-NZ 3.32Å; Q160-K190 WeakPolarHBondContact O-CD 3.45Å; Q160-K190 PolarHBondContact O-NZ 3.22Å; D161-K190 WeakPolarHBondContact CA-O 3.37Å; D161-K190 IonicContact OD1-NZ 3.51Å; D161-K190 PolarHBondContact OD1-NZ 2.9Å; F162-K190 HydrophobicContact CD1-CB 4.15Å; F162-K190 HydrophobicContact CD1-CD 4.36Å; F162-K190 HydrophobicContact CE1-CB 3.9Å; F162-K190 HydrophobicContact CE1-CD 4.31Å; F162-K190 HydrophobicContact CE1-CG 4.36Å; F162-K190 HydrophobicContact CZ-CB 4.35Å; F162-K190 PolarHBondContact N-O 3.24Å; F162-K190 PolarHBondContact O-N 3.47Å; K190-G192 WeakPolarHBondContact CE-O 3.32Å; K190-G192 PolarHBondContact NZ-O 3.23Å; K190-G192 VanDerWaalsContact NZ-O 3.13Å; K190-C194 WeakPolarHBondContact CA-O 3.39Å; K190-L195 HydrophobicContact CB-CD1 4.03Å; K190-I453 HydrophobicContact CB-CD1 4Å; K190-I453 HydrophobicContact CG-CD1 4.02Å; K190-I554 VanDerWaalsContact O-CD1 3.3Å; K190-I554 WeakPolarHBondContact O-CD1 3.49Å
191	S	90.8	Very high	85.1	Confident	28 Å²	28	29.1 Å²	29.1	20%	0.196	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	128.1	171.3	-178.5	0	0	0	0	112.4	D161 Q193 C194	D161-S191 WeakPolarHBondContact OD1-CA 3.31Å; D161-S191 WeakPolarHBondContact OD2-CA 3.24Å; D161-S191 VanDerWaalsContact OD2-CB 3.28Å; D161-S191 WeakPolarHBondContact OD2-CB 3.37Å; D161-S191 PolarHBondContact OD2-OG 2.97Å; S191-Q193 PolarHBondContact O-N 3.03Å; S191-Q193 VanDerWaalsContact O-N 3.13Å; S191-C194 PolarHBondContact N-O 2.84Å; S191-C194 WeakPolarHBondContact O-CA 3.22Å; S191-C194 WeakPolarHBondContact O-CB 3.2Å; S191-C194 PolarHBondContact O-N 2.68Å
192	G	89.1	Confident	85.4	Confident	28 Å²	28	31.9 Å²	31.9	29%	0.289	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-117	-175.7	0	0	0	0	0	112	L156 D161 K190	L156-G192 CarbonylContact C-O 3.59Å; L156-G192 VanDerWaalsContact C-O 3.24Å; D161-G192 PolarHBondContact OD1-N 3.1Å; D161-G192 PolarHBondContact OD2-N 3.42Å; K190-G192 WeakPolarHBondContact CE-O 3.32Å; K190-G192 PolarHBondContact NZ-O 3.23Å; K190-G192 VanDerWaalsContact NZ-O 3.13Å
193	Q	88.8	Confident	85	Confident	39 Å²	39	32.7 Å²	32.7	18%	0.182	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	10.8	174.7	-63.2	-175.4	-37.3	0	0	113.8	L153 R157 S191 G220	L153-Q193 HydrophobicContact CD2-CB 4.31Å; L153-Q193 PolarHBondContact O-NE2 3.46Å; R157-Q193 HydrophobicContact CB-CG 3.82Å; R157-Q193 HydrophobicContact CG-CG 4.36Å; S191-Q193 PolarHBondContact O-N 3.03Å; S191-Q193 VanDerWaalsContact O-N 3.13Å; Q193-G220 PolarHBondContact O-N 2.83Å
194	C	90.7	Very high	83.6	Confident	24 Å²	24	32.6 Å²	32.6	16%	0.162	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	143.6	179.6	-61.2	0	0	0	0	111.5	K190 S191 F218 F559	K190-C194 WeakPolarHBondContact CA-O 3.39Å; S191-C194 PolarHBondContact N-O 2.84Å; S191-C194 WeakPolarHBondContact O-CA 3.22Å; S191-C194 WeakPolarHBondContact O-CB 3.2Å; S191-C194 PolarHBondContact O-N 2.68Å; C194-F218 CarbonylContact C-O 3.24Å; C194-F218 VanDerWaalsContact CA-O 3.28Å; C194-F218 WeakPolarHBondContact CA-O 3.41Å; C194-F559 HydrophobicContact CB-CB 4.11Å; C194-F559 HydrophobicContact CB-CD1 3.54Å; C194-F559 HydrophobicContact CB-CD2 3.88Å; C194-F559 HydrophobicContact CB-CE1 3.85Å; C194-F559 HydrophobicContact CB-CE2 4.18Å; C194-F559 HydrophobicContact CB-CG 3.55Å; C194-F559 HydrophobicContact CB-CZ 4.17Å
195	L	90.1	Very high	81.9	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.031	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	140.5	175.7	177.6	74.1	0	0	0	108.6	V188 W189 K190 V197 F218 I453 L456	V188-L195 HydrophobicContact CG1-CD1 3.72Å; W189-L195 CarbonylContact O-C 3.53Å; W189-L195 WeakPolarHBondContact O-CA 3.47Å; K190-L195 HydrophobicContact CB-CD1 4.03Å; L195-V197 HydrophobicContact CD2-CG2 4.28Å; L195-V197 HydrophobicContact CG-CG2 4.26Å; L195-F218 HydrophobicContact CB-CB 4.31Å; L195-F218 PolarHBondContact N-O 3.26Å; L195-F218 PolarHBondContact O-N 3.44Å; L195-I453 HydrophobicContact CD1-CD1 3.92Å; L195-I453 HydrophobicContact CD1-CG1 3.99Å; L195-I453 HydrophobicContact CD1-CG2 3.98Å; L195-I453 HydrophobicContact CD2-CG1 4.43Å; L195-I453 HydrophobicContact CD2-CG2 3.75Å; L195-L456 HydrophobicContact CD2-CD2 3.68Å
196	R	91.4	Very high	80.1	Confident	36 Å²	36	42 Å²	42	14%	0.136	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	137.7	168.1	172.5	168.5	167.8	174.7	-6.1	109.9	V188 W189 D198 S215 F216 I217 V558 F559	V188-R196 WeakPolarHBondContact CA-O 3.24Å; W189-R196 HydrophobicContact CE3-CB 4.15Å; W189-R196 HydrophobicContact CE3-CG 3.85Å; W189-R196 HydrophobicContact CZ3-CG 4.12Å; W189-R196 PolarHBondContact N-O 2.92Å; W189-R196 PolarHBondContact O-N 2.73Å; R196-D198 VanDerWaalsContact CG-OD1 3.28Å; R196-D198 WeakPolarHBondContact CG-OD1 3.25Å; R196-D198 IonicContact CZ-OD1 2.74Å; R196-D198 IonicContact CZ-OD2 2.78Å; R196-D198 IonicContact NE-OD1 3.58Å; R196-D198 PolarHBondContact NE-OD1 3.37Å; R196-D198 IonicContact NE-OD2 3.89Å; R196-D198 IonicContact NH2-OD1 3.42Å; R196-D198 PolarHBondContact NH2-OD1 3.04Å; R196-D198 IonicContact NH2-OD2 3.01Å; R196-D198 PolarHBondContact NH2-OD2 3.17Å; R196-S215 PolarHBondContact NE-OG 2.93Å; R196-S215 PolarHBondContact NH2-OG 3.23Å; R196-F216 CarbonylContact C-O 3.49Å; R196-F216 WeakPolarHBondContact CA-O 3.29Å; R196-I217 HydrophobicContact CB-CG1 4.37Å; R196-I217 HydrophobicContact CG-CG1 4.01Å; R196-V558 HydrophobicContact CB-CG1 4.49Å; R196-V558 WeakPolarHBondContact CD-O 3.45Å; R196-V558 PolarHBondContact NH1-O 3.29Å; R196-F559 HydrophobicContact CB-CD1 3.93Å; R196-F559 HydrophobicContact CB-CE1 4.03Å
197	V	88.3	Confident	78.2	Confident	13 Å²	13	43 Å²	43	8%	0.079	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	113.8	176.5	-176.8	0	0	0	0	109	Y186 R187 V188 L195 F216 M457	Y186-V197 HydrophobicContact CD1-CG1 3.85Å; R187-V197 CarbonylContact O-C 3.59Å; R187-V197 WeakPolarHBondContact O-CA 3.42Å; V188-V197 HydrophobicContact CG1-CG2 4.35Å; V188-V197 HydrophobicContact CG2-CG1 4.32Å; V188-V197 HydrophobicContact CG2-CG2 4.25Å; L195-V197 HydrophobicContact CD2-CG2 4.28Å; L195-V197 HydrophobicContact CG-CG2 4.26Å; V197-F216 PolarHBondContact N-O 3.01Å; V197-F216 PolarHBondContact O-N 3.35Å; V197-M457 HydrophobicContact CG2-SD 4.47Å
198	D	89.8	Confident	76.5	Confident	13 Å²	13	41.8 Å²	41.8	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	140.6	175.4	-65.3	17.4	0	0	0	110	Y186 R187 W189 R196 R214 S215	Y186-D198 VanDerWaalsContact CA-O 3.31Å; Y186-D198 WeakPolarHBondContact CA-O 3.4Å; R187-D198 HydrophobicContact CB-CB 4.27Å; R187-D198 PolarHBondContact N-O 3.29Å; R187-D198 VanDerWaalsContact N-O 3.11Å; R187-D198 PolarHBondContact O-N 3.17Å; W189-D198 HydrophobicContact CH2-CB 4.43Å; W189-D198 HydrophobicContact CZ3-CB 4.06Å; W189-D198 VanDerWaalsContact CZ3-CG 3.45Å; W189-D198 WeakPolarHBondContact CZ3-OD1 3.32Å; R196-D198 VanDerWaalsContact CG-OD1 3.28Å; R196-D198 WeakPolarHBondContact CG-OD1 3.25Å; R196-D198 IonicContact CZ-OD1 2.74Å; R196-D198 IonicContact CZ-OD2 2.78Å; R196-D198 IonicContact NE-OD1 3.58Å; R196-D198 PolarHBondContact NE-OD1 3.37Å; R196-D198 IonicContact NE-OD2 3.89Å; R196-D198 IonicContact NH2-OD1 3.42Å; R196-D198 PolarHBondContact NH2-OD1 3.04Å; R196-D198 IonicContact NH2-OD2 3.01Å; R196-D198 PolarHBondContact NH2-OD2 3.17Å; D198-R214 VanDerWaalsContact CA-O 3.28Å; D198-R214 WeakPolarHBondContact CA-O 3.14Å; D198-S215 WeakPolarHBondContact OD1-CB 3.21Å; D198-S215 PolarHBondContact OD1-OG 2.98Å
199	T	84.5	Confident	75.3	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.043	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	152.6	-178.5	176.7	0	0	0	0	111.4	D184 Y186 L201 R214 F216	D184-T199 PolarHBondContact OD2-OG1 3.25Å; Y186-T199 PolarHBondContact OH-OG1 3.18Å; T199-L201 PolarHBondContact OG1-N 2.77Å; T199-R214 HydrophobicContact CG2-CB 3.88Å; T199-R214 PolarHBondContact N-O 2.92Å; T199-R214 PolarHBondContact O-N 2.97Å; T199-R214 VanDerWaalsContact O-N 3.14Å; T199-F216 HydrophobicContact CG2-CD2 4.22Å; T199-F216 HydrophobicContact CG2-CE2 3.8Å
200	T	82.3	Confident	74.1	Confident	49 Å²	49	48 Å²	48	30%	0.301	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-8.8	177	73.9	0	0	0	0	114.3	D184 R211 G212	D184-T200 WeakPolarHBondContact OD1-CB 3.35Å; D184-T200 PolarHBondContact OD1-N 2.82Å; D184-T200 PolarHBondContact OD1-OG1 3.36Å; D184-T200 PolarHBondContact OD2-N 3.47Å; T200-R211 VanDerWaalsContact O-CA 3.27Å; T200-R211 WeakPolarHBondContact O-CA 3.33Å; T200-R211 PolarHBondContact OG1-NH1 2.92Å; T200-G212 CarbonylContact C-O 3.54Å; T200-G212 WeakPolarHBondContact CA-O 3.27Å; T200-G212 PolarHBondContact O-N 2.82Å; T200-G212 VanDerWaalsContact O-N 3.1Å
201	L	73	Confident	73.7	Confident	36 Å²	36	54.2 Å²	54.2	19%	0.188	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	106.7	179.7	-167.1	68	0	0	0	110.2	P182 D184 T199 W209 R211	P182-L201 HydrophobicContact CB-CD1 4.41Å; P182-L201 HydrophobicContact CB-CD2 4.46Å; D184-L201 HydrophobicContact CB-CB 4.11Å; D184-L201 WeakPolarHBondContact OD2-CB 3.45Å; D184-L201 PolarHBondContact OD2-N 2.99Å; T199-L201 PolarHBondContact OG1-N 2.77Å; L201-W209 HydrophobicContact CD1-CB 4.08Å; L201-W209 HydrophobicContact CD1-CE3 3.99Å; L201-W209 HydrophobicContact CD2-CE3 4.27Å; L201-W209 HydrophobicContact CD2-CZ3 4.46Å; L201-R211 HydrophobicContact CD1-CG 4.45Å
202	M	68.8	Low	73.3	Confident	79 Å²	79	53.5 Å²	53.5	39%	0.389	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-30.8	-179.1	-63.9	-57.6	-48.4	0	0	113.1	Q210 R214	M202-Q210 HydrophobicContact CB-CB 3.87Å; M202-Q210 WeakPolarHBondContact CB-O 3.46Å; M202-Q210 PolarHBondContact N-O 3.36Å; M202-R214 HydrophobicContact CE-CG 3.84Å; M202-R214 HydrophobicContact SD-CG 3.28Å; M202-R214 WeakPolarHBondContact SD-CG 3.41Å; M202-R214 PolarHBondContact SD-NE 2.98Å
203	G	62.5	Low	73.3	Confident	26 Å²	26	54.8 Å²	54.8	27%	0.268	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	155.6	-160.2	-175.3	0	0	0	0	0	113	Q210	G203-Q210 PolarHBondContact N-O 2.86Å; G203-Q210 PolarHBondContact O-N 2.87Å
204	F	50.7	Low	73.2	Confident	55 Å²	55	54.4 Å²	54.4	24%	0.241	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	117	-178.6	-175.6	-111.3	0	0	0	109.2	M207 T208 W209	F204-M207 HydrophobicContact CE1-SD 3.77Å; F204-M207 HydrophobicContact CZ-CB 4.32Å; F204-M207 HydrophobicContact CZ-SD 3.83Å; F204-T208 WeakPolarHBondContact CA-O 3.48Å; F204-T208 WeakPolarHBondContact CD2-O 3.48Å; F204-W209 HydrophobicContact CB-CE3 3.91Å; F204-W209 HydrophobicContact CB-CH2 4.36Å; F204-W209 HydrophobicContact CB-CZ3 3.76Å; F204-W209 AromaticContact CD2-CD2 3.57Å; F204-W209 HydrophobicContact CD2-CD2 3.57Å; F204-W209 AromaticContact CD2-CE2 3.64Å; F204-W209 AromaticContact CD2-CE3 3.66Å; F204-W209 HydrophobicContact CD2-CE3 3.66Å; F204-W209 HydrophobicContact CD2-CG 4.17Å; F204-W209 AromaticContact CD2-CH2 3.91Å; F204-W209 HydrophobicContact CD2-CH2 3.91Å; F204-W209 AromaticContact CD2-CZ2 3.81Å; F204-W209 HydrophobicContact CD2-CZ2 3.81Å; F204-W209 AromaticContact CD2-CZ3 3.85Å; F204-W209 HydrophobicContact CD2-CZ3 3.85Å; F204-W209 HydrophobicContact CE2-CD2 4.15Å; F204-W209 AromaticContact CE2-CE2 3.79Å; F204-W209 HydrophobicContact CE2-CH2 4.42Å; F204-W209 AromaticContact CE2-CZ2 3.93Å; F204-W209 HydrophobicContact CE2-CZ2 3.93Å; F204-W209 HydrophobicContact CG-CE3 4.19Å; F204-W209 HydrophobicContact CG-CH2 4.23Å; F204-W209 HydrophobicContact CG-CZ3 4.06Å
205	E	47.3	Very low	73.1	Confident	83 Å²	83	53.2 Å²	53.2	39%	0.388	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	140.5	-176.9	-150.7	-150.9	133.6	0	0	109.9	M207 T208 Q210	E205-M207 PolarHBondContact O-N 3.01Å; E205-M207 VanDerWaalsContact O-N 3.12Å; E205-T208 PolarHBondContact N-O 2.76Å; E205-T208 WeakPolarHBondContact O-CA 3.24Å; E205-T208 PolarHBondContact O-N 2.99Å; E205-T208 VanDerWaalsContact O-O 3.07Å; E205-T208 PolarHBondContact O-OG1 3.26Å; E205-Q210 HydrophobicContact CB-CG 3.97Å
206	Q	47.8	Very low	73	Confident	161 Å²	161	56.7 Å²	56.7	75%	0.752	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	35.4	177	-54	175.6	38.1	0	0	113.6	T208	Q206-T208 VanDerWaalsContact C-N 3.26Å; Q206-T208 PolarHBondContact O-N 2.76Å
207	M	46.7	Very low	72.8	Confident	77 Å²	77	55.1 Å²	55.1	38%	0.379	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	20.5	-173.4	-55	-58.3	178.8	0	0	115.6	F204 E205 T355	F204-M207 HydrophobicContact CE1-SD 3.77Å; F204-M207 HydrophobicContact CZ-CB 4.32Å; F204-M207 HydrophobicContact CZ-SD 3.83Å; E205-M207 PolarHBondContact O-N 3.01Å; E205-M207 VanDerWaalsContact O-N 3.12Å; M207-T355 HydrophobicContact CE-CG2 4.14Å
208	T	52.8	Low	72.8	Confident	74 Å²	74	55 Å²	55	45%	0.454	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.4	178.4	63.7	0	0	0	0	112	F204 E205 Q206 Q210	F204-T208 WeakPolarHBondContact CA-O 3.48Å; F204-T208 WeakPolarHBondContact CD2-O 3.48Å; E205-T208 PolarHBondContact N-O 2.76Å; E205-T208 WeakPolarHBondContact O-CA 3.24Å; E205-T208 PolarHBondContact O-N 2.99Å; E205-T208 VanDerWaalsContact O-O 3.07Å; E205-T208 PolarHBondContact O-OG1 3.26Å; Q206-T208 VanDerWaalsContact C-N 3.26Å; Q206-T208 PolarHBondContact O-N 2.76Å; T208-Q210 PolarHBondContact O-N 3.1Å; T208-Q210 PolarHBondContact OG1-NE2 2.79Å; T208-Q210 VanDerWaalsContact OG1-NE2 3.1Å
209	W	63.5	Low	72.7	Confident	100 Å²	100	57.5 Å²	57.5	38%	0.379	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	113.7	177.4	-63.9	104.2	0	0	0	110.3	P182 L201 F204 R211	P182-W209 HydrophobicContact CB-CD2 3.72Å; P182-W209 HydrophobicContact CB-CE3 4.16Å; P182-W209 HydrophobicContact CB-CG 3.93Å; P182-W209 HydrophobicContact CB-CZ2 4.43Å; P182-W209 HydrophobicContact CG-CD2 3.83Å; P182-W209 VanDerWaalsContact CG-CE2 3.48Å; P182-W209 HydrophobicContact CG-CE3 4.2Å; P182-W209 HydrophobicContact CG-CG 4.44Å; P182-W209 HydrophobicContact CG-CH2 3.98Å; P182-W209 HydrophobicContact CG-CZ2 3.6Å; P182-W209 HydrophobicContact CG-CZ3 4.26Å; L201-W209 HydrophobicContact CD1-CB 4.08Å; L201-W209 HydrophobicContact CD1-CE3 3.99Å; L201-W209 HydrophobicContact CD2-CE3 4.27Å; L201-W209 HydrophobicContact CD2-CZ3 4.46Å; F204-W209 HydrophobicContact CB-CE3 3.91Å; F204-W209 HydrophobicContact CB-CH2 4.36Å; F204-W209 HydrophobicContact CB-CZ3 3.76Å; F204-W209 AromaticContact CD2-CD2 3.57Å; F204-W209 HydrophobicContact CD2-CD2 3.57Å; F204-W209 AromaticContact CD2-CE2 3.64Å; F204-W209 AromaticContact CD2-CE3 3.66Å; F204-W209 HydrophobicContact CD2-CE3 3.66Å; F204-W209 HydrophobicContact CD2-CG 4.17Å; F204-W209 AromaticContact CD2-CH2 3.91Å; F204-W209 HydrophobicContact CD2-CH2 3.91Å; F204-W209 AromaticContact CD2-CZ2 3.81Å; F204-W209 HydrophobicContact CD2-CZ2 3.81Å; F204-W209 AromaticContact CD2-CZ3 3.85Å; F204-W209 HydrophobicContact CD2-CZ3 3.85Å; F204-W209 HydrophobicContact CE2-CD2 4.15Å; F204-W209 AromaticContact CE2-CE2 3.79Å; F204-W209 HydrophobicContact CE2-CH2 4.42Å; F204-W209 AromaticContact CE2-CZ2 3.93Å; F204-W209 HydrophobicContact CE2-CZ2 3.93Å; F204-W209 HydrophobicContact CG-CE3 4.19Å; F204-W209 HydrophobicContact CG-CH2 4.23Å; F204-W209 HydrophobicContact CG-CZ3 4.06Å; W209-R211 PolarHBondContact O-N 2.79Å
210	Q	67.4	Low	72.8	Confident	73 Å²	73	57.9 Å²	57.9	34%	0.341	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	121.4	175.5	-60.2	-54.5	-36.4	0	0	108.6	M202 G203 E205 T208	M202-Q210 HydrophobicContact CB-CB 3.87Å; M202-Q210 WeakPolarHBondContact CB-O 3.46Å; M202-Q210 PolarHBondContact N-O 3.36Å; G203-Q210 PolarHBondContact N-O 2.86Å; G203-Q210 PolarHBondContact O-N 2.87Å; E205-Q210 HydrophobicContact CB-CG 3.97Å; T208-Q210 PolarHBondContact O-N 3.1Å; T208-Q210 PolarHBondContact OG1-NE2 2.79Å; T208-Q210 VanDerWaalsContact OG1-NE2 3.1Å
211	R	80.8	Confident	72.7	Confident	131 Å²	131	58.9 Å²	58.9	49%	0.494	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.2	175.8	-71.4	-171.7	177.2	-85.1	9.1	110.3	S183 T200 L201 W209	S183-R211 PolarHBondContact O-NH1 2.98Å; S183-R211 PolarHBondContact O-NH2 3.42Å; T200-R211 VanDerWaalsContact O-CA 3.27Å; T200-R211 WeakPolarHBondContact O-CA 3.33Å; T200-R211 PolarHBondContact OG1-NH1 2.92Å; L201-R211 HydrophobicContact CD1-CG 4.45Å; W209-R211 PolarHBondContact O-N 2.79Å
212	G	83.6	Confident	72.6	Confident	13 Å²	13	65.3 Å²	65.3	13%	0.134	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.8	151.6	-177.6	0	0	0	0	0	109.8	T200 D233	T200-G212 CarbonylContact C-O 3.54Å; T200-G212 WeakPolarHBondContact CA-O 3.27Å; T200-G212 PolarHBondContact O-N 2.82Å; T200-G212 VanDerWaalsContact O-N 3.1Å; G212-D233 WeakPolarHBondContact CA-OD2 3.3Å
213	N	89.2	Confident	72.6	Confident	56 Å²	56	64.6 Å²	64.6	30%	0.299	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	112.9	-170.2	-177.4	7.5	0	0	0	110.9	H232 D233	N213-H232 HydrophobicContact CB-CB 3.93Å; N213-H232 WeakPolarHBondContact ND2-CB 3.45Å; N213-H232 WeakPolarHBondContact O-CB 3.35Å; N213-H232 PolarHBondContact O-CD2 2.85Å; N213-H232 PolarHBondContact O-N 3.32Å; N213-H232 VanDerWaalsContact O-N 3.07Å; N213-H232 PolarHBondContact OD1-CD2 2.91Å; N213-D233 WeakPolarHBondContact CB-OD1 3.49Å; N213-D233 PolarHBondContact N-OD2 3Å
214	R	85.1	Confident	73.4	Confident	30 Å²	30	64 Å²	64	11%	0.113	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142	-179.3	-55.9	-70.7	152.5	169.6	-20.2	112	D198 T199 M202 F216 E229 V230 D231	D198-R214 VanDerWaalsContact CA-O 3.28Å; D198-R214 WeakPolarHBondContact CA-O 3.14Å; T199-R214 HydrophobicContact CG2-CB 3.88Å; T199-R214 PolarHBondContact N-O 2.92Å; T199-R214 PolarHBondContact O-N 2.97Å; T199-R214 VanDerWaalsContact O-N 3.14Å; M202-R214 HydrophobicContact CE-CG 3.84Å; M202-R214 HydrophobicContact SD-CG 3.28Å; M202-R214 WeakPolarHBondContact SD-CG 3.41Å; M202-R214 PolarHBondContact SD-NE 2.98Å; R214-F216 HydrophobicContact CB-CE2 4.16Å; R214-E229 IonicContact NH1-OE1 3.65Å; R214-V230 WeakPolarHBondContact CA-O 3.4Å; R214-D231 IonicContact CZ-OD1 3.13Å; R214-D231 IonicContact CZ-OD2 2.93Å; R214-D231 IonicContact NH1-OD1 3.56Å; R214-D231 IonicContact NH1-OD2 2.79Å; R214-D231 PolarHBondContact NH1-OD2 2.83Å; R214-D231 IonicContact NH2-OD1 3.18Å; R214-D231 PolarHBondContact NH2-OD1 3.08Å; R214-D231 VanDerWaalsContact NH2-OD1 3.11Å; R214-D231 IonicContact NH2-OD2 3.75Å; R214-D231 PolarHBondContact NH2-OD2 3.39Å
215	S	89.9	Confident	74.9	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.2	158.2	-54.4	0	0	0	0	109.8	R196 D198 V230 H232	R196-S215 PolarHBondContact NE-OG 2.93Å; R196-S215 PolarHBondContact NH2-OG 3.23Å; D198-S215 WeakPolarHBondContact OD1-CB 3.21Å; D198-S215 PolarHBondContact OD1-OG 2.98Å; S215-V230 PolarHBondContact N-O 3.01Å; S215-V230 PolarHBondContact O-N 2.94Å; S215-H232 PolarHBondContact OG-NE2 3.28Å
216	F	87	Confident	76.7	Confident	78 Å²	78	59.7 Å²	59.7	34%	0.342	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	117.8	165.4	-64.6	-85.7	0	0	0	108.2	R196 V197 T199 R214 E229	R196-F216 CarbonylContact C-O 3.49Å; R196-F216 WeakPolarHBondContact CA-O 3.29Å; V197-F216 PolarHBondContact N-O 3.01Å; V197-F216 PolarHBondContact O-N 3.35Å; T199-F216 HydrophobicContact CG2-CD2 4.22Å; T199-F216 HydrophobicContact CG2-CE2 3.8Å; R214-F216 HydrophobicContact CB-CE2 4.16Å; F216-E229 HydrophobicContact CD1-CB 4.17Å; F216-E229 HydrophobicContact CD1-CG 4Å; F216-E229 HydrophobicContact CE1-CB 4.18Å; F216-E229 HydrophobicContact CE1-CG 3.65Å; F216-E229 WeakPolarHBondContact CE1-OE2 3.41Å; F216-E229 HydrophobicContact CZ-CG 4.24Å
217	I	88.8	Confident	78.4	Confident	4 Å²	4	53.9 Å²	53.9	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	125.5	-175.5	-51.7	179.9	0	0	0	109.1	R196 R219 M228 V230 F559	R196-I217 HydrophobicContact CB-CG1 4.37Å; R196-I217 HydrophobicContact CG-CG1 4.01Å; I217-R219 HydrophobicContact CG2-CG 4.29Å; I217-M228 HydrophobicContact CB-CB 4.29Å; I217-M228 HydrophobicContact CB-CE 4.18Å; I217-M228 HydrophobicContact CG2-CE 3.9Å; I217-M228 PolarHBondContact N-O 3.46Å; I217-M228 PolarHBondContact O-N 2.71Å; I217-V230 HydrophobicContact CD1-CG2 3.87Å; I217-V230 HydrophobicContact CG1-CG2 4.34Å; I217-F559 HydrophobicContact CG2-CB 4.14Å; I217-F559 WeakPolarHBondContact CG2-O 3.44Å
218	F	87.5	Confident	80.3	Confident	11 Å²	11	50.5 Å²	50.5	5%	0.048	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.1	173.2	176.7	-84	0	0	0	109	L153 L156 C194 L195 A225 E226 V227 L456	L153-F218 HydrophobicContact CD2-CE1 3.59Å; L153-F218 HydrophobicContact CD2-CZ 3.69Å; L156-F218 HydrophobicContact CD1-CD1 4.21Å; L156-F218 HydrophobicContact CD1-CE1 3.77Å; C194-F218 CarbonylContact C-O 3.24Å; C194-F218 VanDerWaalsContact CA-O 3.28Å; C194-F218 WeakPolarHBondContact CA-O 3.41Å; L195-F218 HydrophobicContact CB-CB 4.31Å; L195-F218 PolarHBondContact N-O 3.26Å; L195-F218 PolarHBondContact O-N 3.44Å; F218-A225 HydrophobicContact CE1-CB 4.38Å; F218-A225 HydrophobicContact CE2-CB 3.64Å; F218-A225 HydrophobicContact CZ-CB 3.53Å; F218-E226 CarbonylContact C-O 3.58Å; F218-E226 WeakPolarHBondContact CA-O 3.5Å; F218-V227 HydrophobicContact CD2-CG2 4.03Å; F218-V227 HydrophobicContact CE2-CG2 4.44Å; F218-L456 HydrophobicContact CB-CD2 3.99Å; F218-L456 HydrophobicContact CD1-CD2 3.84Å; F218-L456 HydrophobicContact CD2-CD1 3.56Å; F218-L456 HydrophobicContact CD2-CD2 3.77Å; F218-L456 HydrophobicContact CD2-CG 4.31Å; F218-L456 HydrophobicContact CE1-CD2 4.23Å; F218-L456 HydrophobicContact CE2-CD1 3.47Å; F218-L456 VanDerWaalsContact CE2-CD1 3.47Å; F218-L456 HydrophobicContact CE2-CD2 4.17Å; F218-L456 HydrophobicContact CG-CD1 4.27Å; F218-L456 HydrophobicContact CG-CD2 3.59Å; F218-L456 HydrophobicContact CZ-CD1 4.11Å; F218-L456 HydrophobicContact CZ-CD2 4.38Å
219	R	88.4	Confident	81.9	Confident	65 Å²	65	48 Å²	48	25%	0.245	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	118.7	175.1	-60.4	177.7	77.7	153.3	6.6	110.3	I217 A225 E226 M228 F559 E560	I217-R219 HydrophobicContact CG2-CG 4.29Å; R219-A225 CarbonylContact O-C 3.55Å; R219-A225 VanDerWaalsContact O-CA 3.28Å; R219-A225 WeakPolarHBondContact O-CA 3.22Å; R219-E226 HydrophobicContact CB-CB 4.4Å; R219-E226 PolarHBondContact N-O 3.32Å; R219-E226 PolarHBondContact O-N 3.43Å; R219-M228 HydrophobicContact CG-CE 4.04Å; R219-F559 WeakPolarHBondContact CD-O 3.49Å; R219-F559 HydrophobicContact CG-CB 4.46Å; R219-E560 IonicContact CZ-OE1 3.43Å; R219-E560 IonicContact NH1-OE1 2.79Å; R219-E560 PolarHBondContact NH1-OE1 2.97Å; R219-E560 IonicContact NH2-OE1 2.71Å; R219-E560 PolarHBondContact NH2-OE1 3.17Å
220	G	84.8	Confident	83.2	Confident	14 Å²	14	43.3 Å²	43.3	14%	0.144	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	148	166.7	0	0	0	0	0	113.2	L153 Q193	L153-G220 VanDerWaalsContact CD2-CA 3.45Å; Q193-G220 PolarHBondContact O-N 2.83Å
221	Q	80.7	Confident	84.3	Confident	70 Å²	70	40.2 Å²	40.2	33%	0.327	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	162.8	172.1	-58.8	170.5	2.3	0	0	107.9	S223 S224 E226	Q221-S223 PolarHBondContact O-N 2.85Å; Q221-S224 CarbonylContact C-O 3.57Å; Q221-S224 WeakPolarHBondContact CA-O 3.27Å; Q221-S224 WeakPolarHBondContact CB-O 3.21Å; Q221-S224 PolarHBondContact N-O 3.47Å; Q221-S224 PolarHBondContact O-N 3.16Å; Q221-S224 PolarHBondContact OE1-OG 3.2Å; Q221-E226 PolarHBondContact NE2-OE1 3.36Å; Q221-E226 PolarHBondContact NE2-OE2 3.48Å
222	D	71.4	Confident	84.8	Confident	172 Å²	172	35.1 Å²	35.1	92%	0.92	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22	-172.5	-61.8	-57.8	0	0	0	115.4
223	S	69.4	Low	85.1	Confident	63 Å²	63	39 Å²	39	44%	0.441	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.9	15.4	179.6	61.4	0	0	0	0	114.4	Q221 V244	Q221-S223 PolarHBondContact O-N 2.85Å; S223-V244 VanDerWaalsContact O-CB 3.24Å; S223-V244 WeakPolarHBondContact O-CB 3.36Å; S223-V244 WeakPolarHBondContact O-CG2 3.44Å; S223-V244 PolarHBondContact O-N 2.68Å
224	S	77.8	Confident	85.2	Confident	14 Å²	14	44.8 Å²	44.8	10%	0.098	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	159.6	-170.6	21.4	0	0	0	0	111	Q221 L242	Q221-S224 CarbonylContact C-O 3.57Å; Q221-S224 WeakPolarHBondContact CA-O 3.27Å; Q221-S224 WeakPolarHBondContact CB-O 3.21Å; Q221-S224 PolarHBondContact N-O 3.47Å; Q221-S224 PolarHBondContact O-N 3.16Å; Q221-S224 PolarHBondContact OE1-OG 3.2Å; S224-L242 WeakPolarHBondContact CA-O 3.34Å
225	A	82.9	Confident	85.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	141.8	162.4	0	0	0	0	0	109.9	I149 F218 R219 L242	I149-A225 HydrophobicContact CG2-CB 3.96Å; F218-A225 HydrophobicContact CE1-CB 4.38Å; F218-A225 HydrophobicContact CE2-CB 3.64Å; F218-A225 HydrophobicContact CZ-CB 3.53Å; R219-A225 CarbonylContact O-C 3.55Å; R219-A225 VanDerWaalsContact O-CA 3.28Å; R219-A225 WeakPolarHBondContact O-CA 3.22Å; A225-L242 PolarHBondContact N-O 3.09Å; A225-L242 WeakPolarHBondContact O-CB 3.12Å; A225-L242 PolarHBondContact O-N 2.81Å
226	E	85.2	Confident	85.7	Confident	47 Å²	47	50.2 Å²	50.2	22%	0.22	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.2	172.5	-71.6	167.7	178.9	0	0	109.2	F218 R219 Q221 T241	F218-E226 CarbonylContact C-O 3.58Å; F218-E226 WeakPolarHBondContact CA-O 3.5Å; R219-E226 HydrophobicContact CB-CB 4.4Å; R219-E226 PolarHBondContact N-O 3.32Å; R219-E226 PolarHBondContact O-N 3.43Å; Q221-E226 PolarHBondContact NE2-OE1 3.36Å; Q221-E226 PolarHBondContact NE2-OE2 3.48Å; E226-T241 HydrophobicContact CG-CG2 4.18Å
227	V	83.6	Confident	85.9	Confident	39 Å²	39	46.5 Å²	46.5	24%	0.236	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.5	171.9	-169	0	0	0	0	107.9	F218 E240 L242	F218-V227 HydrophobicContact CD2-CG2 4.03Å; F218-V227 HydrophobicContact CE2-CG2 4.44Å; V227-E240 HydrophobicContact CB-CB 4.46Å; V227-E240 PolarHBondContact N-O 3.16Å; V227-E240 PolarHBondContact O-N 3.48Å; V227-L242 HydrophobicContact CG2-CD1 3.55Å; V227-L242 HydrophobicContact CG2-CG 4.22Å
228	M	86.1	Confident	85.7	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.034	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	137.7	177.7	-67.5	177.7	-75	0	0	110.4	I217 R219 V237 F238 C239 P561	I217-M228 HydrophobicContact CB-CB 4.29Å; I217-M228 HydrophobicContact CB-CE 4.18Å; I217-M228 HydrophobicContact CG2-CE 3.9Å; I217-M228 PolarHBondContact N-O 3.46Å; I217-M228 PolarHBondContact O-N 2.71Å; R219-M228 HydrophobicContact CG-CE 4.04Å; M228-V237 HydrophobicContact CB-CG1 4.12Å; M228-V237 HydrophobicContact CG-CG1 4.17Å; M228-V237 HydrophobicContact SD-CG1 4.25Å; M228-F238 CarbonylContact C-O 3.42Å; M228-F238 VanDerWaalsContact CA-O 3.25Å; M228-F238 WeakPolarHBondContact CA-O 3.26Å; M228-C239 HydrophobicContact CG-CB 4.09Å; M228-P561 HydrophobicContact SD-CG 4.17Å
229	E	86.8	Confident	85.6	Confident	22 Å²	22	48.3 Å²	48.3	10%	0.103	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.9	163.2	-179	-170.3	118.2	0	0	108.3	R214 F216 V237 F238 R573	R214-E229 IonicContact NH1-OE1 3.65Å; F216-E229 HydrophobicContact CD1-CB 4.17Å; F216-E229 HydrophobicContact CD1-CG 4Å; F216-E229 HydrophobicContact CE1-CB 4.18Å; F216-E229 HydrophobicContact CE1-CG 3.65Å; F216-E229 WeakPolarHBondContact CE1-OE2 3.41Å; F216-E229 HydrophobicContact CZ-CG 4.24Å; E229-V237 CarbonylContact O-C 3.46Å; E229-V237 WeakPolarHBondContact O-CA 3.32Å; E229-F238 HydrophobicContact CB-CB 4.47Å; E229-F238 PolarHBondContact N-O 2.94Å; E229-F238 PolarHBondContact O-N 2.9Å; E229-R573 VanDerWaalsContact CD-NH2 3.28Å; E229-R573 IonicContact OE1-CZ 3.49Å; E229-R573 IonicContact OE1-NH1 3.79Å; E229-R573 PolarHBondContact OE1-NH1 3.36Å; E229-R573 IonicContact OE1-NH2 3.56Å; E229-R573 PolarHBondContact OE1-NH2 2.61Å; E229-R573 IonicContact OE2-CZ 3.95Å; E229-R573 IonicContact OE2-NE 2.98Å; E229-R573 IonicContact OE2-NH1 2.73Å; E229-R573 PolarHBondContact OE2-NH1 3.25Å; E229-R573 IonicContact OE2-NH2 3.55Å; E229-R573 PolarHBondContact OE2-NH2 3.34Å
230	V	90	Very high	85.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	117.9	-178.4	-173.2	0	0	0	0	109.1	R214 S215 I217 H232 V237 P561 Y565	R214-V230 WeakPolarHBondContact CA-O 3.4Å; S215-V230 PolarHBondContact N-O 3.01Å; S215-V230 PolarHBondContact O-N 2.94Å; I217-V230 HydrophobicContact CD1-CG2 3.87Å; I217-V230 HydrophobicContact CG1-CG2 4.34Å; V230-H232 WeakPolarHBondContact CG1-CE1 3.36Å; V230-V237 HydrophobicContact CG1-CG2 4.21Å; V230-V237 HydrophobicContact CG2-CG1 4.38Å; V230-V237 HydrophobicContact CG2-CG2 4.27Å; V230-P561 HydrophobicContact CG2-CB 4.44Å; V230-Y565 HydrophobicContact CG1-CD2 3.7Å; V230-Y565 HydrophobicContact CG1-CE2 3.51Å
231	D	90.4	Very high	85.1	Confident	9 Å²	9	49.8 Å²	49.8	5%	0.048	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	99.9	170.6	-170.7	-34.3	0	0	0	108.2	R214 D233 R234 Q235 L236	R214-D231 IonicContact CZ-OD1 3.13Å; R214-D231 IonicContact CZ-OD2 2.93Å; R214-D231 IonicContact NH1-OD1 3.56Å; R214-D231 IonicContact NH1-OD2 2.79Å; R214-D231 PolarHBondContact NH1-OD2 2.83Å; R214-D231 IonicContact NH2-OD1 3.18Å; R214-D231 PolarHBondContact NH2-OD1 3.08Å; R214-D231 VanDerWaalsContact NH2-OD1 3.11Å; R214-D231 IonicContact NH2-OD2 3.75Å; R214-D231 PolarHBondContact NH2-OD2 3.39Å; D231-D233 PolarHBondContact OD1-N 3.01Å; D231-R234 WeakPolarHBondContact OD1-CB 3.42Å; D231-R234 WeakPolarHBondContact OD1-CG 3.19Å; D231-R234 PolarHBondContact OD1-N 3.22Å; D231-R234 WeakPolarHBondContact OD2-CD 3.24Å; D231-Q235 CarbonylContact O-C 3.56Å; D231-Q235 WeakPolarHBondContact O-CA 3.43Å; D231-Q235 PolarHBondContact O-N 2.58Å; D231-L236 HydrophobicContact CB-CB 4.03Å; D231-L236 WeakPolarHBondContact CB-O 3.43Å; D231-L236 PolarHBondContact N-O 2.83Å; D231-L236 PolarHBondContact O-N 3.45Å; D231-L236 VanDerWaalsContact O-N 3.08Å
232	H	92.2	Very high	84.9	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.111	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-28.4	-177.8	-68.2	-70.3	0	0	0	112.9	N213 S215 V230 Y565	N213-H232 HydrophobicContact CB-CB 3.93Å; N213-H232 WeakPolarHBondContact ND2-CB 3.45Å; N213-H232 WeakPolarHBondContact O-CB 3.35Å; N213-H232 PolarHBondContact O-CD2 2.85Å; N213-H232 PolarHBondContact O-N 3.32Å; N213-H232 VanDerWaalsContact O-N 3.07Å; N213-H232 PolarHBondContact OD1-CD2 2.91Å; S215-H232 PolarHBondContact OG-NE2 3.28Å; V230-H232 WeakPolarHBondContact CG1-CE1 3.36Å; H232-Y565 AromaticContact ND1-CE2 3.5Å; H232-Y565 WeakPolarHBondContact ND1-CE2 3.36Å; H232-Y565 AromaticContact ND1-CZ 3.61Å; H232-Y565 PolarHBondContact ND1-OH 3.1Å
233	D	90.6	Very high	84.9	Confident	95 Å²	95	41.4 Å²	41.4	51%	0.508	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-34.7	-178.1	-50.5	-45.9	0	0	0	111.4	G212 N213 D231	G212-D233 WeakPolarHBondContact CA-OD2 3.3Å; N213-D233 WeakPolarHBondContact CB-OD1 3.49Å; N213-D233 PolarHBondContact N-OD2 3Å; D231-D233 PolarHBondContact OD1-N 3.01Å
234	R	91	Very high	84.6	Confident	176 Å²	176	40.1 Å²	40.1	66%	0.664	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-3.5	178.5	-55.9	176.6	63.2	-161.5	2.3	113.9	D231 L236	D231-R234 WeakPolarHBondContact OD1-CB 3.42Å; D231-R234 WeakPolarHBondContact OD1-CG 3.19Å; D231-R234 PolarHBondContact OD1-N 3.22Å; D231-R234 WeakPolarHBondContact OD2-CD 3.24Å; R234-L236 VanDerWaalsContact C-N 3.3Å; R234-L236 HydrophobicContact CB-CD1 3.98Å; R234-L236 HydrophobicContact CB-CG 3.92Å; R234-L236 PolarHBondContact O-N 2.76Å
235	Q	94	Very high	83.7	Confident	109 Å²	109	43.2 Å²	43.2	51%	0.509	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	41.3	-176.4	-55.6	-175.3	-10.6	0	0	113.3	D231 Y565 T566	D231-Q235 CarbonylContact O-C 3.56Å; D231-Q235 WeakPolarHBondContact O-CA 3.43Å; D231-Q235 PolarHBondContact O-N 2.58Å; Q235-Y565 HydrophobicContact CB-CD1 3.81Å; Q235-Y565 HydrophobicContact CB-CD2 4.27Å; Q235-Y565 HydrophobicContact CB-CE1 3.94Å; Q235-Y565 HydrophobicContact CB-CE2 4.41Å; Q235-Y565 HydrophobicContact CB-CG 3.98Å; Q235-Y565 HydrophobicContact CG-CD1 4.11Å; Q235-Y565 HydrophobicContact CG-CE1 3.74Å; Q235-Y565 CarbonylContact O-C 3.56Å; Q235-Y565 WeakPolarHBondContact O-CA 3.41Å; Q235-Y565 WeakPolarHBondContact O-CB 3.33Å; Q235-T566 PolarHBondContact O-N 2.96Å
236	L	91.6	Very high	82.3	Confident	36 Å²	36	46 Å²	46	19%	0.188	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.2	178.8	-54.7	176.3	0	0	0	110.3	D231 R234 T566 L568	D231-L236 HydrophobicContact CB-CB 4.03Å; D231-L236 WeakPolarHBondContact CB-O 3.43Å; D231-L236 PolarHBondContact N-O 2.83Å; D231-L236 PolarHBondContact O-N 3.45Å; D231-L236 VanDerWaalsContact O-N 3.08Å; R234-L236 VanDerWaalsContact C-N 3.3Å; R234-L236 HydrophobicContact CB-CD1 3.98Å; R234-L236 HydrophobicContact CB-CG 3.92Å; R234-L236 PolarHBondContact O-N 2.76Å; L236-T566 WeakPolarHBondContact CA-O 3.32Å; L236-T566 HydrophobicContact CD2-CG2 4.49Å; L236-L568 HydrophobicContact CB-CD1 4.32Å; L236-L568 HydrophobicContact CD1-CD1 4.26Å
237	V	90.1	Very high	80.6	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	110.7	173	-178.5	0	0	0	0	108.5	M228 E229 V230 P561 Y565 T566 M567 L568	M228-V237 HydrophobicContact CB-CG1 4.12Å; M228-V237 HydrophobicContact CG-CG1 4.17Å; M228-V237 HydrophobicContact SD-CG1 4.25Å; E229-V237 CarbonylContact O-C 3.46Å; E229-V237 WeakPolarHBondContact O-CA 3.32Å; V230-V237 HydrophobicContact CG1-CG2 4.21Å; V230-V237 HydrophobicContact CG2-CG1 4.38Å; V230-V237 HydrophobicContact CG2-CG2 4.27Å; V237-P561 HydrophobicContact CG1-CB 4.29Å; V237-P561 HydrophobicContact CG2-CB 3.63Å; V237-Y565 HydrophobicContact CG2-CD2 4Å; V237-Y565 HydrophobicContact CG2-CG 4.44Å; V237-T566 PolarHBondContact N-O 2.77Å; V237-M567 HydrophobicContact CB-CE 4.18Å; V237-M567 HydrophobicContact CB-SD 3.59Å; V237-M567 VanDerWaalsContact CB-SD 3.59Å; V237-M567 HydrophobicContact CG1-CE 3.71Å; V237-M567 HydrophobicContact CG1-SD 3.73Å; V237-M567 HydrophobicContact CG2-SD 4.08Å; V237-M567 CarbonylContact O-C 3.6Å; V237-M567 WeakPolarHBondContact O-CA 2.99Å; V237-L568 PolarHBondContact O-N 2.93Å
238	F	85.2	Confident	78.8	Confident	28 Å²	28	49.2 Å²	49.2	12%	0.123	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	129.8	167.6	179.6	-96	0	0	0	109	M228 E229 E240 R573	M228-F238 CarbonylContact C-O 3.42Å; M228-F238 VanDerWaalsContact CA-O 3.25Å; M228-F238 WeakPolarHBondContact CA-O 3.26Å; E229-F238 HydrophobicContact CB-CB 4.47Å; E229-F238 PolarHBondContact N-O 2.94Å; E229-F238 PolarHBondContact O-N 2.9Å; F238-E240 HydrophobicContact CE1-CB 4.12Å; F238-R573 HydrophobicContact CD2-CB 4.44Å; F238-R573 HydrophobicContact CE1-CB 4.19Å; F238-R573 HydrophobicContact CE2-CB 3.61Å; F238-R573 HydrophobicContact CE2-CG 4.35Å; F238-R573 HydrophobicContact CZ-CB 3.46Å; F238-R573 VanDerWaalsContact CZ-CB 3.46Å; F238-R573 HydrophobicContact CZ-CG 4.22Å
239	C	85.4	Confident	76.8	Confident	24 Å²	24	51.4 Å²	51.4	16%	0.162	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	131.1	179.3	-172	0	0	0	0	112.6	M228 M567 L568 G570	M228-C239 HydrophobicContact CG-CB 4.09Å; C239-M567 HydrophobicContact CB-CE 3.86Å; C239-L568 PolarHBondContact N-O 2.86Å; C239-G570 PolarHBondContact O-N 3.23Å
240	E	80.1	Confident	74.7	Confident	32 Å²	32	52.1 Å²	52.1	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	106.7	177.9	-177.3	-179.1	-157.4	0	0	109.6	R145 V227 F238 L242 R577	R145-E240 IonicContact CZ-OE1 3.93Å; R145-E240 IonicContact CZ-OE2 2.64Å; R145-E240 IonicContact NH1-OE1 3.81Å; R145-E240 PolarHBondContact NH1-OE1 2.78Å; R145-E240 IonicContact NH1-OE2 3.7Å; R145-E240 PolarHBondContact NH1-OE2 2.88Å; R145-E240 VanDerWaalsContact NH2-CD 3.31Å; R145-E240 IonicContact NH2-OE1 2.9Å; R145-E240 PolarHBondContact NH2-OE1 2.73Å; R145-E240 IonicContact NH2-OE2 3.28Å; R145-E240 PolarHBondContact NH2-OE2 3.16Å; V227-E240 HydrophobicContact CB-CB 4.46Å; V227-E240 PolarHBondContact N-O 3.16Å; V227-E240 PolarHBondContact O-N 3.48Å; F238-E240 HydrophobicContact CE1-CB 4.12Å; E240-L242 HydrophobicContact CG-CD2 3.91Å; E240-R577 IonicContact OE1-CZ 2.72Å; E240-R577 IonicContact OE1-NH1 2.81Å; E240-R577 IonicContact OE1-NH2 3.33Å; E240-R577 PolarHBondContact OE1-NH2 3.35Å; E240-R577 IonicContact OE2-CZ 2.96Å; E240-R577 IonicContact OE2-NH1 3.82Å; E240-R577 PolarHBondContact OE2-NH1 3.2Å; E240-R577 IonicContact OE2-NH2 2.71Å; E240-R577 PolarHBondContact OE2-NH2 2.78Å
241	T	81.8	Confident	72	Confident	79 Å²	79	56 Å²	56	49%	0.485	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	122	176.2	-45.3	0	0	0	0	110.9	E226	E226-T241 HydrophobicContact CG-CG2 4.18Å
242	L	77.3	Confident	69.6	Low	13 Å²	13	61.6 Å²	61.6	7%	0.068	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	94.8	-178.2	-55	175.8	0	0	0	109.9	L146 I149 S224 A225 V227 E240	L146-L242 HydrophobicContact CD2-CB 4.14Å; L146-L242 HydrophobicContact CD2-CD2 4.07Å; I149-L242 HydrophobicContact CD1-CB 3.51Å; I149-L242 HydrophobicContact CD1-CD1 3.63Å; I149-L242 HydrophobicContact CD1-CG 4.15Å; S224-L242 WeakPolarHBondContact CA-O 3.34Å; A225-L242 PolarHBondContact N-O 3.09Å; A225-L242 WeakPolarHBondContact O-CB 3.12Å; A225-L242 PolarHBondContact O-N 2.81Å; V227-L242 HydrophobicContact CG2-CD1 3.55Å; V227-L242 HydrophobicContact CG2-CG 4.22Å; E240-L242 HydrophobicContact CG-CD2 3.91Å
243	C	71.8	Confident	66.9	Low	53 Å²	53	63.3 Å²	63.3	36%	0.358	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.5	-177.7	-59	0	0	0	0	112.3	S245 S246	C243-S245 PolarHBondContact O-N 3.17Å; C243-S246 WeakPolarHBondContact O-CB 3.43Å; C243-S246 PolarHBondContact O-N 3.05Å; C243-S246 PolarHBondContact O-OG 3.31Å
244	V	63	Low	64.7	Low	36 Å²	36	69.1 Å²	69.1	22%	0.218	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-63.8	-31.1	174.2	177.9	0	0	0	0	110.8	I149 P150 S223 S246 L247	I149-V244 HydrophobicContact CG2-CG2 4.49Å; P150-V244 HydrophobicContact CG-CG1 3.73Å; P150-V244 HydrophobicContact CG-CG2 4.01Å; S223-V244 VanDerWaalsContact O-CB 3.24Å; S223-V244 WeakPolarHBondContact O-CB 3.36Å; S223-V244 WeakPolarHBondContact O-CG2 3.44Å; S223-V244 PolarHBondContact O-N 2.68Å; V244-S246 PolarHBondContact O-N 3.12Å; V244-L247 HydrophobicContact CG1-CD1 4.15Å; V244-L247 VanDerWaalsContact O-CB 3.28Å; V244-L247 WeakPolarHBondContact O-CB 3.33Å; V244-L247 PolarHBondContact O-N 3.12Å
245	S	57.8	Low	61.9	Low	79 Å²	79	63.8 Å²	63.8	55%	0.552	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-56.2	-20.7	175.7	-49.5	0	0	0	0	114.7	C243 L247 T248	C243-S245 PolarHBondContact O-N 3.17Å; S245-L247 PolarHBondContact O-N 3.45Å; S245-T248 PolarHBondContact O-OG1 2.88Å; S245-T248 VanDerWaalsContact O-OG1 3.08Å
246	S	53.8	Low	58.9	Low	58 Å²	58	68.2 Å²	68.2	41%	0.406	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-70.1	-19.8	174.4	-58.5	0	0	0	0	113	C243 V244	C243-S246 WeakPolarHBondContact O-CB 3.43Å; C243-S246 PolarHBondContact O-N 3.05Å; C243-S246 PolarHBondContact O-OG 3.31Å; V244-S246 PolarHBondContact O-N 3.12Å
247	L	49.2	Very low	56.1	Low	31 Å²	31	72.1 Å²	72.1	16%	0.162	45%	0.448	C	S	.	.	S	Bend	trans	-80	-28.9	-175.5	-66.9	166.3	0	0	0	114.1	L146 A147 P150 V244 S245 A249 L250 S251	L146-L247 HydrophobicContact CB-CD2 3.71Å; L146-L247 HydrophobicContact CB-CG 4.28Å; L146-L247 WeakPolarHBondContact O-CD1 3.41Å; A147-L247 HydrophobicContact CB-CD2 4.01Å; P150-L247 HydrophobicContact CG-CD1 4.38Å; V244-L247 HydrophobicContact CG1-CD1 4.15Å; V244-L247 VanDerWaalsContact O-CB 3.28Å; V244-L247 WeakPolarHBondContact O-CB 3.33Å; V244-L247 PolarHBondContact O-N 3.12Å; S245-L247 PolarHBondContact O-N 3.45Å; L247-A249 PolarHBondContact O-N 2.91Å; L247-A249 VanDerWaalsContact O-N 3.15Å; L247-L250 HydrophobicContact CD2-CD1 4.39Å; L247-L250 CarbonylContact O-C 3.6Å; L247-L250 PolarHBondContact O-N 3.3Å; L247-S251 PolarHBondContact O-N 3.39Å
248	T	46.2	Very low	53.1	Low	123 Å²	123	75.1 Å²	75.1	76%	0.755	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.9	177.6	56.2	0	0	0	0	112	S245	S245-T248 PolarHBondContact O-OG1 2.88Å; S245-T248 VanDerWaalsContact O-OG1 3.08Å
249	A	45.3	Very low	50.5	Low	52 Å²	52	79.2 Å²	79.2	43%	0.43	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	1.7	173.3	0	0	0	0	0	114.4	L247 A265	L247-A249 PolarHBondContact O-N 2.91Å; L247-A249 VanDerWaalsContact O-N 3.15Å; A249-A265 HydrophobicContact CB-CB 3.38Å
250	L	42.1	Very low	47.6	Very low	37 Å²	37	83.2 Å²	83.2	19%	0.194	55%	0.545	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-9.8	172.7	-70	170.4	0	0	0	113	Y139 L146 L247 L269	Y139-L250 HydrophobicContact CE2-CD2 4.19Å; L146-L250 HydrophobicContact CD1-CD1 4.44Å; L247-L250 HydrophobicContact CD2-CD1 4.39Å; L247-L250 CarbonylContact O-C 3.6Å; L247-L250 PolarHBondContact O-N 3.3Å; L250-L269 HydrophobicContact CD1-CD2 4.26Å
251	S	34.2	Very low	45.3	Very low	81 Å²	81	91.9 Å²	91.9	57%	0.566	58%	0.582	S	S	*	*	S	Bend	trans	-64.2	128.2	176	-172	0	0	0	0	111.1	L247 G253	L247-S251 PolarHBondContact O-N 3.39Å; S251-G253 PolarHBondContact O-N 3.29Å
252	P	40	Very low	42.9	Very low	128 Å²	128	90.8 Å²	90.8	83%	0.831	59%	0.587	S	S	*	*			trans	-74.9	69.1	171.4	32.2	-34.6	0	0	0	110	R254	P252-R254 PolarHBondContact O-N 3.41Å; P252-R254 VanDerWaalsContact O-N 3.08Å
253	G	33.7	Very low	40.8	Very low	60 Å²	60	95.2 Å²	95.2	62%	0.619	61%	0.614	S	S	*	*			trans	-66.5	105.2	-176.4	0	0	0	0	0	112.3	S251 G255	S251-G253 PolarHBondContact O-N 3.29Å; G253-G255 VanDerWaalsContact C-N 3.33Å; G253-G255 PolarHBondContact O-N 2.98Å
254	R	45.3	Very low	39	Very low	216 Å²	216	98 Å²	98	82%	0.815	63%	0.633	S	S	*	*			trans	-54.8	94.8	161.3	-91.4	179.8	147.6	157.3	-3.7	109.3	E70 P252	E70-R254 IonicContact OE2-CZ 2.68Å; E70-R254 IonicContact OE2-NE 2.75Å; E70-R254 PolarHBondContact OE2-NE 3.46Å; E70-R254 IonicContact OE2-NH2 2.78Å; E70-R254 PolarHBondContact OE2-NH2 3.41Å; P252-R254 PolarHBondContact O-N 3.41Å; P252-R254 VanDerWaalsContact O-N 3.08Å
255	G	32.8	Very low	37.8	Very low	64 Å²	64	98.3 Å²	98.3	66%	0.66	64%	0.64	S	S	*	*			trans	-161.3	66	-163.8	0	0	0	0	0	115	G253	G253-G255 VanDerWaalsContact C-N 3.33Å; G253-G255 PolarHBondContact O-N 2.98Å
256	K	30	Very low	36.9	Very low	203 Å²	203	95.1 Å²	95.1	88%	0.883	62%	0.62	S	S	*	*			trans	59.6	109.7	170.3	-63.6	-179.6	177	178.2	0	116	G258	K256-G258 PolarHBondContact O-N 3.26Å; K256-G258 VanDerWaalsContact O-N 3.08Å
257	A	32.4	Very low	36.7	Very low	117 Å²	117	97.8 Å²	97.8	97%	0.967	63%	0.629	S	S	*	*			trans	-57.9	113	164.8	0	0	0	0	0	110.5
258	G	27.2	Very low	36.7	Very low	64 Å²	64	98.4 Å²	98.4	66%	0.66	64%	0.643	S	S	*	*			trans	-153.6	43.7	-166.2	0	0	0	0	0	114.2	K256 C260	K256-G258 PolarHBondContact O-N 3.26Å; K256-G258 VanDerWaalsContact O-N 3.08Å; G258-C260 PolarHBondContact O-N 3.39Å
259	A	31.7	Very low	37.3	Very low	113 Å²	113	94.5 Å²	94.5	93%	0.934	62%	0.617	S	S	*	*			trans	48.1	56.9	163.9	0	0	0	0	0	117.6
260	C	24.2	Very low	37.9	Very low	109 Å²	109	93.2 Å²	93.2	74%	0.736	60%	0.602	S	S	*	*			trans	-114.3	129.3	162.8	58	0	0	0	0	111.3	G258	G258-C260 PolarHBondContact O-N 3.39Å
261	K	32.3	Very low	38.4	Very low	213 Å²	213	93.2 Å²	93.2	93%	0.926	61%	0.612	S	S	*	*			trans	-77.9	122.4	172.9	-76.1	179.1	174.6	177.7	0	109.5
262	G	31.8	Very low	39.5	Very low	57 Å²	57	93.3 Å²	93.3	59%	0.588	62%	0.618	S	S	*	*			trans	61.5	97.3	161.9	0	0	0	0	0	115.8	C264	G262-C264 PolarHBondContact O-N 2.91Å; G262-C264 VanDerWaalsContact O-N 3.1Å
263	T	32.5	Very low	40.6	Very low	105 Å²	105	88.2 Å²	88.2	64%	0.644	58%	0.584	S	S	*	*			trans	-62.9	109.9	168.2	38.7	0	0	0	0	110.4	A265	T263-A265 VanDerWaalsContact C-N 3.3Å; T263-A265 PolarHBondContact O-N 2.81Å
264	C	34	Very low	42.3	Very low	112 Å²	112	90.8 Å²	90.8	76%	0.757	58%	0.58	S	S	*	*	H	α-helix	trans	-66.2	-23.2	-167.2	52.4	0	0	0	0	115.1	G262 G268	G262-C264 PolarHBondContact O-N 2.91Å; G262-C264 VanDerWaalsContact O-N 3.1Å; C264-G268 PolarHBondContact O-N 3.27Å
265	A	37	Very low	44	Very low	42 Å²	42	81 Å²	81	35%	0.347	54%	0.544	S	S	.	.	H	α-helix	trans	-73.9	-50.3	-176.6	0	0	0	0	0	113.8	A249 T263 L267 G268 L269	A249-A265 HydrophobicContact CB-CB 3.38Å; T263-A265 VanDerWaalsContact C-N 3.3Å; T263-A265 PolarHBondContact O-N 2.81Å; A265-L267 VanDerWaalsContact C-N 3.3Å; A265-L267 PolarHBondContact O-N 2.71Å; A265-G268 WeakPolarHBondContact O-CA 3.42Å; A265-G268 PolarHBondContact O-N 3.23Å; A265-L269 PolarHBondContact O-N 2.66Å; A265-L269 VanDerWaalsContact O-N 3.17Å
266	G	39.7	Very low	46.3	Very low	13 Å²	13	80.4 Å²	80.4	13%	0.134	53%	0.53	C	S	.	.	H	α-helix	trans	-62.7	-38.3	177.4	0	0	0	0	0	112.3	G268 L269 L270	G266-G268 VanDerWaalsContact C-N 3.28Å; G266-G268 PolarHBondContact O-N 3.23Å; G266-L269 PolarHBondContact O-N 3.33Å; G266-L270 VanDerWaalsContact O-CB 3.32Å; G266-L270 WeakPolarHBondContact O-CB 3.25Å; G266-L270 PolarHBondContact O-N 2.87Å
267	L	48.5	Very low	48.9	Very low	114 Å²	114	75.9 Å²	75.9	60%	0.597	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-28.2	170.5	-102.6	132	0	0	0	113.4	A265 G271	A265-L267 VanDerWaalsContact C-N 3.3Å; A265-L267 PolarHBondContact O-N 2.71Å; L267-G271 VanDerWaalsContact O-CA 3.32Å; L267-G271 WeakPolarHBondContact O-CA 3.25Å; L267-G271 PolarHBondContact O-N 3.3Å
268	G	50.5	Low	51.3	Low	44 Å²	44	78 Å²	78	45%	0.454	51%	0.505	S	S	.	.	H	α-helix	trans	-67.2	-50.4	174	0	0	0	0	0	112.2	C264 A265 G266 G271 A272	C264-G268 PolarHBondContact O-N 3.27Å; A265-G268 WeakPolarHBondContact O-CA 3.42Å; A265-G268 PolarHBondContact O-N 3.23Å; G266-G268 VanDerWaalsContact C-N 3.28Å; G266-G268 PolarHBondContact O-N 3.23Å; G268-G271 PolarHBondContact O-N 3.44Å; G268-A272 PolarHBondContact O-N 2.99Å
269	L	58.4	Low	53.9	Low	41 Å²	41	77 Å²	77	22%	0.215	48%	0.484	C	S	.	.	H	α-helix	trans	-65.9	-50.4	178.5	-176.3	63.6	0	0	0	111.6	Y139 T142 L250 A265 G266 G271 A272 T273	Y139-L269 HydrophobicContact CD2-CB 4.14Å; Y139-L269 HydrophobicContact CD2-CD2 3.86Å; Y139-L269 HydrophobicContact CD2-CG 3.9Å; Y139-L269 HydrophobicContact CE2-CB 4.17Å; Y139-L269 HydrophobicContact CE2-CD2 3.96Å; Y139-L269 HydrophobicContact CE2-CG 4.27Å; T142-L269 HydrophobicContact CG2-CD1 3.87Å; T142-L269 HydrophobicContact CG2-CD2 4.13Å; L250-L269 HydrophobicContact CD1-CD2 4.26Å; A265-L269 PolarHBondContact O-N 2.66Å; A265-L269 VanDerWaalsContact O-N 3.17Å; G266-L269 PolarHBondContact O-N 3.33Å; L269-G271 PolarHBondContact O-N 3.31Å; L269-A272 PolarHBondContact O-N 3.47Å; L269-A272 VanDerWaalsContact O-N 3.16Å; L269-T273 PolarHBondContact O-N 2.9Å; L269-T273 VanDerWaalsContact O-N 3.17Å; L269-T273 PolarHBondContact O-OG1 3.33Å
270	L	57.6	Low	56.5	Low	24 Å²	24	71.8 Å²	71.8	13%	0.126	44%	0.44	C	S	.	.	H	α-helix	trans	-63.3	-22	175.5	-173.8	66	0	0	0	112.1	R135 Y136 Y139 G266	R135-L270 HydrophobicContact CG-CD1 3.82Å; R135-L270 PolarHBondContact NE-O 2.87Å; R135-L270 PolarHBondContact NH2-O 3.3Å; Y136-L270 HydrophobicContact CD1-CD1 4.34Å; Y136-L270 HydrophobicContact CD2-CD1 4.34Å; Y136-L270 HydrophobicContact CE1-CD1 4.31Å; Y136-L270 HydrophobicContact CE1-CD2 4.11Å; Y136-L270 HydrophobicContact CE2-CD1 4.3Å; Y136-L270 HydrophobicContact CE2-CD2 4.38Å; Y136-L270 HydrophobicContact CG-CD1 4.38Å; Y139-L270 HydrophobicContact CD1-CD1 4.43Å; Y139-L270 HydrophobicContact CD2-CB 3.76Å; Y139-L270 HydrophobicContact CD2-CD1 4.25Å; Y139-L270 HydrophobicContact CE2-CB 4.21Å; Y139-L270 HydrophobicContact CG-CB 4.25Å; Y139-L270 HydrophobicContact CG-CD1 3.85Å; G266-L270 VanDerWaalsContact O-CB 3.32Å; G266-L270 WeakPolarHBondContact O-CB 3.25Å; G266-L270 PolarHBondContact O-N 2.87Å
271	G	53.6	Low	59.4	Low	38 Å²	38	69.1 Å²	69.1	39%	0.392	43%	0.426	S	S	.	.	H	α-helix	trans	-80.8	-32.5	175.6	0	0	0	0	0	113.8	L267 G268 L269	L267-G271 VanDerWaalsContact O-CA 3.32Å; L267-G271 WeakPolarHBondContact O-CA 3.25Å; L267-G271 PolarHBondContact O-N 3.3Å; G268-G271 PolarHBondContact O-N 3.44Å; L269-G271 PolarHBondContact O-N 3.31Å
272	A	56.4	Low	61.7	Low	83 Å²	83	61.1 Å²	61.1	69%	0.686	40%	0.399	S	S	*	.	H	α-helix	trans	-73.2	-38.2	174.6	0	0	0	0	0	112.1	G268 L269 Q274	G268-A272 PolarHBondContact O-N 2.99Å; L269-A272 PolarHBondContact O-N 3.47Å; L269-A272 VanDerWaalsContact O-N 3.16Å; A272-Q274 PolarHBondContact O-N 3Å; A272-Q274 VanDerWaalsContact O-N 3.15Å
273	T	62.9	Low	64.2	Low	21 Å²	21	60.3 Å²	60.3	13%	0.129	38%	0.379	C	S	.	.			trans	-79.7	91.6	175.7	58.3	0	0	0	0	110.8	R135 D138 L269	R135-T273 WeakPolarHBondContact CD-O 3.21Å; R135-T273 VanDerWaalsContact CG-O 3.28Å; R135-T273 WeakPolarHBondContact CG-O 3.41Å; R135-T273 PolarHBondContact NE-O 3.27Å; D138-T273 HydrophobicContact CB-CG2 4.11Å; L269-T273 PolarHBondContact O-N 2.9Å; L269-T273 VanDerWaalsContact O-N 3.17Å; L269-T273 PolarHBondContact O-OG1 3.33Å
274	Q	69.9	Low	66.8	Low	113 Å²	113	57.2 Å²	57.2	53%	0.528	36%	0.358	S	S	.	.			trans	-124.5	111.6	169.6	-75.9	-107.9	89.7	0	0	108.9	R135 A272	R135-Q274 VanDerWaalsContact CZ-OE1 3.28Å; A272-Q274 PolarHBondContact O-N 3Å; A272-Q274 VanDerWaalsContact O-N 3.15Å
275	P	80.1	Confident	69.2	Low	11 Å²	11	54.3 Å²	54.3	7%	0.071	34%	0.339	C	S	.	.			trans	-67.7	141.3	178	28.8	-34.6	0	0	0	110.5	R131 L134	R131-P275 HydrophobicContact CG-CG 4.06Å; L134-P275 HydrophobicContact CB-CB 4.34Å; L134-P275 HydrophobicContact CB-CG 3.98Å; L134-P275 HydrophobicContact CD1-CB 4.3Å; L134-P275 HydrophobicContact CD1-CG 4.47Å
276	S	82.8	Confident	71.2	Confident	51 Å²	51	54.4 Å²	54.4	36%	0.357	34%	0.34	S	S	.	.			trans	-70.1	157.5	177.8	77.7	0	0	0	0	111.6	E278 Q279 V280	S276-E278 PolarHBondContact O-N 3.02Å; S276-E278 PolarHBondContact OG-N 2.72Å; S276-Q279 PolarHBondContact O-N 3.11Å; S276-Q279 WeakPolarHBondContact OG-CG 3.2Å; S276-Q279 PolarHBondContact OG-N 2.85Å; S276-Q279 PolarHBondContact OG-OE1 3.49Å; S276-V280 WeakPolarHBondContact O-CG2 3.33Å; S276-V280 PolarHBondContact O-N 3.28Å; S276-V280 VanDerWaalsContact O-N 3.14Å
277	D	84.1	Confident	73.1	Confident	109 Å²	109	55 Å²	55	58%	0.583	34%	0.341	S	S	*	.	H	α-helix	trans	-59.7	-28.2	172.9	-65.9	-34.3	0	0	0	111.6	R131 A281	R131-D277 IonicContact CZ-OD1 3.32Å; R131-D277 IonicContact NH1-OD1 3.58Å; R131-D277 PolarHBondContact NH1-OD1 3.25Å; R131-D277 IonicContact NH2-OD1 2.78Å; R131-D277 PolarHBondContact NH2-OD1 2.81Å; D277-A281 VanDerWaalsContact O-CB 3.22Å; D277-A281 WeakPolarHBondContact O-CB 3.22Å; D277-A281 PolarHBondContact O-N 3Å
278	E	82.7	Confident	74.7	Confident	160 Å²	160	50.3 Å²	50.3	75%	0.748	32%	0.317	S	S	*	.	H	α-helix	trans	-72.6	-43.3	176.7	-173.6	162.3	-147.7	0	0	112.4	S276 V280 A281 A282	S276-E278 PolarHBondContact O-N 3.02Å; S276-E278 PolarHBondContact OG-N 2.72Å; E278-V280 VanDerWaalsContact C-N 3.3Å; E278-V280 PolarHBondContact O-N 3.19Å; E278-A281 PolarHBondContact O-N 2.97Å; E278-A282 VanDerWaalsContact O-CB 3.31Å; E278-A282 WeakPolarHBondContact O-CB 3.36Å; E278-A282 PolarHBondContact O-N 3.32Å
279	Q	80.8	Confident	75.8	Confident	44 Å²	44	49.3 Å²	49.3	21%	0.206	30%	0.302	C	S	.	.	H	α-helix	trans	-60.2	-40.5	172.9	-73.5	167.7	-67	0	0	111.4	S276 R283 E578	S276-Q279 PolarHBondContact O-N 3.11Å; S276-Q279 WeakPolarHBondContact OG-CG 3.2Å; S276-Q279 PolarHBondContact OG-N 2.85Å; S276-Q279 PolarHBondContact OG-OE1 3.49Å; Q279-R283 WeakPolarHBondContact O-CG 3.29Å; Q279-R283 PolarHBondContact O-N 3.34Å; Q279-E578 PolarHBondContact NE2-OE2 2.95Å
280	V	87.1	Confident	76.6	Confident	4 Å²	4	48 Å²	48	2%	0.024	30%	0.296	C	S	.	.	H	α-helix	trans	-66.9	-45.6	175.3	176.2	0	0	0	0	110.9	P127 V130 R131 L134 S276 E278 R283 L284	P127-V280 HydrophobicContact CB-CG1 3.86Å; V130-V280 HydrophobicContact CB-CG1 4.39Å; V130-V280 HydrophobicContact CG1-CG1 4.09Å; R131-V280 HydrophobicContact CB-CG2 4.16Å; L134-V280 HydrophobicContact CD1-CG2 4.07Å; S276-V280 WeakPolarHBondContact O-CG2 3.33Å; S276-V280 PolarHBondContact O-N 3.28Å; S276-V280 VanDerWaalsContact O-N 3.14Å; E278-V280 VanDerWaalsContact C-N 3.3Å; E278-V280 PolarHBondContact O-N 3.19Å; V280-R283 PolarHBondContact O-N 3.41Å; V280-L284 HydrophobicContact CG1-CD1 3.93Å; V280-L284 WeakPolarHBondContact O-CB 3.19Å; V280-L284 WeakPolarHBondContact O-CG 3.35Å; V280-L284 PolarHBondContact O-N 2.82Å
281	A	85.1	Confident	77.1	Confident	53 Å²	53	47.3 Å²	47.3	44%	0.438	29%	0.293	S	S	.	.	H	α-helix	trans	-66	-37.5	179.1	0	0	0	0	0	113.1	D277 E278 L284 S285	D277-A281 VanDerWaalsContact O-CB 3.22Å; D277-A281 WeakPolarHBondContact O-CB 3.22Å; D277-A281 PolarHBondContact O-N 3Å; E278-A281 PolarHBondContact O-N 2.97Å; A281-L284 PolarHBondContact O-N 2.85Å; A281-S285 WeakPolarHBondContact O-CB 3.36Å; A281-S285 PolarHBondContact O-N 3.45Å; A281-S285 PolarHBondContact O-OG 3.38Å
282	A	80.9	Confident	77.9	Confident	44 Å²	44	48.3 Å²	48.3	36%	0.364	29%	0.287	S	S	.	.	H	α-helix	trans	-60.1	-51.2	174.3	0	0	0	0	0	110.8	E278 L284 S285 A286	E278-A282 VanDerWaalsContact O-CB 3.31Å; E278-A282 WeakPolarHBondContact O-CB 3.36Å; E278-A282 PolarHBondContact O-N 3.32Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 PolarHBondContact O-N 3.04Å; A282-S285 PolarHBondContact O-N 3.44Å; A282-S285 PolarHBondContact O-OG 2.88Å; A282-A286 WeakPolarHBondContact O-CB 3.48Å; A282-A286 PolarHBondContact O-N 2.86Å
283	R	83.6	Confident	78.7	Confident	41 Å²	41	47.3 Å²	47.3	16%	0.155	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-30.1	179.1	-64.4	-72.6	169.1	58.1	-14.1	113.3	V122 Q279 V280 E578 D582	V122-R283 VanDerWaalsContact CG1-O 3.3Å; V122-R283 WeakPolarHBondContact CG1-O 3.45Å; V122-R283 HydrophobicContact CG2-CB 4.39Å; Q279-R283 WeakPolarHBondContact O-CG 3.29Å; Q279-R283 PolarHBondContact O-N 3.34Å; V280-R283 PolarHBondContact O-N 3.41Å; R283-E578 IonicContact CZ-OE1 3.03Å; R283-E578 VanDerWaalsContact CZ-OE1 3.28Å; R283-E578 VanDerWaalsContact NH1-CD 3.34Å; R283-E578 IonicContact NH1-OE1 2.85Å; R283-E578 PolarHBondContact NH1-OE1 3.14Å; R283-E578 IonicContact NH1-OE2 2.89Å; R283-E578 VanDerWaalsContact NH2-CD 3.28Å; R283-E578 VanDerWaalsContact NH2-CG 3.27Å; R283-E578 IonicContact NH2-OE1 3.23Å; R283-E578 PolarHBondContact NH2-OE1 3.47Å; R283-D582 IonicContact CZ-OD1 2.61Å; R283-D582 IonicContact CZ-OD2 3.21Å; R283-D582 IonicContact NE-OD1 2.68Å; R283-D582 IonicContact NE-OD2 2.84Å; R283-D582 PolarHBondContact NE-OD2 3.13Å; R283-D582 IonicContact NH2-OD1 3.6Å; R283-D582 PolarHBondContact NH2-OD1 3.48Å; R283-D582 IonicContact NH2-OD2 3.45Å; R283-D582 PolarHBondContact NH2-OD2 2.96Å
284	L	86.8	Confident	79.2	Confident	40 Å²	40	47.7 Å²	47.7	21%	0.209	27%	0.271	C	S	.	.	H	α-helix	trans	-77.4	-15.5	172.7	-73.6	172.9	0	0	0	114.3	V122 P127 V130 V280 A281 A282	V122-L284 HydrophobicContact CG1-CD2 4.48Å; P127-L284 HydrophobicContact CB-CD1 3.9Å; V130-L284 HydrophobicContact CG2-CD2 4.23Å; V280-L284 HydrophobicContact CG1-CD1 3.93Å; V280-L284 WeakPolarHBondContact O-CB 3.19Å; V280-L284 WeakPolarHBondContact O-CG 3.35Å; V280-L284 PolarHBondContact O-N 2.82Å; A281-L284 PolarHBondContact O-N 2.85Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 PolarHBondContact O-N 3.04Å
285	S	84	Confident	79.3	Confident	50 Å²	50	45 Å²	45	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-110.3	-16.7	-178.5	58.2	0	0	0	0	114.8	A281 A282 L342 N346	A281-S285 WeakPolarHBondContact O-CB 3.36Å; A281-S285 PolarHBondContact O-N 3.45Å; A281-S285 PolarHBondContact O-OG 3.38Å; A282-S285 PolarHBondContact O-N 3.44Å; A282-S285 PolarHBondContact O-OG 2.88Å; S285-L342 VanDerWaalsContact C-CD2 3.5Å; S285-L342 VanDerWaalsContact O-CD2 3.23Å; S285-L342 WeakPolarHBondContact O-CD2 3.46Å; S285-N346 WeakPolarHBondContact CB-ND2 3.21Å
286	A	79.9	Confident	78.9	Confident	45 Å²	45	55 Å²	55	37%	0.372	30%	0.299	S	S	.	.	S	Bend	trans	-89.4	149.9	170.6	0	0	0	0	0	112.2	A282 H341	A282-A286 WeakPolarHBondContact O-CB 3.48Å; A282-A286 PolarHBondContact O-N 2.86Å; A286-H341 PolarHBondContact O-CE1 3.35Å; A286-H341 PolarHBondContact O-NE2 2.98Å
287	P	79.4	Confident	78.6	Confident	25 Å²	25	56.9 Å²	56.9	16%	0.162	31%	0.305	C	S	.	.			trans	-65	147.6	172.8	29.5	-35.9	0	0	0	111.4	V289 T337 T339 L342 T350	P287-V289 HydrophobicContact CB-CG2 4.39Å; P287-V289 HydrophobicContact CG-CG2 4.31Å; P287-V289 PolarHBondContact O-N 2.86Å; P287-T337 HydrophobicContact CB-CG2 4.03Å; P287-T339 HydrophobicContact CB-CG2 4.27Å; P287-L342 HydrophobicContact CB-CD1 4.11Å; P287-T350 HydrophobicContact CG-CG2 4.33Å
288	V	81.9	Confident	78.5	Confident	16 Å²	16	52.9 Å²	52.9	10%	0.097	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	110.7	175.9	169.1	0	0	0	0	108.3	W115 Q119 V122 T337 R338	W115-V288 HydrophobicContact CZ3-CG1 4.09Å; Q119-V288 HydrophobicContact CB-CG1 3.93Å; Q119-V288 HydrophobicContact CG-CG1 3.79Å; V122-V288 HydrophobicContact CB-CG2 3.98Å; V122-V288 HydrophobicContact CG1-CG2 3.48Å; V122-V288 VanDerWaalsContact CG1-CG2 3.48Å; V288-T337 WeakPolarHBondContact O-CA 3.35Å; V288-R338 HydrophobicContact CB-CB 4.13Å; V288-R338 PolarHBondContact N-O 3.42Å; V288-R338 PolarHBondContact O-N 2.97Å
289	V	74.9	Confident	78.6	Confident	22 Å²	22	47 Å²	47	13%	0.133	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	135.6	-176.4	-175.2	0	0	0	0	110.4	P287 T335 R336 T337	P287-V289 HydrophobicContact CB-CG2 4.39Å; P287-V289 HydrophobicContact CG-CG2 4.31Å; P287-V289 PolarHBondContact O-N 2.86Å; V289-T335 HydrophobicContact CG1-CG2 3.89Å; V289-R336 CarbonylContact C-O 3.58Å; V289-R336 WeakPolarHBondContact CA-O 3.48Å; V289-T337 HydrophobicContact CG2-CG2 4.07Å
290	T	73.9	Confident	79	Confident	14 Å²	14	47.4 Å²	47.4	9%	0.086	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	128	167.5	47	0	0	0	0	110.6	W115 T335 R336	W115-T290 HydrophobicContact CE3-CG2 4.12Å; W115-T290 WeakPolarHBondContact CH2-OG1 3.44Å; W115-T290 HydrophobicContact CZ3-CG2 3.71Å; W115-T290 WeakPolarHBondContact CZ3-OG1 3.42Å; T290-T335 CarbonylContact O-C 3.5Å; T290-T335 WeakPolarHBondContact O-CA 3.26Å; T290-R336 PolarHBondContact N-O 3.36Å; T290-R336 PolarHBondContact O-N 2.63Å
291	T	69.3	Low	79.1	Confident	10 Å²	10	52.6 Å²	52.6	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	109.7	174.6	-63.4	0	0	0	0	109.2	L333 I334 T335 K466 L592	T291-L333 HydrophobicContact CG2-CD1 3.63Å; T291-L333 HydrophobicContact CG2-CD2 4.24Å; T291-L333 HydrophobicContact CG2-CG 3.86Å; T291-I334 WeakPolarHBondContact CA-O 3.34Å; T291-T335 WeakPolarHBondContact CG2-OG1 3.46Å; T291-T335 PolarHBondContact OG1-OG1 3.12Å; T291-K466 PolarHBondContact O-NZ 2.93Å; T291-L592 HydrophobicContact CG2-CD1 3.66Å
292	Q	69.3	Low	79.4	Confident	59 Å²	59	52.6 Å²	52.6	28%	0.276	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	140.4	-178.4	-68.9	177.5	-22.8	0	0	110.2	E110 I334	E110-Q292 PolarHBondContact OE1-NE2 2.75Å; E110-Q292 VanDerWaalsContact OE1-NE2 3.11Å; Q292-I334 PolarHBondContact N-O 2.83Å; Q292-I334 PolarHBondContact O-N 2.8Å
293	L	72.7	Confident	79.7	Confident	61 Å²	61	52.8 Å²	52.8	32%	0.319	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	119.8	171.2	-172.9	71.9	0	0	0	108	T295 V331 L333 F432 F470	L293-T295 HydrophobicContact CD2-CG2 4.13Å; L293-T295 HydrophobicContact CG-CG2 4.25Å; L293-T295 PolarHBondContact O-N 2.95Å; L293-V331 HydrophobicContact CD1-CG1 3.6Å; L293-L333 HydrophobicContact CB-CD1 4.46Å; L293-L333 HydrophobicContact CD1-CD1 4.16Å; L293-F432 HydrophobicContact CD1-CZ 4.49Å; L293-F470 HydrophobicContact CD2-CD2 3.91Å
294	D	73.9	Confident	79.8	Confident	30 Å²	30	57.2 Å²	57.2	16%	0.16	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	108.6	171.6	-171.8	6.7	0	0	0	109.6	R296 N297 E332 I334	D294-R296 VanDerWaalsContact OD1-CB 3.24Å; D294-R296 WeakPolarHBondContact OD1-CB 3.25Å; D294-R296 WeakPolarHBondContact OD1-CD 3.47Å; D294-R296 WeakPolarHBondContact OD1-CG 3.31Å; D294-R296 PolarHBondContact OD1-N 3.13Å; D294-N297 PolarHBondContact OD2-ND2 3.05Å; D294-E332 HydrophobicContact CB-CB 4.25Å; D294-E332 PolarHBondContact N-O 3.09Å; D294-I334 HydrophobicContact CB-CD1 4.17Å
295	T	71.6	Confident	79.4	Confident	56 Å²	56	58.2 Å²	58.2	34%	0.344	30%	0.299	S	S	.	.			trans	-91.2	-8.1	-178.1	61.1	0	0	0	0	113.2	L293 N297 L473	L293-T295 HydrophobicContact CD2-CG2 4.13Å; L293-T295 HydrophobicContact CG-CG2 4.25Å; L293-T295 PolarHBondContact O-N 2.95Å; T295-N297 PolarHBondContact O-N 3.24Å; T295-L473 HydrophobicContact CG2-CD1 3.66Å; T295-L473 HydrophobicContact CG2-CD2 3.88Å; T295-L473 HydrophobicContact CG2-CG 4.31Å
296	R	72.2	Confident	78.8	Confident	220 Å²	220	58.5 Å²	58.5	83%	0.83	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-30.3	-169.6	-62.6	169.5	-177.3	-163.3	1.5	113.8	D294	D294-R296 VanDerWaalsContact OD1-CB 3.24Å; D294-R296 WeakPolarHBondContact OD1-CB 3.25Å; D294-R296 WeakPolarHBondContact OD1-CD 3.47Å; D294-R296 WeakPolarHBondContact OD1-CG 3.31Å; D294-R296 PolarHBondContact OD1-N 3.13Å
297	N	76.1	Confident	78.2	Confident	92 Å²	92	63.2 Å²	63.2	49%	0.492	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	2.2	-170.4	-61.9	-53.3	0	0	0	113.8	D294 T295 A299 N330	D294-N297 PolarHBondContact OD2-ND2 3.05Å; T295-N297 PolarHBondContact O-N 3.24Å; N297-A299 PolarHBondContact O-N 2.81Å; N297-N330 HydrophobicContact CB-CB 4.5Å; N297-N330 VanDerWaalsContact O-CB 3.32Å; N297-N330 WeakPolarHBondContact O-CB 3.47Å; N297-N330 PolarHBondContact O-ND2 3.41Å
298	I	81.9	Confident	77.2	Confident	25 Å²	25	69.5 Å²	69.5	13%	0.128	36%	0.359	C	S	.	.			trans	-64.2	123.9	-177.5	-61.2	-179.6	0	0	0	109.8	F300 A328 S329 V331 L473	I298-F300 HydrophobicContact CG2-CE1 4.08Å; I298-F300 HydrophobicContact CG2-CE2 4.13Å; I298-F300 HydrophobicContact CG2-CZ 3.76Å; I298-A328 HydrophobicContact CG2-CB 4.36Å; I298-S329 WeakPolarHBondContact CA-O 3.22Å; I298-V331 HydrophobicContact CD1-CG1 4.22Å; I298-V331 HydrophobicContact CD1-CG2 4.3Å; I298-V331 HydrophobicContact CG1-CG2 4.31Å; I298-V331 HydrophobicContact CG2-CG2 4.26Å; I298-L473 HydrophobicContact CD1-CD1 4.2Å
299	A	85.5	Confident	76.3	Confident	35 Å²	35	72.3 Å²	72.3	29%	0.289	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.1	-178.6	0	0	0	0	0	110.8	N297 A328 S329	N297-A299 PolarHBondContact O-N 2.81Å; A299-A328 WeakPolarHBondContact O-CA 3.43Å; A299-S329 PolarHBondContact N-O 2.9Å; A299-S329 PolarHBondContact O-N 2.96Å
300	F	88.4	Confident	75.8	Confident	54 Å²	54	82 Å²	82	24%	0.237	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.7	178.3	-59.3	-75.3	0	0	0	110.9	I298 Y326 A327 A328 L436 R474 L475 P476	I298-F300 HydrophobicContact CG2-CE1 4.08Å; I298-F300 HydrophobicContact CG2-CE2 4.13Å; I298-F300 HydrophobicContact CG2-CZ 3.76Å; F300-Y326 HydrophobicContact CB-CD1 4.32Å; F300-A327 WeakPolarHBondContact CA-O 3.47Å; F300-A328 HydrophobicContact CD1-CB 3.88Å; F300-A328 HydrophobicContact CE1-CB 3.73Å; F300-L436 HydrophobicContact CD1-CD1 4.04Å; F300-L436 HydrophobicContact CE1-CD1 3.68Å; F300-R474 WeakPolarHBondContact CE2-O 3.41Å; F300-L475 HydrophobicContact CE1-CD2 4.09Å; F300-L475 HydrophobicContact CZ-CD2 3.85Å; F300-P476 HydrophobicContact CB-CG 3.74Å; F300-P476 HydrophobicContact CD1-CG 4.32Å; F300-P476 HydrophobicContact CD2-CG 4.3Å; F300-P476 HydrophobicContact CG-CG 3.87Å
301	E	90.3	Very high	75.8	Confident	112 Å²	112	90.8 Å²	90.8	52%	0.523	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	139.3	179.2	-67.6	175.6	-162.6	0	0	110.4	N303 Y326 A327	E301-N303 PolarHBondContact O-N 2.71Å; E301-Y326 CarbonylContact O-C 3.56Å; E301-Y326 WeakPolarHBondContact O-CA 3.49Å; E301-A327 PolarHBondContact N-O 3.15Å; E301-A327 PolarHBondContact O-N 2.98Å
302	R	90.6	Very high	76.3	Confident	53 Å²	53	94.2 Å²	94.2	20%	0.2	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.4	170.6	-70.2	-70	-65.2	-71	0.5	109.5	E313 Y326	R302-E313 IonicContact CZ-OE1 2.73Å; R302-E313 IonicContact CZ-OE2 3.16Å; R302-E313 IonicContact NH1-OE1 2.68Å; R302-E313 PolarHBondContact NH1-OE1 3.45Å; R302-E313 IonicContact NH1-OE2 2.7Å; R302-E313 PolarHBondContact NH1-OE2 3.45Å; R302-E313 VanDerWaalsContact NH2-CB 3.33Å; R302-E313 IonicContact NH2-OE1 2.78Å; R302-E313 IonicContact NH2-OE2 3.76Å; R302-E313 PolarHBondContact NH2-OE2 3.21Å; R302-Y326 HydrophobicContact CG-CD1 4.27Å; R302-Y326 HydrophobicContact CG-CE1 3.91Å
303	N	87.4	Confident	77.2	Confident	49 Å²	49	95.9 Å²	95.9	26%	0.262	49%	0.489	S	S	.	.			trans	-62.6	146.6	169.3	-78.1	-34.1	0	0	0	109.6	E301 K314 V325	E301-N303 PolarHBondContact O-N 2.71Å; N303-K314 HydrophobicContact CB-CB 4.08Å; N303-K314 WeakPolarHBondContact O-CB 3.25Å; N303-K314 PolarHBondContact O-N 3.19Å; N303-V325 HydrophobicContact CB-CB 4.31Å; N303-V325 HydrophobicContact CB-CG1 4.41Å; N303-V325 PolarHBondContact N-O 2.9Å; N303-V325 WeakPolarHBondContact ND2-CG1 3.4Å
304	K	85.8	Confident	78	Confident	133 Å²	133	96 Å²	96	58%	0.578	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.1	-177.5	-61.5	-171.3	-178.8	-173.5	0	111.1	R311 S312	K304-R311 HydrophobicContact CB-CB 4.41Å; K304-R311 HydrophobicContact CD-CB 4.46Å; K304-S312 CarbonylContact C-O 3.54Å; K304-S312 WeakPolarHBondContact CA-O 3.32Å; K304-S312 VanDerWaalsContact CB-O 3.31Å; K304-S312 WeakPolarHBondContact CB-O 3.37Å
305	T	79.4	Confident	78.8	Confident	61 Å²	61	97.5 Å²	97.5	37%	0.374	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	147.5	-175.7	31.8	0	0	0	0	111.2	S312 K314	T305-S312 PolarHBondContact N-O 3.06Å; T305-S312 PolarHBondContact O-N 3.19Å; T305-K314 HydrophobicContact CG2-CB 4.18Å; T305-K314 HydrophobicContact CG2-CD 3.72Å; T305-K314 HydrophobicContact CG2-CG 3.78Å
306	G	69.8	Low	79.8	Confident	56 Å²	56	97.6 Å²	97.6	58%	0.577	49%	0.494	S	S	*	.			trans	136.1	165.8	179.4	0	0	0	0	0	112.9	W310	G306-W310 WeakPolarHBondContact CA-O 3.28Å
307	I	68.2	Low	80.6	Confident	144 Å²	144	92 Å²	92	74%	0.738	49%	0.485	S	S	*	.	S	Bend	trans	-113.7	141.1	-176.5	-58.7	174.8	0	0	0	108.5
308	L	57.6	Low	81.2	Confident	157 Å²	157	88.1 Å²	88.1	82%	0.822	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	39.7	87.4	177.4	-93.8	67.9	0	0	0	115.2	W310	L308-W310 VanDerWaalsContact O-CD1 3.22Å; L308-W310 PolarHBondContact O-N 3.34Å
309	G	64.1	Low	81.3	Confident	75 Å²	75	89.4 Å²	89.4	77%	0.773	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-41.8	170.8	0	0	0	0	0	115	R311	G309-R311 VanDerWaalsContact C-N 3.29Å; G309-R311 PolarHBondContact O-N 3.02Å
310	W	64.3	Low	81.1	Confident	225 Å²	225	91.2 Å²	91.2	85%	0.852	49%	0.493	S	S	*	.			trans	-75.5	72.8	-179.2	-55.6	97.3	0	0	0	112.2	G306 L308 S312	G306-W310 WeakPolarHBondContact CA-O 3.28Å; L308-W310 VanDerWaalsContact O-CD1 3.22Å; L308-W310 PolarHBondContact O-N 3.34Å; W310-S312 PolarHBondContact O-N 3.03Å
311	R	74.3	Confident	81.1	Confident	199 Å²	199	91.6 Å²	91.6	75%	0.751	49%	0.493	S	S	*	.			trans	-87.9	95.3	177.2	-70.3	-178	176.1	173.3	-0.9	111.1	K304 G309	K304-R311 HydrophobicContact CB-CB 4.41Å; K304-R311 HydrophobicContact CD-CB 4.46Å; G309-R311 VanDerWaalsContact C-N 3.29Å; G309-R311 PolarHBondContact O-N 3.02Å
312	S	80	Confident	81.2	Confident	83 Å²	83	92 Å²	92	58%	0.58	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.1	163.1	165.4	-163.5	0	0	0	0	110.9	K304 T305 W310	K304-S312 CarbonylContact C-O 3.54Å; K304-S312 WeakPolarHBondContact CA-O 3.32Å; K304-S312 VanDerWaalsContact CB-O 3.31Å; K304-S312 WeakPolarHBondContact CB-O 3.37Å; T305-S312 PolarHBondContact N-O 3.06Å; T305-S312 PolarHBondContact O-N 3.19Å; W310-S312 PolarHBondContact O-N 3.03Å
313	E	87.1	Confident	81.3	Confident	94 Å²	94	89.5 Å²	89.5	44%	0.439	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	147.8	167	-51.7	-168.4	117.5	0	0	110.4	R302	R302-E313 IonicContact CZ-OE1 2.73Å; R302-E313 IonicContact CZ-OE2 3.16Å; R302-E313 IonicContact NH1-OE1 2.68Å; R302-E313 PolarHBondContact NH1-OE1 3.45Å; R302-E313 IonicContact NH1-OE2 2.7Å; R302-E313 PolarHBondContact NH1-OE2 3.45Å; R302-E313 VanDerWaalsContact NH2-CB 3.33Å; R302-E313 IonicContact NH2-OE1 2.78Å; R302-E313 IonicContact NH2-OE2 3.76Å; R302-E313 PolarHBondContact NH2-OE2 3.21Å
314	K	89.3	Confident	81.6	Confident	64 Å²	64	90 Å²	90	28%	0.278	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-87.1	123.6	179.9	-160.9	-179.5	-161.8	-167.2	0	111.3	N303 T305 E316 V325	N303-K314 HydrophobicContact CB-CB 4.08Å; N303-K314 WeakPolarHBondContact O-CB 3.25Å; N303-K314 PolarHBondContact O-N 3.19Å; T305-K314 HydrophobicContact CG2-CB 4.18Å; T305-K314 HydrophobicContact CG2-CD 3.72Å; T305-K314 HydrophobicContact CG2-CG 3.78Å; K314-E316 HydrophobicContact CD-CG 4.46Å; K314-E316 WeakPolarHBondContact CD-OE1 3.26Å; K314-E316 WeakPolarHBondContact CE-OE1 3.49Å; K314-E316 IonicContact NZ-OE1 3.4Å; K314-E316 PolarHBondContact NZ-OE1 3.25Å; K314-V325 HydrophobicContact CB-CB 4.26Å; K314-V325 HydrophobicContact CB-CG2 4.31Å; K314-V325 HydrophobicContact CD-CB 4.37Å; K314-V325 HydrophobicContact CD-CG2 4.16Å; K314-V325 HydrophobicContact CG-CB 4.39Å; K314-V325 HydrophobicContact CG-CG2 4.02Å; K314-V325 PolarHBondContact O-N 2.84Å
315	T	90.8	Very high	82	Confident	61 Å²	61	83.8 Å²	83.8	37%	0.374	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	153.5	156.3	57.4	0	0	0	0	109.5	E322 A323 K324	T315-E322 WeakPolarHBondContact CB-OE1 3.38Å; T315-E322 HydrophobicContact CG2-CG 4.41Å; T315-E322 WeakPolarHBondContact CG2-OE1 3.45Å; T315-E322 PolarHBondContact OG1-OE1 3.35Å; T315-A323 CarbonylContact C-O 3.56Å; T315-A323 VanDerWaalsContact CA-O 3.26Å; T315-A323 WeakPolarHBondContact CA-O 3.2Å; T315-K324 HydrophobicContact CG2-CG 4.25Å
316	E	92	Very high	82.6	Confident	57 Å²	57	82 Å²	82	27%	0.266	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.7	173.6	-77.8	176.6	-144.3	0	0	108.4	K314 A323 V325 W437	K314-E316 HydrophobicContact CD-CG 4.46Å; K314-E316 WeakPolarHBondContact CD-OE1 3.26Å; K314-E316 WeakPolarHBondContact CE-OE1 3.49Å; K314-E316 IonicContact NZ-OE1 3.4Å; K314-E316 PolarHBondContact NZ-OE1 3.25Å; E316-A323 PolarHBondContact N-O 2.99Å; E316-A323 PolarHBondContact O-N 3.34Å; E316-V325 HydrophobicContact CB-CG2 3.94Å; E316-V325 HydrophobicContact CG-CG2 3.84Å; E316-W437 VanDerWaalsContact CD-NE1 3.26Å; E316-W437 PolarHBondContact OE2-NE1 3.11Å
317	T	90	Very high	83.6	Confident	104 Å²	104	80 Å²	80	64%	0.638	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	129.1	171.3	-45.9	0	0	0	0	109.9	Y321	T317-Y321 CarbonylContact C-O 3.59Å; T317-Y321 WeakPolarHBondContact CA-O 3.23Å
318	V	87.9	Confident	84.5	Confident	10 Å²	10	73.2 Å²	73.2	6%	0.061	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.1	175.9	-179.2	0	0	0	0	107.9	G320 Y321 W437 V481 K482	V318-G320 VanDerWaalsContact C-N 3.3Å; V318-G320 PolarHBondContact O-N 3.15Å; V318-Y321 PolarHBondContact N-O 2.88Å; V318-Y321 WeakPolarHBondContact O-CB 3.25Å; V318-Y321 PolarHBondContact O-N 2.74Å; V318-W437 HydrophobicContact CG2-CG 4.24Å; V318-V481 HydrophobicContact CB-CG2 4.05Å; V318-V481 HydrophobicContact CG1-CG2 4.41Å; V318-K482 HydrophobicContact CG1-CB 4.19Å; V318-K482 HydrophobicContact CG2-CB 4.41Å
319	N	83.7	Confident	85.9	Confident	52 Å²	52	65.9 Å²	65.9	28%	0.278	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	47.2	175.3	-53.5	-8.9	0	0	0	112	Y321 F497 E504	N319-Y321 VanDerWaalsContact C-N 3.26Å; N319-Y321 WeakPolarHBondContact O-CD2 3.45Å; N319-Y321 WeakPolarHBondContact O-CE2 3.19Å; N319-Y321 PolarHBondContact O-N 2.9Å; N319-F497 PolarHBondContact ND2-O 3.42Å; N319-E504 WeakPolarHBondContact CB-OE1 3.28Å
320	G	83.2	Confident	86.7	Confident	72 Å²	72	66.1 Å²	66.1	74%	0.742	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.6	-27.6	-174.1	0	0	0	0	0	115.9	V318	V318-G320 VanDerWaalsContact C-N 3.3Å; V318-G320 PolarHBondContact O-N 3.15Å
321	Y	87.9	Confident	87.4	Confident	62 Å²	62	55.6 Å²	55.6	24%	0.243	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.3	-175.3	-62	-80.6	0	0	0	112.7	T317 V318 N319 A323 P443 V481 L500	T317-Y321 CarbonylContact C-O 3.59Å; T317-Y321 WeakPolarHBondContact CA-O 3.23Å; V318-Y321 PolarHBondContact N-O 2.88Å; V318-Y321 WeakPolarHBondContact O-CB 3.25Å; V318-Y321 PolarHBondContact O-N 2.74Å; N319-Y321 VanDerWaalsContact C-N 3.26Å; N319-Y321 WeakPolarHBondContact O-CD2 3.45Å; N319-Y321 WeakPolarHBondContact O-CE2 3.19Å; N319-Y321 PolarHBondContact O-N 2.9Å; Y321-A323 PolarHBondContact O-N 3.49Å; Y321-P443 HydrophobicContact CE1-CG 4.42Å; Y321-V481 HydrophobicContact CG-CG1 4.41Å; Y321-L500 HydrophobicContact CE2-CD1 3.83Å; Y321-L500 WeakPolarHBondContact OH-CD1 3.34Å
322	E	91.4	Very high	87.6	Confident	122 Å²	122	47.4 Å²	47.4	57%	0.57	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.4	124.4	165.9	-173.6	177.2	-169.9	0	0	109.9	T315 C439	T315-E322 WeakPolarHBondContact CB-OE1 3.38Å; T315-E322 HydrophobicContact CG2-CG 4.41Å; T315-E322 WeakPolarHBondContact CG2-OE1 3.45Å; T315-E322 PolarHBondContact OG1-OE1 3.35Å; E322-C439 PolarHBondContact O-SG 2.88Å
323	A	93.3	Very high	87.2	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	137.1	-178.3	0	0	0	0	0	112.2	T315 E316 Y321 W437 L438 C439 V481	T315-A323 CarbonylContact C-O 3.56Å; T315-A323 VanDerWaalsContact CA-O 3.26Å; T315-A323 WeakPolarHBondContact CA-O 3.2Å; E316-A323 PolarHBondContact N-O 2.99Å; E316-A323 PolarHBondContact O-N 3.34Å; Y321-A323 PolarHBondContact O-N 3.49Å; A323-W437 HydrophobicContact CB-CB 3.77Å; A323-L438 CarbonylContact C-O 3.54Å; A323-L438 WeakPolarHBondContact CA-O 3.36Å; A323-C439 HydrophobicContact CB-CB 4.42Å; A323-V481 HydrophobicContact CB-CG2 3.66Å
324	K	94	Very high	86.7	Confident	60 Å²	60	41.9 Å²	41.9	26%	0.261	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	126.8	172.3	-63.9	177	-168.9	177.6	0	108.5	T315 Y326 L438 E440	T315-K324 HydrophobicContact CG2-CG 4.25Å; K324-Y326 HydrophobicContact CB-CD2 4.38Å; K324-Y326 HydrophobicContact CB-CE2 3.72Å; K324-Y326 WeakPolarHBondContact O-CD2 3.43Å; K324-L438 PolarHBondContact N-O 3.08Å; K324-L438 PolarHBondContact O-N 2.79Å; K324-E440 WeakPolarHBondContact CE-OE2 3.14Å; K324-E440 IonicContact NZ-OE1 2.68Å; K324-E440 PolarHBondContact NZ-OE1 2.94Å; K324-E440 IonicContact NZ-OE2 2.71Å; K324-E440 PolarHBondContact NZ-OE2 3.02Å
325	V	93.4	Very high	86.1	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.7	-176.6	-160.9	0	0	0	0	110.6	N303 K314 E316 L436 W437	N303-V325 HydrophobicContact CB-CB 4.31Å; N303-V325 HydrophobicContact CB-CG1 4.41Å; N303-V325 PolarHBondContact N-O 2.9Å; N303-V325 WeakPolarHBondContact ND2-CG1 3.4Å; K314-V325 HydrophobicContact CB-CB 4.26Å; K314-V325 HydrophobicContact CB-CG2 4.31Å; K314-V325 HydrophobicContact CD-CB 4.37Å; K314-V325 HydrophobicContact CD-CG2 4.16Å; K314-V325 HydrophobicContact CG-CB 4.39Å; K314-V325 HydrophobicContact CG-CG2 4.02Å; K314-V325 PolarHBondContact O-N 2.84Å; E316-V325 HydrophobicContact CB-CG2 3.94Å; E316-V325 HydrophobicContact CG-CG2 3.84Å; V325-L436 WeakPolarHBondContact CA-O 3.28Å; V325-W437 HydrophobicContact CG1-CD2 4.2Å; V325-W437 HydrophobicContact CG1-CZ2 4.08Å
326	Y	92	Very high	85.5	Confident	23 Å²	23	39.6 Å²	39.6	9%	0.09	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	151.2	176.5	-66.8	-103.2	0	0	0	111.1	F300 E301 R302 K324 K435 L436 L438 P476	F300-Y326 HydrophobicContact CB-CD1 4.32Å; E301-Y326 CarbonylContact O-C 3.56Å; E301-Y326 WeakPolarHBondContact O-CA 3.49Å; R302-Y326 HydrophobicContact CG-CD1 4.27Å; R302-Y326 HydrophobicContact CG-CE1 3.91Å; K324-Y326 HydrophobicContact CB-CD2 4.38Å; K324-Y326 HydrophobicContact CB-CE2 3.72Å; K324-Y326 WeakPolarHBondContact O-CD2 3.43Å; Y326-K435 WeakPolarHBondContact O-CA 3.46Å; Y326-L436 PolarHBondContact N-O 3.01Å; Y326-L436 PolarHBondContact O-N 3.48Å; Y326-L438 HydrophobicContact CD2-CB 4.34Å; Y326-L438 HydrophobicContact CD2-CD1 3.71Å; Y326-L438 HydrophobicContact CD2-CG 4.02Å; Y326-L438 HydrophobicContact CE2-CB 4.16Å; Y326-L438 HydrophobicContact CE2-CD1 3.75Å; Y326-L438 HydrophobicContact CE2-CG 4.22Å; Y326-L438 HydrophobicContact CG-CD1 4.38Å; Y326-P476 HydrophobicContact CD1-CB 4.31Å; Y326-P476 HydrophobicContact CD1-CG 3.76Å; Y326-P476 HydrophobicContact CE1-CB 3.64Å; Y326-P476 HydrophobicContact CE1-CG 3.58Å; Y326-P476 HydrophobicContact CE2-CB 4.19Å; Y326-P476 HydrophobicContact CE2-CG 4.47Å; Y326-P476 HydrophobicContact CG-CG 4.26Å
327	A	90.7	Very high	85	Confident	14 Å²	14	38.1 Å²	38.1	12%	0.116	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	128.3	160.8	0	0	0	0	0	109.2	F300 E301 A434	F300-A327 WeakPolarHBondContact CA-O 3.47Å; E301-A327 PolarHBondContact N-O 3.15Å; E301-A327 PolarHBondContact O-N 2.98Å; A327-A434 WeakPolarHBondContact CA-O 3.23Å
328	A	87.8	Confident	84.8	Confident	2 Å²	2	33.6 Å²	33.6	2%	0.017	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	102.6	166.9	0	0	0	0	0	108.1	I298 A299 F300 V331 K433 A434	I298-A328 HydrophobicContact CG2-CB 4.36Å; A299-A328 WeakPolarHBondContact O-CA 3.43Å; F300-A328 HydrophobicContact CD1-CB 3.88Å; F300-A328 HydrophobicContact CE1-CB 3.73Å; A328-V331 HydrophobicContact CB-CG2 4.07Å; A328-K433 VanDerWaalsContact O-CA 3.3Å; A328-K433 WeakPolarHBondContact O-CA 3.45Å; A328-A434 HydrophobicContact CB-CB 4.34Å; A328-A434 PolarHBondContact N-O 3.29Å; A328-A434 PolarHBondContact O-N 2.99Å
329	S	85.6	Confident	84.7	Confident	3 Å²	3	34.7 Å²	34.7	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	161	175.2	-70.1	0	0	0	0	111.4	I298 A299 V331 K433	I298-S329 WeakPolarHBondContact CA-O 3.22Å; A299-S329 PolarHBondContact N-O 2.9Å; A299-S329 PolarHBondContact O-N 2.96Å; S329-V331 VanDerWaalsContact C-N 3.29Å; S329-V331 PolarHBondContact O-N 3.15Å; S329-K433 WeakPolarHBondContact OG-CE 3.36Å; S329-K433 PolarHBondContact OG-NZ 2.98Å
330	N	82.4	Confident	84.7	Confident	81 Å²	81	32.6 Å²	32.6	43%	0.433	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	60.4	33.4	177.5	-45.7	-23.1	0	0	0	113.8	N297 E332	N297-N330 HydrophobicContact CB-CB 4.5Å; N297-N330 VanDerWaalsContact O-CB 3.32Å; N297-N330 WeakPolarHBondContact O-CB 3.47Å; N297-N330 PolarHBondContact O-ND2 3.41Å; N330-E332 PolarHBondContact O-N 3.19Å
331	V	77.9	Confident	84.8	Confident	4 Å²	4	29.4 Å²	29.4	2%	0.024	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	105.1	170.8	-167.8	0	0	0	0	107.4	L293 I298 A328 S329 F432	L293-V331 HydrophobicContact CD1-CG1 3.6Å; I298-V331 HydrophobicContact CD1-CG1 4.22Å; I298-V331 HydrophobicContact CD1-CG2 4.3Å; I298-V331 HydrophobicContact CG1-CG2 4.31Å; I298-V331 HydrophobicContact CG2-CG2 4.26Å; A328-V331 HydrophobicContact CB-CG2 4.07Å; S329-V331 VanDerWaalsContact C-N 3.29Å; S329-V331 PolarHBondContact O-N 3.15Å; V331-F432 HydrophobicContact CB-CD2 3.96Å; V331-F432 HydrophobicContact CB-CE1 4.48Å; V331-F432 HydrophobicContact CB-CE2 3.79Å; V331-F432 HydrophobicContact CB-CG 4.38Å; V331-F432 HydrophobicContact CB-CZ 4.08Å; V331-F432 HydrophobicContact CG1-CD2 4.13Å; V331-F432 HydrophobicContact CG1-CE1 3.94Å; V331-F432 HydrophobicContact CG1-CE2 3.45Å; V331-F432 VanDerWaalsContact CG1-CE2 3.45Å; V331-F432 HydrophobicContact CG1-CZ 3.35Å; V331-F432 HydrophobicContact CG2-CE2 4.36Å; V331-F432 PolarHBondContact N-O 2.85Å; V331-F432 PolarHBondContact O-N 2.96Å
332	E	79.1	Confident	84.7	Confident	26 Å²	26	26.7 Å²	26.7	12%	0.121	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.9	179.4	-41.6	-154.4	171.3	0	0	110.4	D294 N330 T429 Q430 R431	D294-E332 HydrophobicContact CB-CB 4.25Å; D294-E332 PolarHBondContact N-O 3.09Å; N330-E332 PolarHBondContact O-N 3.19Å; E332-T429 HydrophobicContact CB-CG2 4.14Å; E332-T429 WeakPolarHBondContact OE2-CG2 3.3Å; E332-Q430 WeakPolarHBondContact CA-O 3.49Å; E332-R431 VanDerWaalsContact CD-NE 3.25Å; E332-R431 VanDerWaalsContact CD-NH2 3.32Å; E332-R431 HydrophobicContact CG-CG 4.1Å; E332-R431 IonicContact OE1-CZ 2.81Å; E332-R431 IonicContact OE1-NE 2.91Å; E332-R431 PolarHBondContact OE1-NE 3.29Å; E332-R431 IonicContact OE1-NH2 3.31Å; E332-R431 PolarHBondContact OE1-NH2 2.61Å; E332-R431 IonicContact OE2-CZ 2.81Å; E332-R431 IonicContact OE2-NE 3.21Å; E332-R431 IonicContact OE2-NH2 3.25Å; E332-R431 PolarHBondContact OE2-NH2 2.93Å; E332-R431 VanDerWaalsContact OE2-NH2 3.13Å
333	L	71	Confident	84.2	Confident	32 Å²	32	24.5 Å²	24.5	17%	0.168	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	108.7	173.7	-168.6	66.1	0	0	0	108.2	T291 L293 T429 Q430 F432 L592	T291-L333 HydrophobicContact CG2-CD1 3.63Å; T291-L333 HydrophobicContact CG2-CD2 4.24Å; T291-L333 HydrophobicContact CG2-CG 3.86Å; L293-L333 HydrophobicContact CB-CD1 4.46Å; L293-L333 HydrophobicContact CD1-CD1 4.16Å; L333-T429 WeakPolarHBondContact O-CA 3.48Å; L333-Q430 PolarHBondContact N-O 3.08Å; L333-Q430 PolarHBondContact O-N 3.1Å; L333-F432 HydrophobicContact CB-CE1 4.19Å; L333-L592 HydrophobicContact CD2-CD1 3.83Å; L333-L592 HydrophobicContact CD2-CD2 3.53Å; L333-L592 HydrophobicContact CD2-CG 4.36Å
334	I	76.4	Confident	83.5	Confident	29 Å²	29	29.9 Å²	29.9	15%	0.149	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	108.6	-175.2	-54.2	178	0	0	0	107.9	T291 Q292 D294 R336 T427 T429	T291-I334 WeakPolarHBondContact CA-O 3.34Å; Q292-I334 PolarHBondContact N-O 2.83Å; Q292-I334 PolarHBondContact O-N 2.8Å; D294-I334 HydrophobicContact CB-CD1 4.17Å; I334-R336 HydrophobicContact CG2-CG 4.11Å; I334-T427 HydrophobicContact CG2-CG2 3.73Å; I334-T429 HydrophobicContact CG1-CG2 4.14Å
335	T	76.6	Confident	82.6	Confident	21 Å²	21	33.6 Å²	33.6	13%	0.129	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.6	172.7	-65.9	0	0	0	0	109.7	V289 T290 T291 T427 K428	V289-T335 HydrophobicContact CG1-CG2 3.89Å; T290-T335 CarbonylContact O-C 3.5Å; T290-T335 WeakPolarHBondContact O-CA 3.26Å; T291-T335 WeakPolarHBondContact CG2-OG1 3.46Å; T291-T335 PolarHBondContact OG1-OG1 3.12Å; T335-T427 CarbonylContact O-C 3.58Å; T335-T427 WeakPolarHBondContact O-CA 3.46Å; T335-K428 PolarHBondContact N-O 3.17Å; T335-K428 PolarHBondContact O-N 2.92Å
336	R	79.9	Confident	81.9	Confident	57 Å²	57	34.7 Å²	34.7	22%	0.215	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.3	-178.1	-68	173.4	-179.7	-178.1	-2.3	109.3	N113 W115 V289 T290 I334 L425 T426 T427	N113-R336 PolarHBondContact O-NH1 3.03Å; W115-R336 HydrophobicContact CH2-CB 3.65Å; W115-R336 HydrophobicContact CZ2-CB 3.93Å; V289-R336 CarbonylContact C-O 3.58Å; V289-R336 WeakPolarHBondContact CA-O 3.48Å; T290-R336 PolarHBondContact N-O 3.36Å; T290-R336 PolarHBondContact O-N 2.63Å; I334-R336 HydrophobicContact CG2-CG 4.11Å; R336-L425 HydrophobicContact CB-CD1 3.89Å; R336-L425 HydrophobicContact CG-CD1 4.42Å; R336-T426 WeakPolarHBondContact CA-O 3.49Å; R336-T427 HydrophobicContact CG-CG2 4.01Å
337	T	81.3	Confident	81	Confident	26 Å²	26	35.3 Å²	35.3	16%	0.16	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	119.8	-177	-61.5	0	0	0	0	110.2	P287 V288 V289 T339 L425 T426	P287-T337 HydrophobicContact CB-CG2 4.03Å; V288-T337 WeakPolarHBondContact O-CA 3.35Å; V289-T337 HydrophobicContact CG2-CG2 4.07Å; T337-T339 HydrophobicContact CG2-CG2 4.16Å; T337-L425 WeakPolarHBondContact O-CA 3.26Å; T337-T426 PolarHBondContact N-O 3.26Å; T337-T426 PolarHBondContact O-N 3.24Å
338	R	85.3	Confident	79.6	Confident	8 Å²	8	39.3 Å²	39.3	3%	0.03	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	134.9	173.6	-77.1	179.1	72	164	1.8	111	W115 E120 S123 V288 D340 C423 Q424 L425	W115-R338 HydrophobicContact CH2-CG 3.75Å; W115-R338 HydrophobicContact CZ2-CG 3.76Å; W115-R338 HydrophobicContact CZ3-CG 4.29Å; E120-R338 IonicContact OE1-NH1 2.77Å; E120-R338 PolarHBondContact OE1-NH1 3.02Å; E120-R338 VanDerWaalsContact OE1-NH1 3.13Å; E120-R338 IonicContact OE2-CZ 3.34Å; E120-R338 IonicContact OE2-NH1 3.3Å; E120-R338 PolarHBondContact OE2-NH1 2.83Å; E120-R338 IonicContact OE2-NH2 2.76Å; E120-R338 PolarHBondContact OE2-NH2 3.22Å; E120-R338 VanDerWaalsContact OE2-NH2 3.1Å; S123-R338 VanDerWaalsContact CB-NH2 3.25Å; S123-R338 VanDerWaalsContact OG-CZ 3.26Å; S123-R338 PolarHBondContact OG-NE 3.09Å; S123-R338 PolarHBondContact OG-NH2 2.98Å; V288-R338 HydrophobicContact CB-CB 4.13Å; V288-R338 PolarHBondContact N-O 3.42Å; V288-R338 PolarHBondContact O-N 2.97Å; R338-D340 WeakPolarHBondContact CB-OD1 3.47Å; R338-D340 IonicContact CZ-OD2 2.63Å; R338-D340 IonicContact NE-OD1 3.67Å; R338-D340 PolarHBondContact NE-OD1 3.13Å; R338-D340 IonicContact NE-OD2 3.93Å; R338-D340 PolarHBondContact NE-OD2 3.15Å; R338-D340 IonicContact NH2-OD2 3.01Å; R338-D340 PolarHBondContact NH2-OD2 3.01Å; R338-C423 PolarHBondContact NE-SG 3.48Å; R338-C423 VanDerWaalsContact NE-SG 3.36Å; R338-Q424 WeakPolarHBondContact CA-O 3.41Å; R338-L425 HydrophobicContact CG-CD1 4.23Å
339	T	86.3	Confident	78.3	Confident	34 Å²	34	45.4 Å²	45.4	21%	0.209	23%	0.23	C	C	.	.			trans	-131.8	10.5	179.9	61.2	0	0	0	0	113	P287 T337 H341 L342 K347 Q424	P287-T339 HydrophobicContact CB-CG2 4.27Å; T337-T339 HydrophobicContact CG2-CG2 4.16Å; T339-H341 VanDerWaalsContact C-N 3.33Å; T339-H341 PolarHBondContact O-N 3.5Å; T339-L342 HydrophobicContact CG2-CD1 4.18Å; T339-L342 PolarHBondContact O-N 2.96Å; T339-L342 VanDerWaalsContact O-N 3.15Å; T339-K347 WeakPolarHBondContact O-CE 3.46Å; T339-K347 PolarHBondContact O-NZ 2.87Å; T339-Q424 PolarHBondContact N-O 2.92Å; T339-Q424 PolarHBondContact OG1-O 2.89Å
340	D	83.6	Confident	76.8	Confident	8 Å²	8	49 Å²	49	4%	0.043	25%	0.252	C	S	.	.	S	Bend	trans	-58.3	-39.6	-179.3	25	-66	0	0	0	113.1	S123 R125 R338 Q424	S123-D340 VanDerWaalsContact CB-OD2 3.25Å; S123-D340 WeakPolarHBondContact CB-OD2 3.45Å; S123-D340 PolarHBondContact OG-OD2 2.74Å; R125-D340 PolarHBondContact NH2-O 2.77Å; R338-D340 WeakPolarHBondContact CB-OD1 3.47Å; R338-D340 IonicContact CZ-OD2 2.63Å; R338-D340 IonicContact NE-OD1 3.67Å; R338-D340 PolarHBondContact NE-OD1 3.13Å; R338-D340 IonicContact NE-OD2 3.93Å; R338-D340 PolarHBondContact NE-OD2 3.15Å; R338-D340 IonicContact NH2-OD2 3.01Å; R338-D340 PolarHBondContact NH2-OD2 3.01Å; D340-Q424 HydrophobicContact CB-CB 4.25Å; D340-Q424 HydrophobicContact CB-CG 4.42Å; D340-Q424 PolarHBondContact OD1-N 2.75Å
341	H	84.3	Confident	75.1	Confident	5 Å²	5	52.1 Å²	52.1	2%	0.023	26%	0.262	C	S	.	.	S	Bend	trans	-70.2	-29.8	176.5	59.2	-51.4	0	0	0	113.7	V122 R125 A286 T339	V122-H341 VanDerWaalsContact CG1-CD2 3.46Å; V122-H341 WeakPolarHBondContact CG1-CD2 3.25Å; V122-H341 WeakPolarHBondContact O-CB 3.28Å; R125-H341 HydrophobicContact CG-CB 3.9Å; R125-H341 PolarHBondContact NE-O 2.82Å; A286-H341 PolarHBondContact O-CE1 3.35Å; A286-H341 PolarHBondContact O-NE2 2.98Å; T339-H341 VanDerWaalsContact C-N 3.33Å; T339-H341 PolarHBondContact O-N 3.5Å
342	L	85.3	Confident	73.2	Confident	4 Å²	4	54.9 Å²	54.9	2%	0.021	29%	0.291	C	S	.	.			trans	-69.5	141.6	-169.4	-63.7	-176.4	0	0	0	113.7	S285 P287 T339 N346 K347	S285-L342 VanDerWaalsContact C-CD2 3.5Å; S285-L342 VanDerWaalsContact O-CD2 3.23Å; S285-L342 WeakPolarHBondContact O-CD2 3.46Å; P287-L342 HydrophobicContact CB-CD1 4.11Å; T339-L342 HydrophobicContact CG2-CD1 4.18Å; T339-L342 PolarHBondContact O-N 2.96Å; T339-L342 VanDerWaalsContact O-N 3.15Å; L342-N346 HydrophobicContact CD2-CB 4.35Å; L342-K347 HydrophobicContact CB-CD 4.41Å; L342-K347 HydrophobicContact CB-CG 3.73Å; L342-K347 HydrophobicContact CD1-CG 4.19Å; L342-K347 WeakPolarHBondContact O-CE 3.49Å; L342-K347 PolarHBondContact O-NZ 3.48Å
343	T	82.7	Confident	71.2	Confident	77 Å²	77	56.5 Å²	56.5	47%	0.472	32%	0.315	S	S	.	.			trans	-73.2	154.5	164.1	62.3	0	0	0	0	110.7	Q345 N346 K347	T343-Q345 PolarHBondContact O-N 3.32Å; T343-N346 PolarHBondContact O-N 3.22Å; T343-K347 PolarHBondContact O-N 3.48Å
344	D	78.3	Confident	69.9	Low	113 Å²	113	61.7 Å²	61.7	60%	0.604	33%	0.332	S	S	*	.	H	α-helix	trans	-65.2	-27.6	-177.6	-55.2	-54.4	0	0	0	112.8	K347 N348	D344-K347 PolarHBondContact O-N 3.37Å; D344-K347 IonicContact OD1-NZ 3.98Å; D344-N348 WeakPolarHBondContact O-CB 3.31Å; D344-N348 PolarHBondContact O-N 3.38Å; D344-N348 PolarHBondContact O-ND2 3.02Å
345	Q	75	Confident	68.1	Low	137 Å²	137	62.6 Å²	62.6	64%	0.64	34%	0.339	S	S	*	.	H	α-helix	trans	-60.8	-44.1	170	-168.4	-172.3	21.9	0	0	111.6	T343 N348 K349	T343-Q345 PolarHBondContact O-N 3.32Å; Q345-N348 PolarHBondContact O-N 3.17Å; Q345-K349 WeakPolarHBondContact O-CG 3.28Å; Q345-K349 PolarHBondContact O-N 3.15Å
346	N	77.7	Confident	66	Low	24 Å²	24	67.1 Å²	67.1	13%	0.128	37%	0.369	C	S	.	.	H	α-helix	trans	-73.5	-39.8	178.8	-70.5	-13.7	0	0	0	111.4	S285 L342 T343 N348 K349 T350	S285-N346 WeakPolarHBondContact CB-ND2 3.21Å; L342-N346 HydrophobicContact CD2-CB 4.35Å; T343-N346 PolarHBondContact O-N 3.22Å; N346-N348 PolarHBondContact O-N 2.89Å; N346-K349 WeakPolarHBondContact O-CB 3.35Å; N346-K349 PolarHBondContact O-N 3.25Å; N346-K349 VanDerWaalsContact O-N 3.13Å; N346-K349 PolarHBondContact OD1-NZ 3.31Å; N346-K349 VanDerWaalsContact OD1-NZ 3.07Å; N346-T350 PolarHBondContact O-N 2.86Å; N346-T350 VanDerWaalsContact O-N 3.09Å; N346-T350 PolarHBondContact O-OG1 2.85Å; N346-T350 VanDerWaalsContact O-OG1 3.1Å
347	K	74.8	Confident	64	Low	36 Å²	36	69.6 Å²	69.6	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-56	-36.2	171.1	-66.9	176.8	-176.1	169.9	0	112.4	T339 L342 T343 D344 K351	T339-K347 WeakPolarHBondContact O-CE 3.46Å; T339-K347 PolarHBondContact O-NZ 2.87Å; L342-K347 HydrophobicContact CB-CD 4.41Å; L342-K347 HydrophobicContact CB-CG 3.73Å; L342-K347 HydrophobicContact CD1-CG 4.19Å; L342-K347 WeakPolarHBondContact O-CE 3.49Å; L342-K347 PolarHBondContact O-NZ 3.48Å; T343-K347 PolarHBondContact O-N 3.48Å; D344-K347 PolarHBondContact O-N 3.37Å; D344-K347 IonicContact OD1-NZ 3.98Å; K347-K351 WeakPolarHBondContact O-CG 3.49Å
348	N	60.6	Low	62.3	Low	98 Å²	98	69.6 Å²	69.6	52%	0.524	38%	0.384	S	S	.	.	H	α-helix	trans	-77.1	-35.3	177.2	-70.9	-15	0	0	0	112.8	D344 Q345 N346 T350 K351 G352	D344-N348 WeakPolarHBondContact O-CB 3.31Å; D344-N348 PolarHBondContact O-N 3.38Å; D344-N348 PolarHBondContact O-ND2 3.02Å; Q345-N348 PolarHBondContact O-N 3.17Å; N346-N348 PolarHBondContact O-N 2.89Å; N348-T350 VanDerWaalsContact C-N 3.33Å; N348-T350 PolarHBondContact O-N 2.94Å; N348-K351 PolarHBondContact O-N 2.83Å; N348-K351 VanDerWaalsContact O-N 3.12Å; N348-G352 PolarHBondContact O-N 3.41Å; N348-G352 VanDerWaalsContact O-N 3.13Å
349	K	60.4	Low	59.9	Low	130 Å²	130	75.9 Å²	75.9	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-57	-45.9	170.2	-72.2	172.2	-173.8	164.4	0	111.5	Q345 N346 K351 G352	Q345-K349 WeakPolarHBondContact O-CG 3.28Å; Q345-K349 PolarHBondContact O-N 3.15Å; N346-K349 WeakPolarHBondContact O-CB 3.35Å; N346-K349 PolarHBondContact O-N 3.25Å; N346-K349 VanDerWaalsContact O-N 3.13Å; N346-K349 PolarHBondContact OD1-NZ 3.31Å; N346-K349 VanDerWaalsContact OD1-NZ 3.07Å; K349-K351 PolarHBondContact O-N 2.92Å; K349-K351 VanDerWaalsContact O-N 3.17Å; K349-G352 PolarHBondContact O-N 3.49Å
350	T	53.3	Low	57.4	Low	78 Å²	78	81.4 Å²	81.4	48%	0.479	44%	0.44	S	S	.	.	H	α-helix	trans	-61.3	-23.5	177.8	-44.9	0	0	0	0	113.2	P287 N346 N348	P287-T350 HydrophobicContact CG-CG2 4.33Å; N346-T350 PolarHBondContact O-N 2.86Å; N346-T350 VanDerWaalsContact O-N 3.09Å; N346-T350 PolarHBondContact O-OG1 2.85Å; N346-T350 VanDerWaalsContact O-OG1 3.1Å; N348-T350 VanDerWaalsContact C-N 3.33Å; N348-T350 PolarHBondContact O-N 2.94Å
351	K	48.4	Very low	55.3	Low	148 Å²	148	85.1 Å²	85.1	64%	0.643	46%	0.459	S	S	*	.	H	α-helix	trans	-88.2	-19	175.1	-67.4	175.4	179.2	-176.2	0	114.1	K347 N348 K349	K347-K351 WeakPolarHBondContact O-CG 3.49Å; N348-K351 PolarHBondContact O-N 2.83Å; N348-K351 VanDerWaalsContact O-N 3.12Å; K349-K351 PolarHBondContact O-N 2.92Å; K349-K351 VanDerWaalsContact O-N 3.17Å
352	G	36.2	Very low	52.8	Low	61 Å²	61	86.4 Å²	86.4	63%	0.629	47%	0.474	S	S	*	.	H	α-helix	trans	-85.5	-17.3	-170.9	0	0	0	0	0	115.5	N348 K349 R354	N348-G352 PolarHBondContact O-N 3.41Å; N348-G352 VanDerWaalsContact O-N 3.13Å; K349-G352 PolarHBondContact O-N 3.49Å; G352-R354 PolarHBondContact O-N 2.97Å
353	G	37.4	Very low	50.3	Low	61 Å²	61	88.4 Å²	88.4	63%	0.629	48%	0.484	S	S	*	.			trans	-77.7	43.9	-176.3	0	0	0	0	0	115.3
354	R	44.9	Very low	47.7	Very low	141 Å²	141	88.1 Å²	88.1	53%	0.532	49%	0.489	S	S	.	.			trans	-87.4	123.7	-179.1	-60.8	-156.2	156.7	151.1	-1.8	111.2	G352 Q358 E365	G352-R354 PolarHBondContact O-N 2.97Å; R354-Q358 VanDerWaalsContact CB-OE1 3.26Å; R354-E365 IonicContact CZ-OE2 2.73Å; R354-E365 IonicContact NH1-OE2 3.42Å; R354-E365 IonicContact NH2-OE2 3.67Å; R354-E365 PolarHBondContact NH2-OE2 2.88Å
355	T	38.5	Very low	45.4	Very low	48 Å²	48	89.8 Å²	89.8	29%	0.294	49%	0.493	S	S	.	.			trans	-95.2	161.5	-179.4	56.7	0	0	0	0	112.1	M207 L357 Q358	M207-T355 HydrophobicContact CE-CG2 4.14Å; T355-L357 VanDerWaalsContact C-N 3.28Å; T355-L357 PolarHBondContact O-N 3.3Å; T355-Q358 WeakPolarHBondContact O-CB 3.38Å; T355-Q358 PolarHBondContact O-N 2.88Å
356	P	32.5	Very low	43	Very low	115 Å²	115	90.9 Å²	90.9	75%	0.747	50%	0.499	S	S	*	.	H	α-helix	trans	-58.9	-33.3	-177.8	-27.4	36.4	0	0	0	114.9	Q358 N359 F360	P356-Q358 PolarHBondContact O-N 3.08Å; P356-N359 PolarHBondContact O-N 3Å; P356-N359 VanDerWaalsContact O-N 3.11Å; P356-F360 PolarHBondContact O-N 3.22Å
357	L	38.5	Very low	40.7	Very low	109 Å²	109	98.1 Å²	98.1	57%	0.571	53%	0.531	S	S	*	.	H	α-helix	trans	-60.9	-22.6	173.8	-79.7	165.1	0	0	0	113	T355 N359 F360 L361	T355-L357 VanDerWaalsContact C-N 3.28Å; T355-L357 PolarHBondContact O-N 3.3Å; L357-N359 VanDerWaalsContact C-N 3.32Å; L357-N359 PolarHBondContact O-N 3.09Å; L357-F360 HydrophobicContact CD2-CD1 4.36Å; L357-F360 WeakPolarHBondContact O-CB 3.49Å; L357-F360 PolarHBondContact O-N 3.32Å; L357-L361 PolarHBondContact O-N 3.42Å
358	Q	44.9	Very low	38.2	Very low	26 Å²	26	104.3 Å²	104.3	12%	0.121	56%	0.563	C	S	.	*	H	α-helix	trans	-75.4	-21.1	178.1	-152.7	165.4	67.1	0	0	112.8	R354 T355 P356 I363	R354-Q358 VanDerWaalsContact CB-OE1 3.26Å; T355-Q358 WeakPolarHBondContact O-CB 3.38Å; T355-Q358 PolarHBondContact O-N 2.88Å; P356-Q358 PolarHBondContact O-N 3.08Å; Q358-I363 HydrophobicContact CG-CD1 4.04Å
359	N	35.2	Very low	36.6	Very low	140 Å²	140	104.1 Å²	104.1	75%	0.749	57%	0.569	S	S	*	*	H	α-helix	trans	-76.9	-36.9	166.4	-74.2	-10.5	0	0	0	111.4	P356 L357 L361 G362	P356-N359 PolarHBondContact O-N 3Å; P356-N359 VanDerWaalsContact O-N 3.11Å; L357-N359 VanDerWaalsContact C-N 3.32Å; L357-N359 PolarHBondContact O-N 3.09Å; N359-L361 PolarHBondContact O-N 2.89Å; N359-G362 PolarHBondContact O-N 2.8Å; N359-G362 VanDerWaalsContact O-N 3.07Å
360	F	32.7	Very low	35	Very low	150 Å²	150	103.9 Å²	103.9	66%	0.658	58%	0.584	S	S	*	*	H	α-helix	trans	-62.7	-21.8	175.2	-177.6	-103.8	0	0	0	112.7	P356 L357	P356-F360 PolarHBondContact O-N 3.22Å; L357-F360 HydrophobicContact CD2-CD1 4.36Å; L357-F360 WeakPolarHBondContact O-CB 3.49Å; L357-F360 PolarHBondContact O-N 3.32Å
361	L	40.3	Very low	33.7	Very low	87 Å²	87	107.3 Å²	107.3	46%	0.455	60%	0.599	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.3	7.8	174.9	-63.8	175.1	0	0	0	114.7	L357 N359 I363	L357-L361 PolarHBondContact O-N 3.42Å; N359-L361 PolarHBondContact O-N 2.89Å; L361-I363 PolarHBondContact O-N 3.28Å
362	G	31.6	Very low	32.8	Very low	32 Å²	32	108.4 Å²	108.4	33%	0.33	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	72.7	27.8	161.3	0	0	0	0	0	117.7	N359 A364	N359-G362 PolarHBondContact O-N 2.8Å; N359-G362 VanDerWaalsContact O-N 3.07Å; G362-A364 PolarHBondContact O-N 2.98Å
363	I	33.1	Very low	32.4	Very low	46 Å²	46	111.9 Å²	111.9	24%	0.236	62%	0.621	C	S	.	*			trans	-83.3	98.6	-173.1	-50.1	-172.8	0	0	0	112.8	Q358 L361	Q358-I363 HydrophobicContact CG-CD1 4.04Å; L361-I363 PolarHBondContact O-N 3.28Å
364	A	27.8	Very low	31.8	Very low	70 Å²	70	111.8 Å²	111.8	58%	0.579	62%	0.619	S	S	*	*			trans	-105.8	108.5	167.7	0	0	0	0	0	111.5	G362 Q366	G362-A364 PolarHBondContact O-N 2.98Å; A364-Q366 PolarHBondContact O-N 3.22Å
365	E	29.8	Very low	30.9	Very low	148 Å²	148	113.2 Å²	113.2	69%	0.692	64%	0.638	S	S	*	*			trans	-75.6	104.4	-179.4	-94.1	174.1	118.8	0	0	112.6	R354	R354-E365 IonicContact CZ-OE2 2.73Å; R354-E365 IonicContact NH1-OE2 3.42Å; R354-E365 IonicContact NH2-OE2 3.67Å; R354-E365 PolarHBondContact NH2-OE2 2.88Å
366	Q	24.8	Very low	30.4	Very low	161 Å²	161	119.7 Å²	119.7	75%	0.752	66%	0.662	S	S	*	*			trans	-84.5	123.9	166	-66.2	-163.2	24.2	0	0	111.6	A364 M368	A364-Q366 PolarHBondContact O-N 3.22Å; Q366-M368 PolarHBondContact O-N 3.11Å
367	H	28.3	Very low	30	Very low	175 Å²	175	122.3 Å²	122.3	81%	0.81	66%	0.664	S	S	*	*			trans	-70.9	108.7	179.3	-110.1	-104.2	0	0	0	112.1
368	M	23.4	Very low	29.3	Very low	167 Å²	167	125.7 Å²	125.7	82%	0.823	68%	0.677	S	S	*	*			trans	-101.7	80.8	169.1	-77.4	-68.2	173.2	0	0	111.7	Q366	Q366-M368 PolarHBondContact O-N 3.11Å
369	S	26	Very low	28.3	Very low	94 Å²	94	132.6 Å²	132.6	66%	0.657	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-75.8	120.2	166.4	-61.5	0	0	0	0	109.6	N371	S369-N371 PolarHBondContact O-N 3.44Å
370	S	28.3	Very low	27.9	Very low	125 Å²	125	135.2 Å²	135.2	87%	0.874	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-64.3	121	177	-72.9	0	0	0	0	111.4
371	N	25.9	Very low	27.4	Very low	149 Å²	149	136.9 Å²	136.9	80%	0.797	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-61.7	139.1	173.9	-77.4	-49	0	0	0	111.3	S369	S369-N371 PolarHBondContact O-N 3.44Å
372	N	27.8	Very low	26.7	Very low	171 Å²	171	136.9 Å²	136.9	91%	0.914	74%	0.736	S	S	*	*			trans	-137.8	127.7	148.5	-133.9	-13.9	0	0	0	108.1
373	V	29.2	Very low	26.4	Very low	135 Å²	135	144 Å²	144	82%	0.818	76%	0.761	S	S	*	*			trans	-105.1	135.4	-163.6	176.3	0	0	0	0	110.7
374	G	25.1	Very low	26.3	Very low	58 Å²	58	151 Å²	151	60%	0.598	79%	0.793	S	S	*	*			trans	121.5	64.8	156.1	0	0	0	0	0	117.7
375	N	26	Very low	26.1	Very low	172 Å²	172	151.7 Å²	151.7	92%	0.92	80%	0.798	S	S	*	*				-174.7	153.8	100.2	-97.5	-29.2	0	0	0	113.2
376	K	26.3	Very low	25.9	Very low	183 Å²	183	152.5 Å²	152.5	80%	0.796	81%	0.806	S	S	*	*			trans	-92.2	140.9	168.5	-65.8	176.3	178.6	177.9	0	108.9
377	H	24	Very low	26	Very low	171 Å²	171	151.5 Å²	151.5	79%	0.792	81%	0.811	S	S	*	*				-171.5	97.9	115.3	-97.8	-67.9	0	0	0	111.2
378	Q	25.3	Very low	25.8	Very low	179 Å²	179	148.1 Å²	148.1	84%	0.836	80%	0.803	S	S	*	*				31.7	99.2	127.7	-172.2	175	3.6	0	0	118.2
379	E	23.6	Very low	26.5	Very low	172 Å²	172	149.3 Å²	149.3	80%	0.804	81%	0.806	S	S	*	*				-141	138.4	129.2	-149.8	177.5	169.7	0	0	109.9
380	Q	26.1	Very low	26.4	Very low	194 Å²	194	153 Å²	153	91%	0.907	82%	0.815	S	S	*	*			trans	-131.9	105.2	179.8	-178.9	175.4	2.5	0	0	108
381	K	23.4	Very low	26.9	Very low	185 Å²	185	153 Å²	153	80%	0.804	82%	0.815	S	S	*	*			trans	-142.9	124.8	176.6	-145.7	169.3	-170	172.7	0	109.8
382	A	26	Very low	27.1	Very low	88 Å²	88	151 Å²	151	73%	0.727	81%	0.812	S	S	*	*			trans	-72	146.6	178.5	0	0	0	0	0	110.6
383	H	24.8	Very low	27.8	Very low	182 Å²	182	148.2 Å²	148.2	84%	0.843	80%	0.804	S	S	*	*			trans	-138.1	107.2	149	-113.2	-76.3	0	0	0	108.3	A385	H383-A385 PolarHBondContact O-N 3.39Å
384	E	30.2	Very low	29	Very low	193 Å²	193	145.8 Å²	145.8	90%	0.902	79%	0.789	S	S	*	*			trans	-61.9	127.3	159.3	-70.4	172.3	102.9	0	0	107.8
385	A	24.5	Very low	30.5	Very low	84 Å²	84	147.5 Å²	147.5	69%	0.694	79%	0.788	S	S	*	*			trans	-125	115.4	171.8	0	0	0	0	0	107.6	H383 V387	H383-A385 PolarHBondContact O-N 3.39Å; A385-V387 PolarHBondContact O-N 2.9Å
386	L	25	Very low	32.4	Very low	165 Å²	165	140.7 Å²	140.7	86%	0.864	75%	0.752	S	S	*	*			trans	-60.3	121.2	-179.2	-140.2	75.3	0	0	0	109.5	T388	L386-T388 PolarHBondContact O-N 2.94Å
387	V	26.9	Very low	34.6	Very low	140 Å²	140	133.8 Å²	133.8	85%	0.848	73%	0.725	S	S	*	*			trans	-78.5	77.8	177.5	-175.2	0	0	0	0	109.5	A385 Q389	A385-V387 PolarHBondContact O-N 2.9Å; V387-Q389 PolarHBondContact O-N 3Å
388	T	24.3	Very low	36.7	Very low	104 Å²	104	128.7 Å²	128.7	64%	0.638	71%	0.707	S	S	*	*			trans	-65.7	120.5	164.4	-59.2	0	0	0	0	108.5	L386 M390	L386-T388 PolarHBondContact O-N 2.94Å; T388-M390 PolarHBondContact O-N 3.39Å; T388-M390 VanDerWaalsContact O-N 3.15Å
389	Q	37.2	Very low	38.7	Very low	191 Å²	191	121.7 Å²	121.7	89%	0.893	68%	0.679	S	S	*	*			trans	-63.4	115.6	172.4	-75.4	-173.7	-21.8	0	0	110	V387	V387-Q389 PolarHBondContact O-N 3Å
390	M	24.6	Very low	41.2	Very low	171 Å²	171	121.4 Å²	121.4	84%	0.842	68%	0.68	S	S	*	*			trans	-150.6	135	169.3	-132.4	165.9	-177.8	0	0	110	T388 S392	T388-M390 PolarHBondContact O-N 3.39Å; T388-M390 VanDerWaalsContact O-N 3.15Å; M390-S392 PolarHBondContact O-N 3.2Å
391	S	38.8	Very low	44	Very low	127 Å²	127	112.8 Å²	112.8	89%	0.888	64%	0.64	S	S	*	*			trans	-72.6	97.1	-175	39.8	0	0	0	0	111.8
392	S	31.1	Very low	46.9	Very low	105 Å²	105	107.4 Å²	107.4	73%	0.734	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-87.3	147.7	163.1	-81.7	0	0	0	0	111.2	M390	M390-S392 PolarHBondContact O-N 3.2Å
393	P	41.5	Very low	49.7	Very low	113 Å²	113	103.8 Å²	103.8	73%	0.734	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-63.5	138.5	175.7	27.7	-34.5	0	0	0	110.8	V395	P393-V395 PolarHBondContact O-N 3.13Å
394	V	53.8	Low	52.5	Low	84 Å²	84	101.5 Å²	101.5	51%	0.509	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-61.5	125.9	177.1	-177.9	0	0	0	0	109.2	T396 H421	V394-T396 HydrophobicContact CB-CG2 4.15Å; V394-T396 HydrophobicContact CG1-CG2 3.81Å; V394-T396 PolarHBondContact O-N 2.89Å; V394-H421 VanDerWaalsContact CG1-CE1 3.47Å; V394-H421 WeakPolarHBondContact CG1-CE1 3.28Å; V394-H421 WeakPolarHBondContact CG1-NE2 3.47Å
395	V	57.3	Low	55.2	Low	94 Å²	94	95.9 Å²	95.9	57%	0.57	56%	0.556	S	S	*	*			trans	-78.2	87.2	176.9	-175.2	0	0	0	0	108.9	P393 N397 P398	P393-V395 PolarHBondContact O-N 3.13Å; V395-N397 VanDerWaalsContact C-N 3.32Å; V395-N397 PolarHBondContact O-N 3.4Å; V395-P398 HydrophobicContact CG1-CB 4.13Å
396	T	66.6	Low	58.1	Low	29 Å²	29	92 Å²	92	18%	0.178	52%	0.523	C	S	.	.	S	Bend	trans	-81.6	-7.1	-174.8	56.4	0	0	0	0	114.3	L91 V394 G420	L91-T396 WeakPolarHBondContact O-CB 2.99Å; L91-T396 WeakPolarHBondContact O-CG2 3.42Å; L91-T396 PolarHBondContact O-OG1 3.03Å; V394-T396 HydrophobicContact CB-CG2 4.15Å; V394-T396 HydrophobicContact CG1-CG2 3.81Å; V394-T396 PolarHBondContact O-N 2.89Å; T396-G420 PolarHBondContact O-N 2.94Å
397	N	70.8	Confident	61.1	Low	39 Å²	39	84.3 Å²	84.3	21%	0.209	48%	0.483	C	S	.	.			trans	-131.5	73	168.3	-178.1	3.1	0	0	0	109.9	V395 A399 M400 L401 I419	V395-N397 VanDerWaalsContact C-N 3.32Å; V395-N397 PolarHBondContact O-N 3.4Å; N397-A399 PolarHBondContact O-N 3.5Å; N397-M400 PolarHBondContact O-N 3Å; N397-M400 VanDerWaalsContact O-N 3.13Å; N397-M400 PolarHBondContact OD1-N 2.83Å; N397-L401 PolarHBondContact ND2-N 3.02Å; N397-L401 PolarHBondContact ND2-O 3.27Å; N397-L401 PolarHBondContact OD1-N 2.67Å; N397-I419 HydrophobicContact CB-CG2 4.32Å
398	P	68.8	Low	63.7	Low	64 Å²	64	81.7 Å²	81.7	42%	0.416	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.9	-176	30	-35.7	0	0	0	113.2	V395 M400 G420	V395-P398 HydrophobicContact CG1-CB 4.13Å; P398-M400 VanDerWaalsContact C-N 3.33Å; P398-G420 WeakPolarHBondContact CD-O 3.39Å; P398-G420 WeakPolarHBondContact CG-O 3.33Å
399	A	67.6	Low	65.8	Low	31 Å²	31	80.9 Å²	80.9	26%	0.256	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-3	174.4	0	0	0	0	0	113.9	N397 L401 R417	N397-A399 PolarHBondContact O-N 3.5Å; A399-L401 HydrophobicContact CB-CD1 4.28Å; A399-L401 HydrophobicContact CB-CG 3.97Å; A399-L401 PolarHBondContact O-N 2.87Å; A399-R417 HydrophobicContact CB-CB 4Å; A399-R417 HydrophobicContact CB-CG 4.43Å
400	M	77	Confident	67	Low	166 Å²	166	73.8 Å²	73.8	82%	0.818	44%	0.439	S	S	*	.			trans	51.5	31.3	-175.2	-63.3	-173.1	66.1	0	0	114.6	N397 P398 T402	N397-M400 PolarHBondContact O-N 3Å; N397-M400 VanDerWaalsContact O-N 3.13Å; N397-M400 PolarHBondContact OD1-N 2.83Å; P398-M400 VanDerWaalsContact C-N 3.33Å; M400-T402 PolarHBondContact O-N 2.96Å
401	L	83.5	Confident	68.5	Low	14 Å²	14	68.3 Å²	68.3	7%	0.073	42%	0.418	C	S	.	.			trans	-59.7	135.5	178.8	-69.5	168	0	0	0	111	W55 N397 A399 E405 R417 I419	W55-L401 HydrophobicContact CH2-CB 4.38Å; W55-L401 WeakPolarHBondContact CZ2-O 3.49Å; N397-L401 PolarHBondContact ND2-N 3.02Å; N397-L401 PolarHBondContact ND2-O 3.27Å; N397-L401 PolarHBondContact OD1-N 2.67Å; A399-L401 HydrophobicContact CB-CD1 4.28Å; A399-L401 HydrophobicContact CB-CG 3.97Å; A399-L401 PolarHBondContact O-N 2.87Å; L401-E405 HydrophobicContact CD2-CB 4.1Å; L401-R417 HydrophobicContact CD1-CB 4.44Å; L401-R417 HydrophobicContact CD2-CB 4.16Å; L401-I419 HydrophobicContact CD1-CG2 4.32Å
402	T	85.8	Confident	69.3	Low	71 Å²	71	65.4 Å²	65.4	44%	0.436	40%	0.395	S	S	.	.			trans	-76.1	166.6	166.1	59.6	0	0	0	0	111.4	M400 E404 E405 Y406	M400-T402 PolarHBondContact O-N 2.96Å; T402-E404 VanDerWaalsContact C-N 3.27Å; T402-E404 PolarHBondContact O-N 2.93Å; T402-E405 WeakPolarHBondContact CB-OE2 3.37Å; T402-E405 WeakPolarHBondContact CG2-OE2 3.33Å; T402-E405 PolarHBondContact N-OE2 3.27Å; T402-E405 PolarHBondContact O-N 2.79Å; T402-E405 WeakPolarHBondContact OG1-CB 3.34Å; T402-E405 VanDerWaalsContact OG1-CG 3.24Å; T402-E405 WeakPolarHBondContact OG1-CG 3.45Å; T402-E405 PolarHBondContact OG1-N 3.28Å; T402-E405 VanDerWaalsContact OG1-N 3.13Å; T402-E405 PolarHBondContact OG1-OE2 3.4Å; T402-Y406 WeakPolarHBondContact O-CB 3.19Å; T402-Y406 PolarHBondContact O-N 3.14Å
403	A	84.9	Confident	70.2	Confident	12 Å²	12	68.9 Å²	68.9	10%	0.099	40%	0.399	C	S	.	.	H	α-helix	trans	-57.8	-44.3	171.1	0	0	0	0	0	110.8	Y52 E405 Y406 F407	Y52-A403 HydrophobicContact CE2-CB 4.42Å; A403-E405 PolarHBondContact O-N 3.41Å; A403-Y406 WeakPolarHBondContact O-CB 3.42Å; A403-Y406 PolarHBondContact O-N 2.95Å; A403-F407 HydrophobicContact CB-CD2 4.33Å; A403-F407 HydrophobicContact CB-CE2 4.46Å; A403-F407 VanDerWaalsContact O-CD2 3.28Å; A403-F407 WeakPolarHBondContact O-CD2 3.43Å; A403-F407 PolarHBondContact O-N 2.83Å
404	E	83.2	Confident	70.7	Confident	135 Å²	135	72.4 Å²	72.4	63%	0.631	41%	0.406	S	S	*	.	H	α-helix	trans	-63.9	-40.2	-177.7	-60.4	180	-169.6	0	0	111.9	E44 T402 Y406 N408	E44-E404 WeakPolarHBondContact OE1-CA 3.36Å; E44-E404 WeakPolarHBondContact OE2-CA 3.22Å; T402-E404 VanDerWaalsContact C-N 3.27Å; T402-E404 PolarHBondContact O-N 2.93Å; E404-Y406 VanDerWaalsContact C-N 3.33Å; E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 PolarHBondContact O-N 3.47Å; E404-N408 VanDerWaalsContact O-N 3.13Å
405	E	85.4	Confident	70.6	Confident	74 Å²	74	71.4 Å²	71.4	35%	0.346	40%	0.4	S	S	.	.	H	α-helix	trans	-71.5	-27	173	-69.2	163.7	124.9	0	0	113.3	L401 T402 A403 S411	L401-E405 HydrophobicContact CD2-CB 4.1Å; T402-E405 WeakPolarHBondContact CB-OE2 3.37Å; T402-E405 WeakPolarHBondContact CG2-OE2 3.33Å; T402-E405 PolarHBondContact N-OE2 3.27Å; T402-E405 PolarHBondContact O-N 2.79Å; T402-E405 WeakPolarHBondContact OG1-CB 3.34Å; T402-E405 VanDerWaalsContact OG1-CG 3.24Å; T402-E405 WeakPolarHBondContact OG1-CG 3.45Å; T402-E405 PolarHBondContact OG1-N 3.28Å; T402-E405 VanDerWaalsContact OG1-N 3.13Å; T402-E405 PolarHBondContact OG1-OE2 3.4Å; A403-E405 PolarHBondContact O-N 3.41Å; E405-S411 PolarHBondContact O-OG 2.82Å
406	Y	86.4	Confident	70.9	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.008	41%	0.414	C	S	.	.	H	α-helix	trans	-77.7	-46.1	-179.2	-176.7	-91.4	0	0	0	112.6	W55 D78 R80 R82 L87 T402 A403 E404 I419	W55-Y406 AromaticContact CE3-CD1 3.98Å; W55-Y406 HydrophobicContact CE3-CD1 3.98Å; W55-Y406 HydrophobicContact CE3-CD2 4.34Å; W55-Y406 HydrophobicContact CE3-CE1 4.36Å; W55-Y406 AromaticContact CE3-CG 3.99Å; W55-Y406 HydrophobicContact CE3-CG 3.99Å; W55-Y406 AromaticContact CH2-CD2 3.75Å; W55-Y406 HydrophobicContact CH2-CD2 3.75Å; W55-Y406 AromaticContact CH2-CG 3.72Å; W55-Y406 HydrophobicContact CH2-CG 3.72Å; W55-Y406 AromaticContact CZ3-CD1 3.79Å; W55-Y406 HydrophobicContact CZ3-CD1 3.79Å; W55-Y406 AromaticContact CZ3-CD2 3.37Å; W55-Y406 HydrophobicContact CZ3-CD2 3.37Å; W55-Y406 HydrophobicContact CZ3-CE1 4.24Å; W55-Y406 AromaticContact CZ3-CE2 3.83Å; W55-Y406 HydrophobicContact CZ3-CE2 3.83Å; W55-Y406 AromaticContact CZ3-CG 3.34Å; W55-Y406 HydrophobicContact CZ3-CG 3.34Å; D78-Y406 VanDerWaalsContact OD2-CE1 3.23Å; D78-Y406 WeakPolarHBondContact OD2-CE1 3.25Å; D78-Y406 PolarHBondContact OD2-OH 2.95Å; R80-Y406 PolarHBondContact NE-O 3.49Å; R82-Y406 PolarHBondContact NH1-OH 2.81Å; R82-Y406 VanDerWaalsContact NH1-OH 3.07Å; L87-Y406 HydrophobicContact CD1-CE1 4.32Å; T402-Y406 WeakPolarHBondContact O-CB 3.19Å; T402-Y406 PolarHBondContact O-N 3.14Å; A403-Y406 WeakPolarHBondContact O-CB 3.42Å; A403-Y406 PolarHBondContact O-N 2.95Å; E404-Y406 VanDerWaalsContact C-N 3.33Å; Y406-I419 HydrophobicContact CD2-CG2 4.16Å; Y406-I419 HydrophobicContact CE2-CD1 3.79Å; Y406-I419 HydrophobicContact CE2-CG1 3.88Å; Y406-I419 HydrophobicContact CE2-CG2 4.2Å
407	F	87.3	Confident	71.3	Confident	4 Å²	4	78 Å²	78	2%	0.018	43%	0.428	C	S	.	.	H	α-helix	trans	-90.2	-12	-176.9	-66.3	-67.9	0	0	0	114.2	E44 Y48 H51 Y52 W55 D78 P79 L87 A403 P409	E44-F407 HydrophobicContact CB-CB 4.14Å; E44-F407 HydrophobicContact CB-CD2 4.29Å; E44-F407 HydrophobicContact CB-CG 4.37Å; E44-F407 HydrophobicContact CG-CB 3.65Å; E44-F407 HydrophobicContact CG-CG 4.4Å; Y48-F407 AromaticContact CD2-CD1 3.86Å; Y48-F407 HydrophobicContact CD2-CD1 3.86Å; Y48-F407 HydrophobicContact CD2-CG 4.49Å; Y48-F407 HydrophobicContact CG-CD1 4.21Å; Y48-F407 HydrophobicContact CG-CE1 4.46Å; H51-F407 HydrophobicContact CB-CE1 3.7Å; H51-F407 HydrophobicContact CB-CZ 3.83Å; Y52-F407 HydrophobicContact CD2-CE2 4.38Å; W55-F407 HydrophobicContact CB-CE2 4.28Å; W55-F407 HydrophobicContact CB-CZ 4.36Å; W55-F407 HydrophobicContact CD2-CE2 4.47Å; W55-F407 HydrophobicContact CG-CE2 4.28Å; D78-F407 HydrophobicContact CB-CE1 4.37Å; P79-F407 VanDerWaalsContact CG-O 3.32Å; P79-F407 WeakPolarHBondContact CG-O 3.39Å; L87-F407 HydrophobicContact CD2-CZ 4.43Å; A403-F407 HydrophobicContact CB-CD2 4.33Å; A403-F407 HydrophobicContact CB-CE2 4.46Å; A403-F407 VanDerWaalsContact O-CD2 3.28Å; A403-F407 WeakPolarHBondContact O-CD2 3.43Å; A403-F407 PolarHBondContact O-N 2.83Å; F407-P409 WeakPolarHBondContact O-CD 3.34Å
408	N	82.6	Confident	71.7	Confident	85 Å²	85	78.7 Å²	78.7	46%	0.455	43%	0.433	S	S	.	.			trans	-86.8	113.2	172.6	-173.9	-13.1	0	0	0	111.6	E404 G410 S411	E404-N408 WeakPolarHBondContact O-CB 3.47Å; E404-N408 PolarHBondContact O-N 3.47Å; E404-N408 VanDerWaalsContact O-N 3.13Å; N408-G410 PolarHBondContact O-N 3.24Å; N408-G410 VanDerWaalsContact O-N 3.11Å; N408-G410 PolarHBondContact OD1-N 3.4Å; N408-S411 PolarHBondContact O-N 2.88Å; N408-S411 PolarHBondContact O-OG 3.14Å; N408-S411 VanDerWaalsContact O-OG 3.12Å
409	P	67.1	Low	72.4	Confident	87 Å²	87	76 Å²	76	57%	0.565	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-6.5	-179.4	30.4	-36.7	0	0	0	114.5	F407	F407-P409 WeakPolarHBondContact O-CD 3.34Å
410	G	63.3	Low	73	Confident	43 Å²	43	75 Å²	75	44%	0.443	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-16.9	177.3	0	0	0	0	0	115.1	N408 T412	N408-G410 PolarHBondContact O-N 3.24Å; N408-G410 VanDerWaalsContact O-N 3.11Å; N408-G410 PolarHBondContact OD1-N 3.4Å; G410-T412 VanDerWaalsContact C-N 3.33Å; G410-T412 PolarHBondContact O-N 3.06Å
411	S	56.8	Low	73	Confident	56 Å²	56	70 Å²	70	39%	0.392	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-70.9	-25.3	-172.6	64.9	0	0	0	0	114	E405 N408 Q413	E405-S411 PolarHBondContact O-OG 2.82Å; N408-S411 PolarHBondContact O-N 2.88Å; N408-S411 PolarHBondContact O-OG 3.14Å; N408-S411 VanDerWaalsContact O-OG 3.12Å; S411-Q413 VanDerWaalsContact C-N 3.31Å; S411-Q413 PolarHBondContact O-N 3.29Å
412	T	53.7	Low	72.6	Confident	65 Å²	65	74.2 Å²	74.2	40%	0.399	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-80.4	1.3	-160.3	-13.9	0	0	0	0	115.8	G410 Q414	G410-T412 VanDerWaalsContact C-N 3.33Å; G410-T412 PolarHBondContact O-N 3.06Å; T412-Q414 VanDerWaalsContact C-N 3.31Å; T412-Q414 PolarHBondContact O-N 3.4Å
413	Q	51.4	Low	72.4	Confident	179 Å²	179	73.7 Å²	73.7	84%	0.836	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-69.6	-16.8	-165.7	-67.3	-169.4	-2.7	0	0	116	S411	S411-Q413 VanDerWaalsContact C-N 3.31Å; S411-Q413 PolarHBondContact O-N 3.29Å
414	Q	52.4	Low	72.4	Confident	186 Å²	186	77.9 Å²	77.9	87%	0.869	43%	0.426	S	S	*	.	S	Bend	trans	-112.7	-24.8	-171	-64.9	-176.8	-0.2	0	0	115.1	T412	T412-Q414 VanDerWaalsContact C-N 3.31Å; T412-Q414 PolarHBondContact O-N 3.4Å
415	T	51.8	Low	72.5	Confident	63 Å²	63	75 Å²	75	39%	0.387	41%	0.414	S	S	.	.			trans	-154.8	137	173.3	48	0	0	0	0	110.5	R417	T415-R417 VanDerWaalsContact C-N 3.27Å; T415-R417 PolarHBondContact O-N 2.95Å; T415-R417 PolarHBondContact OG1-NE 3.33Å; T415-R417 PolarHBondContact OG1-NH2 2.7Å
416	P	63.3	Low	72.4	Confident	132 Å²	132	75.7 Å²	75.7	86%	0.857	42%	0.424	S	S	*	.			trans	-75.9	75.3	175.8	32.7	-35.4	0	0	0	111.2
417	R	75	Confident	72.2	Confident	129 Å²	129	79 Å²	79	49%	0.487	45%	0.445	S	S	.	.			trans	-87.1	136.4	172.7	-62.2	-177.8	-147.6	172.9	8.8	110.4	R80 A399 L401 T415	R80-R417 PolarHBondContact NH1-O 3.01Å; A399-R417 HydrophobicContact CB-CB 4Å; A399-R417 HydrophobicContact CB-CG 4.43Å; L401-R417 HydrophobicContact CD1-CB 4.44Å; L401-R417 HydrophobicContact CD2-CB 4.16Å; T415-R417 VanDerWaalsContact C-N 3.27Å; T415-R417 PolarHBondContact O-N 2.95Å; T415-R417 PolarHBondContact OG1-NE 3.33Å; T415-R417 PolarHBondContact OG1-NH2 2.7Å
418	D	78.4	Confident	71.7	Confident	55 Å²	55	83.2 Å²	83.2	29%	0.294	46%	0.463	S	S	.	.			trans	-145.9	169	176.5	-157.2	16.2	0	0	0	111	R80 R82	R80-D418 WeakPolarHBondContact CD-OD1 3.39Å; R80-D418 IonicContact CZ-OD1 3.4Å; R80-D418 IonicContact NE-OD1 2.71Å; R80-D418 IonicContact NH1-OD1 3.2Å; R80-D418 PolarHBondContact NH1-OD1 3.25Å; R82-D418 IonicContact CZ-OD1 3.1Å; R82-D418 IonicContact CZ-OD2 2.76Å; R82-D418 IonicContact NH1-OD1 3.38Å; R82-D418 PolarHBondContact NH1-OD1 3.38Å; R82-D418 IonicContact NH1-OD2 3.25Å; R82-D418 PolarHBondContact NH1-OD2 3.22Å; R82-D418 IonicContact NH2-OD1 2.93Å; R82-D418 IonicContact NH2-OD2 3.5Å; R82-D418 PolarHBondContact NH2-OD2 3.4Å
419	I	84.3	Confident	71.6	Confident	8 Å²	8	82.3 Å²	82.3	4%	0.041	46%	0.46	C	S	.	.	S	Bend	trans	-81.3	169.5	173.4	57.8	168	0	0	0	112	W55 L87 T90 L91 N397 L401 Y406	W55-I419 HydrophobicContact CH2-CG2 3.69Å; W55-I419 HydrophobicContact CZ3-CD1 4.33Å; W55-I419 HydrophobicContact CZ3-CG2 3.71Å; L87-I419 HydrophobicContact CD1-CD1 3.33Å; T90-I419 HydrophobicContact CG2-CB 4.46Å; T90-I419 HydrophobicContact CG2-CD1 3.87Å; T90-I419 HydrophobicContact CG2-CG1 3.78Å; L91-I419 HydrophobicContact CD2-CB 4.18Å; L91-I419 HydrophobicContact CD2-CD1 3.87Å; L91-I419 HydrophobicContact CD2-CG2 4.25Å; L91-I419 HydrophobicContact CG-CD1 4.05Å; N397-I419 HydrophobicContact CB-CG2 4.32Å; L401-I419 HydrophobicContact CD1-CG2 4.32Å; Y406-I419 HydrophobicContact CD2-CG2 4.16Å; Y406-I419 HydrophobicContact CE2-CD1 3.79Å; Y406-I419 HydrophobicContact CE2-CG1 3.88Å; Y406-I419 HydrophobicContact CE2-CG2 4.2Å
420	G	78.6	Confident	71.8	Confident	10 Å²	10	80.6 Å²	80.6	10%	0.103	45%	0.445	C	S	.	.	S	Bend	trans	80.5	-172.2	-177.2	0	0	0	0	0	113	T396 P398	T396-G420 PolarHBondContact O-N 2.94Å; P398-G420 WeakPolarHBondContact CD-O 3.39Å; P398-G420 WeakPolarHBondContact CG-O 3.33Å
421	H	76.9	Confident	72.5	Confident	59 Å²	59	87 Å²	87	27%	0.273	46%	0.456	S	S	.	.	S	Bend	trans	-80.8	147.4	178.6	-69.1	-39.2	0	0	0	112.4	V394 C423	V394-H421 VanDerWaalsContact CG1-CE1 3.47Å; V394-H421 WeakPolarHBondContact CG1-CE1 3.28Å; V394-H421 WeakPolarHBondContact CG1-NE2 3.47Å; H421-C423 PolarHBondContact O-N 3.44Å
422	P	75.8	Confident	73.5	Confident	103 Å²	103	86 Å²	86	67%	0.669	45%	0.445	S	S	*	.			trans	-57.7	111.6	174.1	-25.4	35.2	0	0	0	112.2	Q424	P422-Q424 PolarHBondContact O-N 3.31Å
423	C	81.2	Confident	74.9	Confident	61 Å²	61	88.9 Å²	88.9	41%	0.412	45%	0.452	S	S	.	.			trans	-65.7	121.9	-176.3	-178.8	0	0	0	0	111.9	R338 H421 L425	R338-C423 PolarHBondContact NE-SG 3.48Å; R338-C423 VanDerWaalsContact NE-SG 3.36Å; H421-C423 PolarHBondContact O-N 3.44Å; C423-L425 PolarHBondContact O-N 3.49Å
424	Q	84.4	Confident	76.6	Confident	100 Å²	100	80.7 Å²	80.7	47%	0.467	41%	0.414	S	S	.	.			trans	-98.3	79.4	176.2	-67.2	-170.6	-7.9	0	0	108.9	R338 T339 D340 P422	R338-Q424 WeakPolarHBondContact CA-O 3.41Å; T339-Q424 PolarHBondContact N-O 2.92Å; T339-Q424 PolarHBondContact OG1-O 2.89Å; D340-Q424 HydrophobicContact CB-CB 4.25Å; D340-Q424 HydrophobicContact CB-CG 4.42Å; D340-Q424 PolarHBondContact OD1-N 2.75Å; P422-Q424 PolarHBondContact O-N 3.31Å
425	L	85.2	Confident	78.3	Confident	73 Å²	73	75.8 Å²	75.8	38%	0.382	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	126.9	-175.6	174.3	58.9	0	0	0	112.1	W115 R336 T337 R338 C423	W115-L425 HydrophobicContact CH2-CD1 4.23Å; W115-L425 HydrophobicContact CZ2-CD1 3.75Å; W115-L425 HydrophobicContact CZ2-CD2 4.4Å; R336-L425 HydrophobicContact CB-CD1 3.89Å; R336-L425 HydrophobicContact CG-CD1 4.42Å; T337-L425 WeakPolarHBondContact O-CA 3.26Å; R338-L425 HydrophobicContact CG-CD1 4.23Å; C423-L425 PolarHBondContact O-N 3.49Å
426	T	83.3	Confident	80.2	Confident	89 Å²	89	72.9 Å²	72.9	55%	0.546	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	143.7	158.9	59.6	0	0	0	0	110.1	R336 T337	R336-T426 WeakPolarHBondContact CA-O 3.49Å; T337-T426 PolarHBondContact N-O 3.26Å; T337-T426 PolarHBondContact O-N 3.24Å
427	T	82.8	Confident	81.6	Confident	72 Å²	72	66.9 Å²	66.9	44%	0.442	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	123.1	176.4	-58.2	0	0	0	0	109.2	I334 T335 R336	I334-T427 HydrophobicContact CG2-CG2 3.73Å; T335-T427 CarbonylContact O-C 3.58Å; T335-T427 WeakPolarHBondContact O-CA 3.46Å; R336-T427 HydrophobicContact CG-CG2 4.01Å
428	K	77.8	Confident	82.4	Confident	92 Å²	92	60.8 Å²	60.8	40%	0.4	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.1	167.9	-68	-164.8	178.8	-163.1	0	108.2	T335 G596	T335-K428 PolarHBondContact N-O 3.17Å; T335-K428 PolarHBondContact O-N 2.92Å; K428-G596 PolarHBondContact NZ-O 2.95Å
429	T	79.3	Confident	83	Confident	66 Å²	66	58.5 Å²	58.5	41%	0.405	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.3	172.6	-61.7	0	0	0	0	108.8	E332 L333 I334	E332-T429 HydrophobicContact CB-CG2 4.14Å; E332-T429 WeakPolarHBondContact OE2-CG2 3.3Å; L333-T429 WeakPolarHBondContact O-CA 3.48Å; I334-T429 HydrophobicContact CG1-CG2 4.14Å
430	Q	72.3	Confident	83.2	Confident	51 Å²	51	63.1 Å²	63.1	24%	0.238	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	134.6	172.7	-169	-178.6	5.6	0	0	108.8	E332 L333 L487	E332-Q430 WeakPolarHBondContact CA-O 3.49Å; L333-Q430 PolarHBondContact N-O 3.08Å; L333-Q430 PolarHBondContact O-N 3.1Å; Q430-L487 PolarHBondContact NE2-O 3.12Å
431	R	77.6	Confident	83.6	Confident	177 Å²	177	67 Å²	67	67%	0.668	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.1	175.3	-71.6	-176.3	166.4	119.3	7.6	110	E332	E332-R431 VanDerWaalsContact CD-NE 3.25Å; E332-R431 VanDerWaalsContact CD-NH2 3.32Å; E332-R431 HydrophobicContact CG-CG 4.1Å; E332-R431 IonicContact OE1-CZ 2.81Å; E332-R431 IonicContact OE1-NE 2.91Å; E332-R431 PolarHBondContact OE1-NE 3.29Å; E332-R431 IonicContact OE1-NH2 3.31Å; E332-R431 PolarHBondContact OE1-NH2 2.61Å; E332-R431 IonicContact OE2-CZ 2.81Å; E332-R431 IonicContact OE2-NE 3.21Å; E332-R431 IonicContact OE2-NH2 3.25Å; E332-R431 PolarHBondContact OE2-NH2 2.93Å; E332-R431 VanDerWaalsContact OE2-NH2 3.13Å
432	F	77.5	Confident	83.9	Confident	37 Å²	37	65.2 Å²	65.2	16%	0.162	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	167.6	174.7	61.8	-94.8	0	0	0	112.9	L293 V331 L333 A434 I485 P486	L293-F432 HydrophobicContact CD1-CZ 4.49Å; V331-F432 HydrophobicContact CB-CD2 3.96Å; V331-F432 HydrophobicContact CB-CE1 4.48Å; V331-F432 HydrophobicContact CB-CE2 3.79Å; V331-F432 HydrophobicContact CB-CG 4.38Å; V331-F432 HydrophobicContact CB-CZ 4.08Å; V331-F432 HydrophobicContact CG1-CD2 4.13Å; V331-F432 HydrophobicContact CG1-CE1 3.94Å; V331-F432 HydrophobicContact CG1-CE2 3.45Å; V331-F432 VanDerWaalsContact CG1-CE2 3.45Å; V331-F432 HydrophobicContact CG1-CZ 3.35Å; V331-F432 HydrophobicContact CG2-CE2 4.36Å; V331-F432 PolarHBondContact N-O 2.85Å; V331-F432 PolarHBondContact O-N 2.96Å; L333-F432 HydrophobicContact CB-CE1 4.19Å; F432-A434 HydrophobicContact CD2-CB 4.44Å; F432-A434 HydrophobicContact CE2-CB 4.37Å; F432-I485 HydrophobicContact CD2-CG2 4.03Å; F432-I485 HydrophobicContact CE2-CG2 3.67Å; F432-I485 HydrophobicContact CZ-CG2 4.21Å; F432-P486 HydrophobicContact CB-CG 4.27Å
433	K	84.2	Confident	84.3	Confident	125 Å²	125	63.9 Å²	63.9	54%	0.543	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	105.2	173.8	-63.7	-160.4	176	-149.3	0	109.5	A328 S329 P486	A328-K433 VanDerWaalsContact O-CA 3.3Å; A328-K433 WeakPolarHBondContact O-CA 3.45Å; S329-K433 WeakPolarHBondContact OG-CE 3.36Å; S329-K433 PolarHBondContact OG-NZ 2.98Å; K433-P486 VanDerWaalsContact O-CD 3.29Å; K433-P486 WeakPolarHBondContact O-CD 3.45Å; K433-P486 WeakPolarHBondContact O-CG 3.44Å
434	A	85.9	Confident	84.3	Confident	7 Å²	7	61.5 Å²	61.5	6%	0.058	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	158.4	174.8	0	0	0	0	0	110.8	A327 A328 F432 E484 I485	A327-A434 WeakPolarHBondContact CA-O 3.23Å; A328-A434 HydrophobicContact CB-CB 4.34Å; A328-A434 PolarHBondContact N-O 3.29Å; A328-A434 PolarHBondContact O-N 2.99Å; F432-A434 HydrophobicContact CD2-CB 4.44Å; F432-A434 HydrophobicContact CE2-CB 4.37Å; A434-E484 CarbonylContact C-O 3.6Å; A434-E484 WeakPolarHBondContact CA-O 3.49Å; A434-I485 HydrophobicContact CB-CG1 4.15Å
435	K	89.4	Confident	84.3	Confident	82 Å²	82	58.3 Å²	58.3	36%	0.357	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	141.7	171.2	-55.4	166	-165.5	157.8	0	109.3	Y326 W437 E484	Y326-K435 WeakPolarHBondContact O-CA 3.46Å; K435-W437 HydrophobicContact CB-CE3 4.3Å; K435-W437 HydrophobicContact CB-CH2 3.52Å; K435-W437 HydrophobicContact CB-CZ3 3.38Å; K435-W437 HydrophobicContact CD-CH2 3.79Å; K435-W437 HydrophobicContact CD-CZ3 4.47Å; K435-W437 HydrophobicContact CG-CH2 4.32Å; K435-E484 HydrophobicContact CB-CB 4.28Å; K435-E484 PolarHBondContact N-O 3.22Å; K435-E484 IonicContact NZ-OE1 3.28Å; K435-E484 PolarHBondContact NZ-OE1 3.23Å; K435-E484 PolarHBondContact O-N 3.23Å
436	L	91.3	Very high	84	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	138.9	-179.4	-63	173.1	0	0	0	109.7	F300 V325 Y326 L438 L475 I483	F300-L436 HydrophobicContact CD1-CD1 4.04Å; F300-L436 HydrophobicContact CE1-CD1 3.68Å; V325-L436 WeakPolarHBondContact CA-O 3.28Å; Y326-L436 PolarHBondContact N-O 3.01Å; Y326-L436 PolarHBondContact O-N 3.48Å; L436-L438 HydrophobicContact CB-CD2 4.28Å; L436-L438 HydrophobicContact CB-CG 4.34Å; L436-L475 HydrophobicContact CD1-CD2 4.12Å; L436-I483 HydrophobicContact CD2-CB 4.23Å; L436-I483 HydrophobicContact CD2-CD1 4.41Å; L436-I483 HydrophobicContact CD2-CG1 3.85Å; L436-I483 HydrophobicContact CD2-CG2 3.86Å
437	W	93.1	Very high	83.8	Confident	5 Å²	5	55.4 Å²	55.4	2%	0.019	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	107.7	173.2	-72	-111.5	0	0	0	107.3	E316 V318 A323 V325 K435 P480 V481 K482 E484	E316-W437 VanDerWaalsContact CD-NE1 3.26Å; E316-W437 PolarHBondContact OE2-NE1 3.11Å; V318-W437 HydrophobicContact CG2-CG 4.24Å; A323-W437 HydrophobicContact CB-CB 3.77Å; V325-W437 HydrophobicContact CG1-CD2 4.2Å; V325-W437 HydrophobicContact CG1-CZ2 4.08Å; K435-W437 HydrophobicContact CB-CE3 4.3Å; K435-W437 HydrophobicContact CB-CH2 3.52Å; K435-W437 HydrophobicContact CB-CZ3 3.38Å; K435-W437 HydrophobicContact CD-CH2 3.79Å; K435-W437 HydrophobicContact CD-CZ3 4.47Å; K435-W437 HydrophobicContact CG-CH2 4.32Å; W437-P480 CarbonylContact O-C 3.44Å; W437-P480 WeakPolarHBondContact O-CA 3.43Å; W437-V481 HydrophobicContact CB-CG2 3.99Å; W437-V481 PolarHBondContact O-N 3.45Å; W437-K482 HydrophobicContact CB-CB 3.88Å; W437-K482 HydrophobicContact CD2-CB 3.92Å; W437-K482 HydrophobicContact CD2-CD 3.7Å; W437-K482 HydrophobicContact CD2-CG 3.93Å; W437-K482 HydrophobicContact CE3-CB 3.85Å; W437-K482 HydrophobicContact CE3-CD 3.67Å; W437-K482 HydrophobicContact CE3-CG 3.55Å; W437-K482 HydrophobicContact CG-CB 3.94Å; W437-K482 HydrophobicContact CG-CD 4.33Å; W437-K482 HydrophobicContact CG-CG 4.46Å; W437-K482 HydrophobicContact CH2-CD 4.05Å; W437-K482 VanDerWaalsContact CH2-CE 3.5Å; W437-K482 HydrophobicContact CZ2-CD 4.04Å; W437-K482 HydrophobicContact CZ3-CD 3.83Å; W437-K482 HydrophobicContact CZ3-CG 3.93Å; W437-K482 PolarHBondContact N-O 3.49Å; W437-E484 HydrophobicContact CH2-CB 3.96Å; W437-E484 VanDerWaalsContact CH2-OE2 3.31Å; W437-E484 WeakPolarHBondContact CH2-OE2 3.33Å; W437-E484 HydrophobicContact CZ3-CB 3.63Å
438	L	91.6	Very high	83.7	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.8	-174	-55.8	179.7	0	0	0	110	A323 K324 Y326 L436 P476 F479 P480	A323-L438 CarbonylContact C-O 3.54Å; A323-L438 WeakPolarHBondContact CA-O 3.36Å; K324-L438 PolarHBondContact N-O 3.08Å; K324-L438 PolarHBondContact O-N 2.79Å; Y326-L438 HydrophobicContact CD2-CB 4.34Å; Y326-L438 HydrophobicContact CD2-CD1 3.71Å; Y326-L438 HydrophobicContact CD2-CG 4.02Å; Y326-L438 HydrophobicContact CE2-CB 4.16Å; Y326-L438 HydrophobicContact CE2-CD1 3.75Å; Y326-L438 HydrophobicContact CE2-CG 4.22Å; Y326-L438 HydrophobicContact CG-CD1 4.38Å; L436-L438 HydrophobicContact CB-CD2 4.28Å; L436-L438 HydrophobicContact CB-CG 4.34Å; L438-P476 HydrophobicContact CD1-CB 3.63Å; L438-P476 HydrophobicContact CD1-CG 3.73Å; L438-F479 WeakPolarHBondContact CA-O 3.37Å; L438-P480 HydrophobicContact CD2-CB 3.85Å
439	C	91.7	Very high	83.8	Confident	7 Å²	7	54.5 Å²	54.5	5%	0.047	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.5	176.7	-175.7	0	0	0	0	110.1	E322 A323 H442 G478 F479 V481	E322-C439 PolarHBondContact O-SG 2.88Å; A323-C439 HydrophobicContact CB-CB 4.42Å; C439-H442 HydrophobicContact CB-CB 4.19Å; C439-G478 CarbonylContact O-C 3.59Å; C439-G478 WeakPolarHBondContact O-CA 3.44Å; C439-F479 PolarHBondContact N-O 3.07Å; C439-F479 PolarHBondContact O-N 3.18Å; C439-V481 HydrophobicContact CB-CG1 3.89Å; C439-V481 HydrophobicContact CB-CG2 4.5Å
440	E	88.5	Confident	83.9	Confident	105 Å²	105	52.4 Å²	52.4	49%	0.491	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-25.5	-177.5	-73.4	168.3	179.2	0	0	113.4	K324	K324-E440 WeakPolarHBondContact CE-OE2 3.14Å; K324-E440 IonicContact NZ-OE1 2.68Å; K324-E440 PolarHBondContact NZ-OE1 2.94Å; K324-E440 IonicContact NZ-OE2 2.71Å; K324-E440 PolarHBondContact NZ-OE2 3.02Å
441	A	85.3	Confident	84.3	Confident	91 Å²	91	51 Å²	51	75%	0.752	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	27.7	-178.7	0	0	0	0	0	113
442	H	84.6	Confident	84.5	Confident	21 Å²	21	43 Å²	43	10%	0.097	24%	0.242	C	C	.	.			trans	-78.1	139	-178.5	-172.3	-99.9	0	0	0	111.4	C439 L444 F479 V481 L500	C439-H442 HydrophobicContact CB-CB 4.19Å; H442-L444 VanDerWaalsContact C-N 3.29Å; H442-L444 PolarHBondContact ND1-N 2.85Å; H442-L444 VanDerWaalsContact ND1-N 3.16Å; H442-L444 PolarHBondContact ND1-O 3.41Å; H442-L444 VanDerWaalsContact ND1-O 3.13Å; H442-L444 PolarHBondContact O-N 3.43Å; H442-F479 HydrophobicContact CB-CB 3.58Å; H442-F479 HydrophobicContact CB-CG 4.34Å; H442-F479 AromaticContact CD2-CD1 3.99Å; H442-F479 AromaticContact CE1-CD1 3.17Å; H442-F479 WeakPolarHBondContact CE1-CD1 3.36Å; H442-F479 AromaticContact CE1-CD2 3.84Å; H442-F479 AromaticContact CE1-CE1 3.39Å; H442-F479 WeakPolarHBondContact CE1-CE1 3.35Å; H442-F479 AromaticContact CE1-CG 3.42Å; H442-F479 VanDerWaalsContact CE1-CG 3.42Å; H442-F479 WeakPolarHBondContact CE1-CG 3.36Å; H442-F479 AromaticContact CE1-CZ 3.81Å; H442-F479 AromaticContact CG-CD1 3.89Å; H442-F479 AromaticContact CG-CG 3.75Å; H442-F479 WeakPolarHBondContact ND1-CB 3.47Å; H442-F479 AromaticContact ND1-CD1 3.4Å; H442-F479 WeakPolarHBondContact ND1-CD1 3.48Å; H442-F479 AromaticContact ND1-CD2 3.57Å; H442-F479 AromaticContact ND1-CG 3.14Å; H442-F479 WeakPolarHBondContact ND1-CG 3.17Å; H442-F479 AromaticContact NE2-CD1 3.54Å; H442-F479 AromaticContact NE2-CE1 3.84Å; H442-V481 VanDerWaalsContact CD2-CG1 3.44Å; H442-V481 WeakPolarHBondContact CD2-CG1 3.48Å; H442-L500 VanDerWaalsContact NE2-CD1 3.31Å; H442-L500 WeakPolarHBondContact NE2-CD1 3.28Å
443	P	82.9	Confident	84.5	Confident	75 Å²	75	41.6 Å²	41.6	49%	0.487	24%	0.236	S	C	.	.	S	Bend	trans	-71.6	-20.2	-175.5	29.3	-37	0	0	0	113.8	Y321 L500	Y321-P443 HydrophobicContact CE1-CG 4.42Å; P443-L500 HydrophobicContact CG-CD1 3.97Å
444	L	82.5	Confident	84.1	Confident	12 Å²	12	36.2 Å²	36.2	6%	0.063	21%	0.213	C	C	.	.	S	Bend	trans	-92.6	134.9	169.9	-54.9	-174.3	0	0	0	113	F162 V164 H442 F479 L500	F162-L444 HydrophobicContact CB-CD2 3.75Å; F162-L444 HydrophobicContact CD1-CD2 4.25Å; F162-L444 HydrophobicContact CD2-CD1 3.78Å; F162-L444 HydrophobicContact CD2-CD2 3.89Å; F162-L444 HydrophobicContact CE2-CD1 3.86Å; F162-L444 HydrophobicContact CG-CD1 4.44Å; F162-L444 HydrophobicContact CG-CD2 3.71Å; V164-L444 HydrophobicContact CB-CD1 4.17Å; V164-L444 HydrophobicContact CG1-CD1 4.43Å; V164-L444 HydrophobicContact CG2-CD1 4.25Å; H442-L444 VanDerWaalsContact C-N 3.29Å; H442-L444 PolarHBondContact ND1-N 2.85Å; H442-L444 VanDerWaalsContact ND1-N 3.16Å; H442-L444 PolarHBondContact ND1-O 3.41Å; H442-L444 VanDerWaalsContact ND1-O 3.13Å; H442-L444 PolarHBondContact O-N 3.43Å; L444-F479 HydrophobicContact CB-CD2 4.06Å; L444-F479 HydrophobicContact CB-CE2 3.77Å; L444-F479 HydrophobicContact CB-CZ 4.37Å; L444-F479 HydrophobicContact CD1-CE2 4.45Å; L444-F479 HydrophobicContact CD1-CZ 4.38Å; L444-F479 WeakPolarHBondContact O-CD2 3.3Å; L444-L500 HydrophobicContact CD1-CD2 3.42Å; L444-L500 VanDerWaalsContact CD1-CD2 3.42Å; L444-L500 HydrophobicContact CD2-CD2 4.18Å; L444-L500 HydrophobicContact CG-CD2 3.56Å
445	S	82.9	Confident	83.6	Confident	32 Å²	32	37.1 Å²	37.1	22%	0.224	22%	0.217	C	C	.	.			trans	-93.8	114.6	171.7	177.1	0	0	0	0	110.3	A447 E448 Q449 V450	S445-A447 VanDerWaalsContact C-N 3.26Å; S445-A447 PolarHBondContact O-N 2.93Å; S445-E448 WeakPolarHBondContact CB-OE2 3.47Å; S445-E448 PolarHBondContact O-N 3.38Å; S445-E448 WeakPolarHBondContact OG-CB 3.34Å; S445-E448 WeakPolarHBondContact OG-CG 3.33Å; S445-E448 PolarHBondContact OG-N 2.86Å; S445-E448 PolarHBondContact OG-OE2 2.85Å; S445-Q449 PolarHBondContact O-N 3.28Å; S445-V450 PolarHBondContact O-N 3.22Å
446	L	80	Confident	82.7	Confident	29 Å²	29	34.3 Å²	34.3	15%	0.152	21%	0.205	C	C	.	.	I	π-helix	trans	-56.8	-42.4	179.2	-177.4	67.6	0	0	0	111.3	V450 V451 I471 L475 F479 P480	L446-V450 HydrophobicContact CD1-CB 4.17Å; L446-V450 HydrophobicContact CD1-CG1 4.18Å; L446-V450 PolarHBondContact O-N 2.84Å; L446-V451 WeakPolarHBondContact O-CG2 3.34Å; L446-V451 PolarHBondContact O-N 2.6Å; L446-I471 HydrophobicContact CD1-CB 4.5Å; L446-I471 HydrophobicContact CD1-CG2 4.41Å; L446-I471 HydrophobicContact CD2-CB 4.23Å; L446-L475 HydrophobicContact CD2-CD1 3.75Å; L446-F479 HydrophobicContact CB-CD2 4.12Å; L446-F479 HydrophobicContact CB-CE2 4.49Å; L446-F479 HydrophobicContact CD1-CE2 4.49Å; L446-P480 HydrophobicContact CD1-CG 4.42Å; L446-P480 HydrophobicContact CD2-CG 4.43Å
447	A	78.4	Confident	81.6	Confident	73 Å²	73	35.9 Å²	35.9	60%	0.603	21%	0.213	S	C	*	.	I	π-helix	trans	-78	-33.6	-175.1	0	0	0	0	0	114	S445	S445-A447 VanDerWaalsContact C-N 3.26Å; S445-A447 PolarHBondContact O-N 2.93Å
448	E	80.6	Confident	80.4	Confident	137 Å²	137	36.3 Å²	36.3	64%	0.64	22%	0.218	S	C	*	.	I	π-helix	trans	-97.6	-30.4	-171.7	-63.1	163.6	133.5	0	0	113.1	S445 P452	S445-E448 WeakPolarHBondContact CB-OE2 3.47Å; S445-E448 PolarHBondContact O-N 3.38Å; S445-E448 WeakPolarHBondContact OG-CB 3.34Å; S445-E448 WeakPolarHBondContact OG-CG 3.33Å; S445-E448 PolarHBondContact OG-N 2.86Å; S445-E448 PolarHBondContact OG-OE2 2.85Å; E448-P452 WeakPolarHBondContact O-CG 3.44Å
449	Q	81.2	Confident	79	Confident	8 Å²	8	38.8 Å²	38.8	4%	0.037	23%	0.231	C	C	.	.	I	π-helix	trans	-110.1	-43.3	-175.6	-65.2	158.1	-15.3	0	0	112.3	A159 F162 S445 I453	A159-Q449 HydrophobicContact CB-CG 4.43Å; F162-Q449 HydrophobicContact CD1-CB 4.43Å; F162-Q449 HydrophobicContact CE1-CB 3.89Å; S445-Q449 PolarHBondContact O-N 3.28Å; Q449-I453 WeakPolarHBondContact O-CD1 3.38Å
450	V	80.4	Confident	77.2	Confident	22 Å²	22	41.9 Å²	41.9	13%	0.133	25%	0.252	C	S	.	.	I	π-helix	trans	-88.2	-39	-172	-175.9	0	0	0	0	112.7	S445 L446 I453 I454 F479	S445-V450 PolarHBondContact O-N 3.22Å; L446-V450 HydrophobicContact CD1-CB 4.17Å; L446-V450 HydrophobicContact CD1-CG1 4.18Å; L446-V450 PolarHBondContact O-N 2.84Å; V450-I453 PolarHBondContact O-N 3.44Å; V450-I453 VanDerWaalsContact O-N 3.14Å; V450-I454 HydrophobicContact CG1-CD1 3.7Å; V450-I454 HydrophobicContact CG1-CG1 4.25Å; V450-I454 PolarHBondContact O-N 3.38Å; V450-F479 HydrophobicContact CG2-CE2 3.95Å
451	V	80.7	Confident	75.6	Confident	22 Å²	22	39.2 Å²	39.2	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-55.6	-45.9	174.8	163.1	0	0	0	0	112.7	L446 I453 I454 D455 I471	L446-V451 WeakPolarHBondContact O-CG2 3.34Å; L446-V451 PolarHBondContact O-N 2.6Å; V451-I453 VanDerWaalsContact C-N 3.31Å; V451-I453 PolarHBondContact O-N 2.89Å; V451-I454 CarbonylContact O-C 3.57Å; V451-I454 PolarHBondContact O-N 2.97Å; V451-D455 PolarHBondContact O-N 2.72Å; V451-I471 HydrophobicContact CG2-CD1 3.61Å; V451-I471 HydrophobicContact CG2-CG1 3.98Å
452	P	81.3	Confident	74.2	Confident	8 Å²	8	37 Å²	37	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-57.9	-37.2	174.4	-29.8	37.8	0	0	0	114.9	L152 R155 L156 E448 D455 L456	L152-P452 WeakPolarHBondContact CD1-O 3.36Å; R155-P452 HydrophobicContact CB-CB 3.9Å; R155-P452 HydrophobicContact CB-CG 4.1Å; L156-P452 HydrophobicContact CD2-CB 4.4Å; E448-P452 WeakPolarHBondContact O-CG 3.44Å; P452-D455 WeakPolarHBondContact O-CB 3.5Å; P452-D455 PolarHBondContact O-N 2.78Å; P452-L456 PolarHBondContact O-N 3.36Å
453	I	77.1	Confident	72.8	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.041	24%	0.236	C	C	.	.	H	α-helix	trans	-71.2	-38.5	178.2	-71.3	165.2	0	0	0	110.5	L156 F162 K190 L195 Q449 V450 V451 L456 M457	L156-I453 HydrophobicContact CD2-CG1 3.82Å; F162-I453 HydrophobicContact CE1-CD1 3.69Å; F162-I453 HydrophobicContact CZ-CD1 3.42Å; F162-I453 VanDerWaalsContact CZ-CD1 3.42Å; K190-I453 HydrophobicContact CB-CD1 4Å; K190-I453 HydrophobicContact CG-CD1 4.02Å; L195-I453 HydrophobicContact CD1-CD1 3.92Å; L195-I453 HydrophobicContact CD1-CG1 3.99Å; L195-I453 HydrophobicContact CD1-CG2 3.98Å; L195-I453 HydrophobicContact CD2-CG1 4.43Å; L195-I453 HydrophobicContact CD2-CG2 3.75Å; Q449-I453 WeakPolarHBondContact O-CD1 3.38Å; V450-I453 PolarHBondContact O-N 3.44Å; V450-I453 VanDerWaalsContact O-N 3.14Å; V451-I453 VanDerWaalsContact C-N 3.31Å; V451-I453 PolarHBondContact O-N 2.89Å; I453-L456 WeakPolarHBondContact O-CB 3.18Å; I453-L456 PolarHBondContact O-N 2.83Å; I453-M457 HydrophobicContact CG2-CE 3.66Å; I453-M457 WeakPolarHBondContact O-CE 3.49Å; I453-M457 PolarHBondContact O-N 3.23Å; I453-M457 VanDerWaalsContact O-N 3.17Å
454	I	76.2	Confident	71.8	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.062	22%	0.222	C	C	.	.	H	α-helix	trans	-72	-33	175	-68.7	175.8	0	0	0	111.1	V450 V451 M457 A458 F464 L467 R468 I471	V450-I454 HydrophobicContact CG1-CD1 3.7Å; V450-I454 HydrophobicContact CG1-CG1 4.25Å; V450-I454 PolarHBondContact O-N 3.38Å; V451-I454 CarbonylContact O-C 3.57Å; V451-I454 PolarHBondContact O-N 2.97Å; I454-M457 HydrophobicContact CG1-CE 4.07Å; I454-M457 PolarHBondContact O-N 3.43Å; I454-A458 WeakPolarHBondContact O-CB 3.34Å; I454-A458 PolarHBondContact O-N 2.84Å; I454-F464 HydrophobicContact CG1-CD1 4.34Å; I454-F464 HydrophobicContact CG2-CD1 4.32Å; I454-F464 WeakPolarHBondContact CG2-O 3.36Å; I454-L467 HydrophobicContact CD1-CD2 3.79Å; I454-L467 HydrophobicContact CD1-CG 4.13Å; I454-L467 HydrophobicContact CG1-CD2 4.45Å; I454-L467 HydrophobicContact CG2-CB 4.5Å; I454-L467 HydrophobicContact CG2-CG 4.49Å; I454-R468 HydrophobicContact CG2-CB 3.85Å; I454-I471 HydrophobicContact CB-CD1 4.29Å; I454-I471 HydrophobicContact CD1-CD1 3.53Å; I454-I471 HydrophobicContact CG1-CD1 4.48Å; I454-I471 HydrophobicContact CG2-CD1 4.18Å
455	D	75.2	Confident	71	Confident	25 Å²	25	38.3 Å²	38.3	13%	0.134	23%	0.228	C	C	.	.	H	α-helix	trans	-59.5	-43.9	169	-81.5	-32.1	0	0	0	111.6	L152 R155 V451 P452 A458 I459 R468	L152-D455 HydrophobicContact CD1-CB 4.33Å; R155-D455 IonicContact CZ-OD2 3.49Å; R155-D455 IonicContact NH1-OD2 3.51Å; R155-D455 PolarHBondContact NH1-OD2 2.75Å; V451-D455 PolarHBondContact O-N 2.72Å; P452-D455 WeakPolarHBondContact O-CB 3.5Å; P452-D455 PolarHBondContact O-N 2.78Å; D455-A458 PolarHBondContact O-N 2.83Å; D455-I459 WeakPolarHBondContact O-CG1 3.4Å; D455-I459 PolarHBondContact O-N 2.84Å; D455-R468 WeakPolarHBondContact OD1-CD 3.36Å
456	L	71.4	Confident	70	Confident	23 Å²	23	41.2 Å²	41.2	12%	0.12	24%	0.236	C	C	.	.	H	α-helix	trans	-56.6	-51.9	174	170.1	53.6	0	0	0	111.4	L152 L156 L195 F218 P452 I453 A458 I459	L152-L456 HydrophobicContact CD1-CB 4Å; L152-L456 HydrophobicContact CD2-CB 3.67Å; L152-L456 HydrophobicContact CD2-CD1 3.68Å; L152-L456 HydrophobicContact CD2-CG 4.2Å; L152-L456 HydrophobicContact CG-CB 4.29Å; L156-L456 HydrophobicContact CD1-CD2 4.28Å; L195-L456 HydrophobicContact CD2-CD2 3.68Å; F218-L456 HydrophobicContact CB-CD2 3.99Å; F218-L456 HydrophobicContact CD1-CD2 3.84Å; F218-L456 HydrophobicContact CD2-CD1 3.56Å; F218-L456 HydrophobicContact CD2-CD2 3.77Å; F218-L456 HydrophobicContact CD2-CG 4.31Å; F218-L456 HydrophobicContact CE1-CD2 4.23Å; F218-L456 HydrophobicContact CE2-CD1 3.47Å; F218-L456 VanDerWaalsContact CE2-CD1 3.47Å; F218-L456 HydrophobicContact CE2-CD2 4.17Å; F218-L456 HydrophobicContact CG-CD1 4.27Å; F218-L456 HydrophobicContact CG-CD2 3.59Å; F218-L456 HydrophobicContact CZ-CD1 4.11Å; F218-L456 HydrophobicContact CZ-CD2 4.38Å; P452-L456 PolarHBondContact O-N 3.36Å; I453-L456 WeakPolarHBondContact O-CB 3.18Å; I453-L456 PolarHBondContact O-N 2.83Å; L456-A458 VanDerWaalsContact C-N 3.34Å; L456-A458 PolarHBondContact O-N 3.14Å; L456-I459 WeakPolarHBondContact O-CB 3.25Å; L456-I459 PolarHBondContact O-N 2.89Å
457	M	67.8	Low	69.1	Low	36 Å²	36	42.8 Å²	42.8	18%	0.177	24%	0.244	C	C	.	.	H	α-helix	trans	-71	-31.2	-177.4	-63.9	-178.6	-70.1	0	0	112.2	V197 I453 I454 I459 S460 N461 F464	V197-M457 HydrophobicContact CG2-SD 4.47Å; I453-M457 HydrophobicContact CG2-CE 3.66Å; I453-M457 WeakPolarHBondContact O-CE 3.49Å; I453-M457 PolarHBondContact O-N 3.23Å; I453-M457 VanDerWaalsContact O-N 3.17Å; I454-M457 HydrophobicContact CG1-CE 4.07Å; I454-M457 PolarHBondContact O-N 3.43Å; M457-I459 VanDerWaalsContact C-N 3.25Å; M457-I459 PolarHBondContact O-N 3.19Å; M457-S460 PolarHBondContact O-N 2.86Å; M457-S460 PolarHBondContact O-OG 2.95Å; M457-N461 PolarHBondContact O-N 3.33Å; M457-F464 HydrophobicContact CB-CB 3.73Å; M457-F464 HydrophobicContact CB-CD1 3.85Å; M457-F464 HydrophobicContact CB-CD2 3.62Å; M457-F464 HydrophobicContact CB-CE1 4.37Å; M457-F464 HydrophobicContact CB-CE2 4.15Å; M457-F464 HydrophobicContact CB-CG 3.44Å; M457-F464 VanDerWaalsContact CB-CG 3.44Å; M457-F464 HydrophobicContact CB-CZ 4.5Å; M457-F464 HydrophobicContact CE-CD1 3.62Å; M457-F464 HydrophobicContact CE-CE1 3.34Å; M457-F464 HydrophobicContact CE-CG 4.39Å; M457-F464 HydrophobicContact CE-CZ 3.89Å; M457-F464 HydrophobicContact SD-CD1 4.17Å; M457-F464 HydrophobicContact SD-CD2 4.42Å; M457-F464 HydrophobicContact SD-CE1 3.75Å; M457-F464 HydrophobicContact SD-CE2 4Å; M457-F464 HydrophobicContact SD-CG 4.49Å; M457-F464 HydrophobicContact SD-CZ 3.64Å
458	A	67.4	Low	68.9	Low	15 Å²	15	42.9 Å²	42.9	12%	0.124	23%	0.229	C	C	.	.	H	α-helix	trans	-64.9	-25.1	176.9	0	0	0	0	0	113.7	I454 D455 L456 S460 F464 A465	I454-A458 WeakPolarHBondContact O-CB 3.34Å; I454-A458 PolarHBondContact O-N 2.84Å; D455-A458 PolarHBondContact O-N 2.83Å; L456-A458 VanDerWaalsContact C-N 3.34Å; L456-A458 PolarHBondContact O-N 3.14Å; A458-S460 VanDerWaalsContact C-N 3.26Å; A458-S460 PolarHBondContact O-N 3.36Å; A458-F464 HydrophobicContact CB-CB 4.19Å; A458-A465 HydrophobicContact CB-CB 4.03Å
459	I	63.7	Low	68.3	Low	53 Å²	53	39.9 Å²	39.9	27%	0.272	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-30.3	175.4	-73.9	164.8	0	0	0	111.8	R145 L152 D455 L456 M457	R145-I459 HydrophobicContact CB-CG2 3.48Å; R145-I459 VanDerWaalsContact CB-CG2 3.48Å; R145-I459 HydrophobicContact CG-CG2 3.38Å; L152-I459 HydrophobicContact CD2-CD1 3.74Å; D455-I459 WeakPolarHBondContact O-CG1 3.4Å; D455-I459 PolarHBondContact O-N 2.84Å; L456-I459 WeakPolarHBondContact O-CB 3.25Å; L456-I459 PolarHBondContact O-N 2.89Å; M457-I459 VanDerWaalsContact C-N 3.25Å; M457-I459 PolarHBondContact O-N 3.19Å
460	S	52.2	Low	67.7	Low	72 Å²	72	41.4 Å²	41.4	50%	0.503	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-15.2	-178.8	46.4	0	0	0	0	114.8	M457 A458	M457-S460 PolarHBondContact O-N 2.86Å; M457-S460 PolarHBondContact O-OG 2.95Å; A458-S460 VanDerWaalsContact C-N 3.26Å; A458-S460 PolarHBondContact O-N 3.36Å
461	N	55	Low	67	Low	50 Å²	50	41.4 Å²	41.4	27%	0.267	22%	0.223	S	C	.	.			trans	-140.7	123.2	-173.1	-176.2	-44.7	0	0	0	112.2	M457 L463 F464 A465	M457-N461 PolarHBondContact O-N 3.33Å; N461-L463 VanDerWaalsContact C-N 3.29Å; N461-L463 PolarHBondContact O-N 3.02Å; N461-L463 WeakPolarHBondContact OD1-CB 3.34Å; N461-L463 PolarHBondContact OD1-N 2.85Å; N461-F464 HydrophobicContact CB-CD2 4.06Å; N461-F464 PolarHBondContact O-N 3.47Å; N461-F464 VanDerWaalsContact O-N 3.17Å; N461-A465 PolarHBondContact O-N 3.05Å
462	A	56.8	Low	66.2	Low	45 Å²	45	44.4 Å²	44.4	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-66	-22.8	-176.8	0	0	0	0	0	114.5	A465 K466	A462-A465 PolarHBondContact O-N 3.13Å; A462-K466 WeakPolarHBondContact O-CG 3.39Å; A462-K466 PolarHBondContact O-N 3.26Å
463	L	55.9	Low	65.6	Low	67 Å²	67	46 Å²	46	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-70	-40.3	172.5	-62.5	-166.6	0	0	0	111.7	N461 A465 K466 L467 L584 I588	N461-L463 VanDerWaalsContact C-N 3.29Å; N461-L463 PolarHBondContact O-N 3.02Å; N461-L463 WeakPolarHBondContact OD1-CB 3.34Å; N461-L463 PolarHBondContact OD1-N 2.85Å; L463-A465 VanDerWaalsContact C-N 3.28Å; L463-A465 PolarHBondContact O-N 2.87Å; L463-K466 PolarHBondContact O-N 3.5Å; L463-L467 WeakPolarHBondContact O-CB 3.32Å; L463-L467 PolarHBondContact O-N 3.03Å; L463-L584 HydrophobicContact CD1-CD1 4.07Å; L463-L584 HydrophobicContact CD1-CD2 3.72Å; L463-L584 HydrophobicContact CD1-CG 4.12Å; L463-L584 HydrophobicContact CG-CD2 4.05Å; L463-I588 HydrophobicContact CD1-CD1 4.3Å; L463-I588 HydrophobicContact CD2-CD1 3.76Å
464	F	62.1	Low	65.1	Low	47 Å²	47	57 Å²	57	21%	0.206	29%	0.29	C	S	.	.	H	α-helix	trans	-68.9	-29.4	175	-76.6	-75.7	0	0	0	111.9	I454 M457 A458 N461 L467 R468	I454-F464 HydrophobicContact CG1-CD1 4.34Å; I454-F464 HydrophobicContact CG2-CD1 4.32Å; I454-F464 WeakPolarHBondContact CG2-O 3.36Å; M457-F464 HydrophobicContact CB-CB 3.73Å; M457-F464 HydrophobicContact CB-CD1 3.85Å; M457-F464 HydrophobicContact CB-CD2 3.62Å; M457-F464 HydrophobicContact CB-CE1 4.37Å; M457-F464 HydrophobicContact CB-CE2 4.15Å; M457-F464 HydrophobicContact CB-CG 3.44Å; M457-F464 VanDerWaalsContact CB-CG 3.44Å; M457-F464 HydrophobicContact CB-CZ 4.5Å; M457-F464 HydrophobicContact CE-CD1 3.62Å; M457-F464 HydrophobicContact CE-CE1 3.34Å; M457-F464 HydrophobicContact CE-CG 4.39Å; M457-F464 HydrophobicContact CE-CZ 3.89Å; M457-F464 HydrophobicContact SD-CD1 4.17Å; M457-F464 HydrophobicContact SD-CD2 4.42Å; M457-F464 HydrophobicContact SD-CE1 3.75Å; M457-F464 HydrophobicContact SD-CE2 4Å; M457-F464 HydrophobicContact SD-CG 4.49Å; M457-F464 HydrophobicContact SD-CZ 3.64Å; A458-F464 HydrophobicContact CB-CB 4.19Å; N461-F464 HydrophobicContact CB-CD2 4.06Å; N461-F464 PolarHBondContact O-N 3.47Å; N461-F464 VanDerWaalsContact O-N 3.17Å; F464-L467 HydrophobicContact CD1-CD2 3.99Å; F464-L467 HydrophobicContact CE1-CD2 4.13Å; F464-L467 PolarHBondContact O-N 3.16Å; F464-R468 WeakPolarHBondContact O-CB 3.22Å; F464-R468 PolarHBondContact O-N 3.1Å
465	A	63.8	Low	65.2	Low	21 Å²	21	58 Å²	58	17%	0.174	30%	0.295	C	S	.	.	H	α-helix	trans	-64.1	-47.6	167.5	0	0	0	0	0	112.1	A458 N461 A462 L463 L467 R468 D469	A458-A465 HydrophobicContact CB-CB 4.03Å; N461-A465 PolarHBondContact O-N 3.05Å; A462-A465 PolarHBondContact O-N 3.13Å; L463-A465 VanDerWaalsContact C-N 3.28Å; L463-A465 PolarHBondContact O-N 2.87Å; A465-L467 VanDerWaalsContact C-N 3.29Å; A465-L467 PolarHBondContact O-N 2.86Å; A465-R468 WeakPolarHBondContact O-CB 3.31Å; A465-R468 PolarHBondContact O-N 2.97Å; A465-D469 PolarHBondContact O-N 2.99Å
466	K	62.2	Low	65.6	Low	93 Å²	93	57.7 Å²	57.7	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-62.6	-34.9	174.5	-69	178.6	-170.4	-173.8	0	112.5	T291 A462 L463 D469 F470	T291-K466 PolarHBondContact O-NZ 2.93Å; A462-K466 WeakPolarHBondContact O-CG 3.39Å; A462-K466 PolarHBondContact O-N 3.26Å; L463-K466 PolarHBondContact O-N 3.5Å; K466-D469 PolarHBondContact O-N 3.04Å; K466-F470 WeakPolarHBondContact O-CB 3.31Å; K466-F470 PolarHBondContact O-N 2.64Å
467	L	62.8	Low	66.2	Low	62 Å²	62	60.6 Å²	60.6	33%	0.325	32%	0.315	S	S	.	.	H	α-helix	trans	-69.5	-43.1	176	-176.7	61.7	0	0	0	111.6	I454 L463 F464 A465 D469 F470 I471	I454-L467 HydrophobicContact CD1-CD2 3.79Å; I454-L467 HydrophobicContact CD1-CG 4.13Å; I454-L467 HydrophobicContact CG1-CD2 4.45Å; I454-L467 HydrophobicContact CG2-CB 4.5Å; I454-L467 HydrophobicContact CG2-CG 4.49Å; L463-L467 WeakPolarHBondContact O-CB 3.32Å; L463-L467 PolarHBondContact O-N 3.03Å; F464-L467 HydrophobicContact CD1-CD2 3.99Å; F464-L467 HydrophobicContact CE1-CD2 4.13Å; F464-L467 PolarHBondContact O-N 3.16Å; A465-L467 VanDerWaalsContact C-N 3.29Å; A465-L467 PolarHBondContact O-N 2.86Å; L467-D469 VanDerWaalsContact C-N 3.31Å; L467-D469 PolarHBondContact O-N 3.33Å; L467-F470 PolarHBondContact O-N 3.22Å; L467-I471 HydrophobicContact CD1-CG2 4.26Å; L467-I471 WeakPolarHBondContact O-CG1 3.23Å; L467-I471 PolarHBondContact O-N 3.23Å
468	R	72.7	Confident	67	Low	75 Å²	75	60.3 Å²	60.3	28%	0.283	32%	0.321	S	S	.	.	H	α-helix	trans	-54.2	-49.7	169.6	-176.7	-161	62	-144.7	-9.7	110.4	I454 D455 F464 A465 F470 I471 T472	I454-R468 HydrophobicContact CG2-CB 3.85Å; D455-R468 WeakPolarHBondContact OD1-CD 3.36Å; F464-R468 WeakPolarHBondContact O-CB 3.22Å; F464-R468 PolarHBondContact O-N 3.1Å; A465-R468 WeakPolarHBondContact O-CB 3.31Å; A465-R468 PolarHBondContact O-N 2.97Å; R468-F470 PolarHBondContact O-N 3.28Å; R468-I471 WeakPolarHBondContact O-CG1 3.44Å; R468-I471 PolarHBondContact O-N 3.28Å; R468-T472 HydrophobicContact CG-CG2 4.24Å; R468-T472 WeakPolarHBondContact O-CB 3.15Å; R468-T472 VanDerWaalsContact O-CG2 3.29Å; R468-T472 WeakPolarHBondContact O-CG2 3.47Å; R468-T472 PolarHBondContact O-N 3.45Å; R468-T472 PolarHBondContact O-OG1 2.88Å
469	D	69.4	Low	68	Low	73 Å²	73	59.9 Å²	59.9	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-66.4	-28.9	-176.8	-62.3	-14	0	0	0	111.3	A465 K466 L467 T472 L473	A465-D469 PolarHBondContact O-N 2.99Å; K466-D469 PolarHBondContact O-N 3.04Å; L467-D469 VanDerWaalsContact C-N 3.31Å; L467-D469 PolarHBondContact O-N 3.33Å; D469-T472 PolarHBondContact O-OG1 3Å; D469-L473 WeakPolarHBondContact O-CD2 3.27Å; D469-L473 WeakPolarHBondContact O-CG 3.48Å
470	F	66.7	Low	69.2	Low	41 Å²	41	57.8 Å²	57.8	18%	0.18	31%	0.306	C	S	.	.	H	α-helix	trans	-73.8	-46	170.4	179.3	-100	0	0	0	114.2	L293 K466 L467 R468 T472 L473 L475	L293-F470 HydrophobicContact CD2-CD2 3.91Å; K466-F470 WeakPolarHBondContact O-CB 3.31Å; K466-F470 PolarHBondContact O-N 2.64Å; L467-F470 PolarHBondContact O-N 3.22Å; R468-F470 PolarHBondContact O-N 3.28Å; F470-T472 VanDerWaalsContact C-N 3.31Å; F470-T472 PolarHBondContact O-N 3.05Å; F470-L473 HydrophobicContact CD2-CD1 3.94Å; F470-L473 HydrophobicContact CE2-CD1 4.47Å; F470-L473 VanDerWaalsContact O-CB 3.24Å; F470-L473 WeakPolarHBondContact O-CB 3.47Å; F470-L473 VanDerWaalsContact O-CG 3.24Å; F470-L473 WeakPolarHBondContact O-CG 3.34Å; F470-L473 PolarHBondContact O-N 2.89Å; F470-L475 HydrophobicContact CE1-CD2 4.47Å; F470-L475 HydrophobicContact CZ-CD2 4.42Å
471	I	65.8	Low	71.1	Confident	21 Å²	21	54.4 Å²	54.4	11%	0.108	28%	0.283	C	S	.	.	H	α-helix	trans	-74.9	-20.3	-179.2	66.4	-173.8	0	0	0	113.4	L446 V451 I454 L467 R468 L473	L446-I471 HydrophobicContact CD1-CB 4.5Å; L446-I471 HydrophobicContact CD1-CG2 4.41Å; L446-I471 HydrophobicContact CD2-CB 4.23Å; V451-I471 HydrophobicContact CG2-CD1 3.61Å; V451-I471 HydrophobicContact CG2-CG1 3.98Å; I454-I471 HydrophobicContact CB-CD1 4.29Å; I454-I471 HydrophobicContact CD1-CD1 3.53Å; I454-I471 HydrophobicContact CG1-CD1 4.48Å; I454-I471 HydrophobicContact CG2-CD1 4.18Å; L467-I471 HydrophobicContact CD1-CG2 4.26Å; L467-I471 WeakPolarHBondContact O-CG1 3.23Å; L467-I471 PolarHBondContact O-N 3.23Å; R468-I471 WeakPolarHBondContact O-CG1 3.44Å; R468-I471 PolarHBondContact O-N 3.28Å; I471-L473 VanDerWaalsContact C-N 3.33Å
472	T	65.6	Low	72.8	Confident	85 Å²	85	53 Å²	53	52%	0.521	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.3	171.9	57.1	0	0	0	0	113.2	R468 D469 F470	R468-T472 HydrophobicContact CG-CG2 4.24Å; R468-T472 WeakPolarHBondContact O-CB 3.15Å; R468-T472 VanDerWaalsContact O-CG2 3.29Å; R468-T472 WeakPolarHBondContact O-CG2 3.47Å; R468-T472 PolarHBondContact O-N 3.45Å; R468-T472 PolarHBondContact O-OG1 2.88Å; D469-T472 PolarHBondContact O-OG1 3Å; F470-T472 VanDerWaalsContact C-N 3.31Å; F470-T472 PolarHBondContact O-N 3.05Å
473	L	67.3	Low	74.3	Confident	41 Å²	41	51.8 Å²	51.8	22%	0.215	26%	0.261	C	S	.	.	S	Bend	trans	-62	164.6	160.1	-57.3	179.7	0	0	0	110.3	T295 I298 D469 F470 I471 L475	T295-L473 HydrophobicContact CG2-CD1 3.66Å; T295-L473 HydrophobicContact CG2-CD2 3.88Å; T295-L473 HydrophobicContact CG2-CG 4.31Å; I298-L473 HydrophobicContact CD1-CD1 4.2Å; D469-L473 WeakPolarHBondContact O-CD2 3.27Å; D469-L473 WeakPolarHBondContact O-CG 3.48Å; F470-L473 HydrophobicContact CD2-CD1 3.94Å; F470-L473 HydrophobicContact CE2-CD1 4.47Å; F470-L473 VanDerWaalsContact O-CB 3.24Å; F470-L473 WeakPolarHBondContact O-CB 3.47Å; F470-L473 VanDerWaalsContact O-CG 3.24Å; F470-L473 WeakPolarHBondContact O-CG 3.34Å; F470-L473 PolarHBondContact O-N 2.89Å; I471-L473 VanDerWaalsContact C-N 3.33Å; L473-L475 PolarHBondContact O-N 3.03Å
474	R	68.1	Low	75.8	Confident	239 Å²	239	49.7 Å²	49.7	90%	0.902	25%	0.25	S	C	*	.			trans	-75.7	68.2	172.6	-65.5	-173.3	176.4	-165.7	-2	111.2	F300	F300-R474 WeakPolarHBondContact CE2-O 3.41Å
475	L	77.6	Confident	76.6	Confident	33 Å²	33	49.8 Å²	49.8	17%	0.173	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-53.6	145.6	160.1	-66.1	175.6	0	0	0	109.1	F300 L436 L446 F470 L473	F300-L475 HydrophobicContact CE1-CD2 4.09Å; F300-L475 HydrophobicContact CZ-CD2 3.85Å; L436-L475 HydrophobicContact CD1-CD2 4.12Å; L446-L475 HydrophobicContact CD2-CD1 3.75Å; F470-L475 HydrophobicContact CE1-CD2 4.47Å; F470-L475 HydrophobicContact CZ-CD2 4.42Å; L473-L475 PolarHBondContact O-N 3.03Å
476	P	83.4	Confident	77.1	Confident	19 Å²	19	50.5 Å²	50.5	12%	0.123	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-59.4	160.4	167.6	-15	26.5	0	0	0	111.2	F300 Y326 L438	F300-P476 HydrophobicContact CB-CG 3.74Å; F300-P476 HydrophobicContact CD1-CG 4.32Å; F300-P476 HydrophobicContact CD2-CG 4.3Å; F300-P476 HydrophobicContact CG-CG 3.87Å; Y326-P476 HydrophobicContact CD1-CB 4.31Å; Y326-P476 HydrophobicContact CD1-CG 3.76Å; Y326-P476 HydrophobicContact CE1-CB 3.64Å; Y326-P476 HydrophobicContact CE1-CG 3.58Å; Y326-P476 HydrophobicContact CE2-CB 4.19Å; Y326-P476 HydrophobicContact CE2-CG 4.47Å; Y326-P476 HydrophobicContact CG-CG 4.26Å; L438-P476 HydrophobicContact CD1-CB 3.63Å; L438-P476 HydrophobicContact CD1-CG 3.73Å
477	P	83.9	Confident	77.1	Confident	85 Å²	85	48.6 Å²	48.6	55%	0.552	25%	0.249	S	C	*	.	S	Bend	trans	-61.8	144.5	-178	26.2	-35.1	0	0	0	112.6
478	G	85.7	Confident	77	Confident	29 Å²	29	48.4 Å²	48.4	30%	0.299	24%	0.244	S	C	.	.	S	Bend	trans	112.5	160.5	179	0	0	0	0	0	114.1	C439	C439-G478 CarbonylContact O-C 3.59Å; C439-G478 WeakPolarHBondContact O-CA 3.44Å
479	F	88.3	Confident	76.3	Confident	7 Å²	7	53 Å²	53	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	138.4	178.1	-172.3	-86	0	0	0	111.2	L438 C439 H442 L444 L446 V450 V481 F497	L438-F479 WeakPolarHBondContact CA-O 3.37Å; C439-F479 PolarHBondContact N-O 3.07Å; C439-F479 PolarHBondContact O-N 3.18Å; H442-F479 HydrophobicContact CB-CB 3.58Å; H442-F479 HydrophobicContact CB-CG 4.34Å; H442-F479 AromaticContact CD2-CD1 3.99Å; H442-F479 AromaticContact CE1-CD1 3.17Å; H442-F479 WeakPolarHBondContact CE1-CD1 3.36Å; H442-F479 AromaticContact CE1-CD2 3.84Å; H442-F479 AromaticContact CE1-CE1 3.39Å; H442-F479 WeakPolarHBondContact CE1-CE1 3.35Å; H442-F479 AromaticContact CE1-CG 3.42Å; H442-F479 VanDerWaalsContact CE1-CG 3.42Å; H442-F479 WeakPolarHBondContact CE1-CG 3.36Å; H442-F479 AromaticContact CE1-CZ 3.81Å; H442-F479 AromaticContact CG-CD1 3.89Å; H442-F479 AromaticContact CG-CG 3.75Å; H442-F479 WeakPolarHBondContact ND1-CB 3.47Å; H442-F479 AromaticContact ND1-CD1 3.4Å; H442-F479 WeakPolarHBondContact ND1-CD1 3.48Å; H442-F479 AromaticContact ND1-CD2 3.57Å; H442-F479 AromaticContact ND1-CG 3.14Å; H442-F479 WeakPolarHBondContact ND1-CG 3.17Å; H442-F479 AromaticContact NE2-CD1 3.54Å; H442-F479 AromaticContact NE2-CE1 3.84Å; L444-F479 HydrophobicContact CB-CD2 4.06Å; L444-F479 HydrophobicContact CB-CE2 3.77Å; L444-F479 HydrophobicContact CB-CZ 4.37Å; L444-F479 HydrophobicContact CD1-CE2 4.45Å; L444-F479 HydrophobicContact CD1-CZ 4.38Å; L444-F479 WeakPolarHBondContact O-CD2 3.3Å; L446-F479 HydrophobicContact CB-CD2 4.12Å; L446-F479 HydrophobicContact CB-CE2 4.49Å; L446-F479 HydrophobicContact CD1-CE2 4.49Å; V450-F479 HydrophobicContact CG2-CE2 3.95Å; F479-V481 HydrophobicContact CD1-CG1 4.1Å; F479-V481 PolarHBondContact O-N 3.5Å; F479-F497 HydrophobicContact CE1-CB 4.06Å; F479-F497 HydrophobicContact CE1-CD1 4.2Å; F479-F497 AromaticContact CE1-CD2 3.97Å; F479-F497 HydrophobicContact CE1-CD2 3.97Å; F479-F497 HydrophobicContact CE1-CE2 4.49Å; F479-F497 AromaticContact CE1-CG 3.81Å; F479-F497 HydrophobicContact CE1-CG 3.81Å; F479-F497 HydrophobicContact CZ-CD1 4.2Å; F479-F497 HydrophobicContact CZ-CE1 4.47Å; F479-F497 HydrophobicContact CZ-CG 4.28Å
480	P	88.8	Confident	75.7	Confident	8 Å²	8	52.3 Å²	52.3	5%	0.052	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	78.1	-178.8	33.3	-36.5	0	0	0	112.9	W437 L438 L446 K482 I483 F497	W437-P480 CarbonylContact O-C 3.44Å; W437-P480 WeakPolarHBondContact O-CA 3.43Å; L438-P480 HydrophobicContact CD2-CB 3.85Å; L446-P480 HydrophobicContact CD1-CG 4.42Å; L446-P480 HydrophobicContact CD2-CG 4.43Å; P480-K482 PolarHBondContact O-N 3.04Å; P480-I483 HydrophobicContact CB-CD1 4.23Å; P480-I483 HydrophobicContact CB-CG1 4.13Å; P480-F497 WeakPolarHBondContact O-CD2 3.49Å; P480-F497 WeakPolarHBondContact O-CE2 3.39Å
481	V	90.8	Very high	75.7	Confident	1 Å²	1	52 Å²	52	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	-25.8	179.9	-62.3	0	0	0	0	113.7	V318 Y321 A323 W437 C439 H442 F479 T496 F497	V318-V481 HydrophobicContact CB-CG2 4.05Å; V318-V481 HydrophobicContact CG1-CG2 4.41Å; Y321-V481 HydrophobicContact CG-CG1 4.41Å; A323-V481 HydrophobicContact CB-CG2 3.66Å; W437-V481 HydrophobicContact CB-CG2 3.99Å; W437-V481 PolarHBondContact O-N 3.45Å; C439-V481 HydrophobicContact CB-CG1 3.89Å; C439-V481 HydrophobicContact CB-CG2 4.5Å; H442-V481 VanDerWaalsContact CD2-CG1 3.44Å; H442-V481 WeakPolarHBondContact CD2-CG1 3.48Å; F479-V481 HydrophobicContact CD1-CG1 4.1Å; F479-V481 PolarHBondContact O-N 3.5Å; V481-T496 WeakPolarHBondContact O-CA 3.46Å; V481-F497 PolarHBondContact O-N 3.42Å
482	K	91.4	Very high	76.1	Confident	20 Å²	20	53 Å²	53	9%	0.087	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	144.2	168.8	176.2	-174.2	168.6	-155.7	0	111.1	V318 W437 P480 E484 I495 T496	V318-K482 HydrophobicContact CG1-CB 4.19Å; V318-K482 HydrophobicContact CG2-CB 4.41Å; W437-K482 HydrophobicContact CB-CB 3.88Å; W437-K482 HydrophobicContact CD2-CB 3.92Å; W437-K482 HydrophobicContact CD2-CD 3.7Å; W437-K482 HydrophobicContact CD2-CG 3.93Å; W437-K482 HydrophobicContact CE3-CB 3.85Å; W437-K482 HydrophobicContact CE3-CD 3.67Å; W437-K482 HydrophobicContact CE3-CG 3.55Å; W437-K482 HydrophobicContact CG-CB 3.94Å; W437-K482 HydrophobicContact CG-CD 4.33Å; W437-K482 HydrophobicContact CG-CG 4.46Å; W437-K482 HydrophobicContact CH2-CD 4.05Å; W437-K482 VanDerWaalsContact CH2-CE 3.5Å; W437-K482 HydrophobicContact CZ2-CD 4.04Å; W437-K482 HydrophobicContact CZ3-CD 3.83Å; W437-K482 HydrophobicContact CZ3-CG 3.93Å; W437-K482 PolarHBondContact N-O 3.49Å; P480-K482 PolarHBondContact O-N 3.04Å; K482-E484 WeakPolarHBondContact CE-OE2 3.43Å; K482-E484 IonicContact NZ-OE2 2.88Å; K482-E484 PolarHBondContact NZ-OE2 3.19Å; K482-I495 CarbonylContact C-O 3.58Å; K482-I495 VanDerWaalsContact CA-O 3.3Å; K482-I495 WeakPolarHBondContact CA-O 3.37Å; K482-T496 HydrophobicContact CB-CG2 3.97Å; K482-T496 HydrophobicContact CD-CG2 4.26Å; K482-T496 HydrophobicContact CG-CG2 3.79Å
483	I	88.6	Confident	76.6	Confident	21 Å²	21	49.5 Å²	49.5	11%	0.108	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	139.8	170.7	-53.5	179.2	0	0	0	107.8	L436 P480 I485 R494 I495	L436-I483 HydrophobicContact CD2-CB 4.23Å; L436-I483 HydrophobicContact CD2-CD1 4.41Å; L436-I483 HydrophobicContact CD2-CG1 3.85Å; L436-I483 HydrophobicContact CD2-CG2 3.86Å; P480-I483 HydrophobicContact CB-CD1 4.23Å; P480-I483 HydrophobicContact CB-CG1 4.13Å; I483-I485 HydrophobicContact CG2-CD1 4.2Å; I483-I485 HydrophobicContact CG2-CG1 3.94Å; I483-R494 WeakPolarHBondContact O-CA 3.49Å; I483-I495 HydrophobicContact CB-CB 4.21Å; I483-I495 HydrophobicContact CB-CD1 4.29Å; I483-I495 HydrophobicContact CD1-CD1 4.36Å; I483-I495 HydrophobicContact CG2-CD1 4.44Å; I483-I495 PolarHBondContact N-O 3.42Å; I483-I495 PolarHBondContact O-N 2.95Å
484	E	87.1	Confident	77.4	Confident	22 Å²	22	51 Å²	51	10%	0.103	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	116.6	174.6	-168.1	-174.4	124.4	0	0	109.5	A434 K435 W437 K482 N492 A493	A434-E484 CarbonylContact C-O 3.6Å; A434-E484 WeakPolarHBondContact CA-O 3.49Å; K435-E484 HydrophobicContact CB-CB 4.28Å; K435-E484 PolarHBondContact N-O 3.22Å; K435-E484 IonicContact NZ-OE1 3.28Å; K435-E484 PolarHBondContact NZ-OE1 3.23Å; K435-E484 PolarHBondContact O-N 3.23Å; W437-E484 HydrophobicContact CH2-CB 3.96Å; W437-E484 VanDerWaalsContact CH2-OE2 3.31Å; W437-E484 WeakPolarHBondContact CH2-OE2 3.33Å; W437-E484 HydrophobicContact CZ3-CB 3.63Å; K482-E484 WeakPolarHBondContact CE-OE2 3.43Å; K482-E484 IonicContact NZ-OE2 2.88Å; K482-E484 PolarHBondContact NZ-OE2 3.19Å; E484-N492 HydrophobicContact CG-CB 4.21Å; E484-N492 PolarHBondContact OE1-ND2 2.85Å; E484-N492 VanDerWaalsContact OE1-ND2 3.16Å; E484-A493 CarbonylContact C-O 3.57Å; E484-A493 WeakPolarHBondContact CA-O 3.47Å
485	I	79.4	Confident	78.3	Confident	49 Å²	49	40.4 Å²	40.4	25%	0.251	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	115	-176.8	-57.4	177.1	0	0	0	108.2	F432 A434 I483 L487 N492 A493	F432-I485 HydrophobicContact CD2-CG2 4.03Å; F432-I485 HydrophobicContact CE2-CG2 3.67Å; F432-I485 HydrophobicContact CZ-CG2 4.21Å; A434-I485 HydrophobicContact CB-CG1 4.15Å; I483-I485 HydrophobicContact CG2-CD1 4.2Å; I483-I485 HydrophobicContact CG2-CG1 3.94Å; I485-L487 HydrophobicContact CG2-CD2 4.1Å; I485-L487 PolarHBondContact O-N 2.81Å; I485-N492 CarbonylContact O-C 3.56Å; I485-N492 WeakPolarHBondContact O-CA 3.32Å; I485-A493 PolarHBondContact N-O 2.72Å; I485-A493 PolarHBondContact O-N 2.89Å
486	P	73.3	Confident	78.8	Confident	37 Å²	37	39.1 Å²	39.1	24%	0.24	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	123.7	171.4	29.5	-31.1	0	0	0	109.3	F432 K433 N492	F432-P486 HydrophobicContact CB-CG 4.27Å; K433-P486 VanDerWaalsContact O-CD 3.29Å; K433-P486 WeakPolarHBondContact O-CD 3.45Å; K433-P486 WeakPolarHBondContact O-CG 3.44Å; P486-N492 WeakPolarHBondContact CA-OD1 3.45Å; P486-N492 WeakPolarHBondContact CB-OD1 3.5Å
487	L	63	Low	79	Confident	52 Å²	52	39.6 Å²	39.6	27%	0.272	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-39.7	177.6	-60	-177.8	0	0	0	111	F170 Q430 I485 L491 A493	F170-L487 HydrophobicContact CD1-CD1 4Å; F170-L487 HydrophobicContact CE1-CD1 3.57Å; Q430-L487 PolarHBondContact NE2-O 3.12Å; I485-L487 HydrophobicContact CG2-CD2 4.1Å; I485-L487 PolarHBondContact O-N 2.81Å; L487-L491 PolarHBondContact N-O 3.4Å; L487-A493 HydrophobicContact CD1-CB 3.91Å; L487-A493 HydrophobicContact CG-CB 4.13Å
488	Y	60.3	Low	79	Confident	58 Å²	58	36.3 Å²	36.3	23%	0.227	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	168.7	178.9	-58.7	-94.6	0	0	0	110.2	I490 L491 S591 E594 A595	Y488-I490 PolarHBondContact O-N 3.42Å; Y488-L491 HydrophobicContact CD2-CB 4.06Å; Y488-L491 HydrophobicContact CD2-CD1 4.13Å; Y488-L491 PolarHBondContact N-O 2.87Å; Y488-L491 VanDerWaalsContact N-O 3.13Å; Y488-L491 PolarHBondContact O-N 3.24Å; Y488-S591 VanDerWaalsContact OH-CA 3.23Å; Y488-S591 WeakPolarHBondContact OH-CA 3.25Å; Y488-S591 PolarHBondContact OH-O 3.35Å; Y488-S591 PolarHBondContact OH-OG 3.29Å; Y488-E594 HydrophobicContact CE1-CB 4.37Å; Y488-A595 HydrophobicContact CD1-CB 4.2Å; Y488-A595 HydrophobicContact CE1-CB 3.82Å
489	H	57.8	Low	78.6	Confident	173 Å²	173	36.9 Å²	36.9	80%	0.801	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-18.8	171.3	-46.1	-56.1	0	0	0	113.9	W173	W173-H489 PolarHBondContact NE1-O 3.03Å
490	I	57.7	Low	78.1	Confident	58 Å²	58	37.1 Å²	37.1	30%	0.297	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-2.3	-177.3	66.8	166.2	0	0	0	114.7	S172 W173 V174 Y488	S172-I490 VanDerWaalsContact CA-O 3.26Å; S172-I490 WeakPolarHBondContact CA-O 3.5Å; S172-I490 VanDerWaalsContact CB-O 3.25Å; S172-I490 WeakPolarHBondContact CB-O 3.4Å; S172-I490 PolarHBondContact OG-O 3.34Å; W173-I490 HydrophobicContact CZ2-CG2 3.76Å; V174-I490 HydrophobicContact CG2-CB 4.13Å; V174-I490 HydrophobicContact CG2-CG2 4.16Å; Y488-I490 PolarHBondContact O-N 3.42Å
491	L	65.2	Low	77.4	Confident	35 Å²	35	40 Å²	40	18%	0.183	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	125.8	-171.5	-80.5	167.3	0	0	0	112.9	T171 V177 C181 L487 Y488	T171-L491 CarbonylContact O-C 3.58Å; T171-L491 WeakPolarHBondContact O-CA 3.4Å; V177-L491 HydrophobicContact CG1-CD2 4.37Å; C181-L491 VanDerWaalsContact SG-CD2 3.57Å; L487-L491 PolarHBondContact N-O 3.4Å; Y488-L491 HydrophobicContact CD2-CB 4.06Å; Y488-L491 HydrophobicContact CD2-CD1 4.13Å; Y488-L491 PolarHBondContact N-O 2.87Å; Y488-L491 VanDerWaalsContact N-O 3.13Å; Y488-L491 PolarHBondContact O-N 3.24Å
492	N	74.9	Confident	75.9	Confident	42 Å²	42	42.1 Å²	42.1	23%	0.225	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.6	171.1	-63.1	-1.2	0	0	0	110	T171 E484 I485 P486	T171-N492 PolarHBondContact N-O 3.05Å; T171-N492 PolarHBondContact O-N 3.17Å; T171-N492 PolarHBondContact OG1-O 2.8Å; E484-N492 HydrophobicContact CG-CB 4.21Å; E484-N492 PolarHBondContact OE1-ND2 2.85Å; E484-N492 VanDerWaalsContact OE1-ND2 3.16Å; I485-N492 CarbonylContact O-C 3.56Å; I485-N492 WeakPolarHBondContact O-CA 3.32Å; P486-N492 WeakPolarHBondContact CA-OD1 3.45Å; P486-N492 WeakPolarHBondContact CB-OD1 3.5Å
493	A	76.8	Confident	73.6	Confident	10 Å²	10	46 Å²	46	8%	0.083	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	135.5	163.4	0	0	0	0	0	109.6	F170 E484 I485 L487	F170-A493 HydrophobicContact CD1-CB 4.33Å; F170-A493 HydrophobicContact CE1-CB 4.19Å; E484-A493 CarbonylContact C-O 3.57Å; E484-A493 WeakPolarHBondContact CA-O 3.47Å; I485-A493 PolarHBondContact N-O 2.72Å; I485-A493 PolarHBondContact O-N 2.89Å; L487-A493 HydrophobicContact CD1-CB 3.91Å; L487-A493 HydrophobicContact CG-CB 4.13Å
494	R	83.3	Confident	71.8	Confident	74 Å²	74	50.2 Å²	50.2	28%	0.279	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.4	178.7	175.4	-177.4	176.7	-165.2	9	109.3	E169 I483 T496	E169-R494 HydrophobicContact CB-CB 4.36Å; E169-R494 PolarHBondContact N-O 2.81Å; E169-R494 PolarHBondContact O-N 3.04Å; E169-R494 WeakPolarHBondContact OE2-CD 3.34Å; E169-R494 IonicContact OE2-CZ 2.68Å; E169-R494 IonicContact OE2-NE 2.99Å; E169-R494 IonicContact OE2-NH1 3.09Å; E169-R494 PolarHBondContact OE2-NH1 3.43Å; I483-R494 WeakPolarHBondContact O-CA 3.49Å; R494-T496 HydrophobicContact CG-CG2 4.22Å
495	I	86.4	Confident	69.6	Low	16 Å²	16	58.3 Å²	58.3	8%	0.082	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.9	173.3	-48.5	164	0	0	0	106.6	M166 K167 W168 K482 I483 F497	M166-I495 HydrophobicContact CG-CG2 3.7Å; M166-I495 HydrophobicContact SD-CG2 4.11Å; K167-I495 WeakPolarHBondContact O-CA 3.3Å; W168-I495 HydrophobicContact CD2-CG1 3.96Å; W168-I495 HydrophobicContact CE3-CD1 4.24Å; W168-I495 HydrophobicContact CE3-CG1 3.8Å; W168-I495 HydrophobicContact CH2-CD1 3.4Å; W168-I495 VanDerWaalsContact CH2-CD1 3.4Å; W168-I495 HydrophobicContact CH2-CG1 3.88Å; W168-I495 HydrophobicContact CZ2-CD1 3.74Å; W168-I495 HydrophobicContact CZ2-CG1 4.03Å; W168-I495 HydrophobicContact CZ2-CG2 4.45Å; W168-I495 HydrophobicContact CZ3-CD1 3.68Å; W168-I495 HydrophobicContact CZ3-CG1 3.76Å; K482-I495 CarbonylContact C-O 3.58Å; K482-I495 VanDerWaalsContact CA-O 3.3Å; K482-I495 WeakPolarHBondContact CA-O 3.37Å; I483-I495 HydrophobicContact CB-CB 4.21Å; I483-I495 HydrophobicContact CB-CD1 4.29Å; I483-I495 HydrophobicContact CD1-CD1 4.36Å; I483-I495 HydrophobicContact CG2-CD1 4.44Å; I483-I495 PolarHBondContact N-O 3.42Å; I483-I495 PolarHBondContact O-N 2.95Å; I495-F497 HydrophobicContact CG2-CE2 4.08Å; I495-F497 HydrophobicContact CG2-CZ 4.26Å
496	T	88.1	Confident	67.5	Low	6 Å²	6	59.5 Å²	59.5	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	140.7	173.6	50.5	0	0	0	0	111	K167 V481 K482 R494	K167-T496 PolarHBondContact N-O 2.88Å; K167-T496 PolarHBondContact O-N 2.93Å; V481-T496 WeakPolarHBondContact O-CA 3.46Å; K482-T496 HydrophobicContact CB-CG2 3.97Å; K482-T496 HydrophobicContact CD-CG2 4.26Å; K482-T496 HydrophobicContact CG-CG2 3.79Å; R494-T496 HydrophobicContact CG-CG2 4.22Å
497	F	87.5	Confident	65.6	Low	29 Å²	29	63 Å²	63	13%	0.127	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	134.2	176.3	-61.2	-95	0	0	0	110.1	V164 E165 M166 N319 F479 P480 V481 I495	V164-F497 HydrophobicContact CG2-CB 4.34Å; V164-F497 HydrophobicContact CG2-CD1 4.25Å; E165-F497 CarbonylContact O-C 3.53Å; E165-F497 VanDerWaalsContact O-CA 3.29Å; E165-F497 WeakPolarHBondContact O-CA 3.38Å; M166-F497 HydrophobicContact CB-CD1 4.01Å; M166-F497 HydrophobicContact CB-CE1 3.91Å; M166-F497 HydrophobicContact CG-CD1 4.21Å; M166-F497 HydrophobicContact CG-CE1 3.74Å; M166-F497 HydrophobicContact CG-CZ 4.05Å; M166-F497 HydrophobicContact SD-CE1 3.77Å; M166-F497 HydrophobicContact SD-CZ 3.89Å; N319-F497 PolarHBondContact ND2-O 3.42Å; F479-F497 HydrophobicContact CE1-CB 4.06Å; F479-F497 HydrophobicContact CE1-CD1 4.2Å; F479-F497 AromaticContact CE1-CD2 3.97Å; F479-F497 HydrophobicContact CE1-CD2 3.97Å; F479-F497 HydrophobicContact CE1-CE2 4.49Å; F479-F497 AromaticContact CE1-CG 3.81Å; F479-F497 HydrophobicContact CE1-CG 3.81Å; F479-F497 HydrophobicContact CZ-CD1 4.2Å; F479-F497 HydrophobicContact CZ-CE1 4.47Å; F479-F497 HydrophobicContact CZ-CG 4.28Å; P480-F497 WeakPolarHBondContact O-CD2 3.49Å; P480-F497 WeakPolarHBondContact O-CE2 3.39Å; V481-F497 PolarHBondContact O-N 3.42Å; I495-F497 HydrophobicContact CG2-CE2 4.08Å; I495-F497 HydrophobicContact CG2-CZ 4.26Å
498	S	84.2	Confident	64.2	Low	15 Å²	15	64 Å²	64	11%	0.105	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	173	-170.4	50.7	0	0	0	0	112.5	E165 L500	E165-S498 WeakPolarHBondContact CB-OG 3.37Å; E165-S498 PolarHBondContact N-O 3.3Å; E165-S498 PolarHBondContact O-N 3.38Å; S498-L500 VanDerWaalsContact C-N 3.31Å; S498-L500 PolarHBondContact O-N 2.9Å
499	N	77	Confident	62.7	Low	42 Å²	42	69.6 Å²	69.6	23%	0.225	42%	0.419	C	S	.	.			trans	52.3	40	169.8	-158.1	10.4	0	0	0	115.7	Y163 E165 N501 G502	Y163-N499 VanDerWaalsContact CD1-O 3.25Å; Y163-N499 WeakPolarHBondContact CD1-O 3.4Å; Y163-N499 HydrophobicContact CE1-CB 4.35Å; Y163-N499 WeakPolarHBondContact CE1-O 3.48Å; E165-N499 HydrophobicContact CB-CB 4.35Å; E165-N499 HydrophobicContact CG-CB 4.05Å; E165-N499 PolarHBondContact OE1-ND2 3.05Å; N499-N501 PolarHBondContact O-N 2.88Å; N499-G502 PolarHBondContact O-N 2.87Å; N499-G502 VanDerWaalsContact OD1-CA 3.3Å; N499-G502 WeakPolarHBondContact OD1-CA 3.22Å
500	L	78	Confident	61.3	Low	11 Å²	11	71.8 Å²	71.8	6%	0.058	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-61.1	118.2	-178.2	-74.2	159.7	0	0	0	111.3	Y163 V164 Y321 H442 P443 L444 S498 G502 C503	Y163-L500 WeakPolarHBondContact O-CA 3.31Å; V164-L500 HydrophobicContact CB-CD2 3.82Å; V164-L500 HydrophobicContact CG2-CD2 3.54Å; V164-L500 HydrophobicContact CG2-CG 4.21Å; Y321-L500 HydrophobicContact CE2-CD1 3.83Å; Y321-L500 WeakPolarHBondContact OH-CD1 3.34Å; H442-L500 VanDerWaalsContact NE2-CD1 3.31Å; H442-L500 WeakPolarHBondContact NE2-CD1 3.28Å; P443-L500 HydrophobicContact CG-CD1 3.97Å; L444-L500 HydrophobicContact CD1-CD2 3.42Å; L444-L500 VanDerWaalsContact CD1-CD2 3.42Å; L444-L500 HydrophobicContact CD2-CD2 4.18Å; L444-L500 HydrophobicContact CG-CD2 3.56Å; S498-L500 VanDerWaalsContact C-N 3.31Å; S498-L500 PolarHBondContact O-N 2.9Å; L500-G502 PolarHBondContact O-N 3.02Å; L500-C503 WeakPolarHBondContact O-CB 3.21Å; L500-C503 PolarHBondContact O-N 3.13Å
501	N	74.4	Confident	60.1	Low	68 Å²	68	75.2 Å²	75.2	36%	0.364	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	50.8	20.6	-177.5	-63.2	-7.6	0	0	0	115	F162 Y163 N499	F162-N501 VanDerWaalsContact CA-OD1 3.32Å; F162-N501 WeakPolarHBondContact CA-OD1 3.24Å; Y163-N501 PolarHBondContact N-OD1 3.34Å; Y163-N501 PolarHBondContact O-N 3.41Å; Y163-N501 PolarHBondContact O-OD1 3.3Å; N499-N501 PolarHBondContact O-N 2.88Å
502	G	59.9	Low	58.5	Low	47 Å²	47	80 Å²	80	49%	0.485	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	85.8	8.7	-175.9	0	0	0	0	0	115.8	N499 L500 E504	N499-G502 PolarHBondContact O-N 2.87Å; N499-G502 VanDerWaalsContact OD1-CA 3.3Å; N499-G502 WeakPolarHBondContact OD1-CA 3.22Å; L500-G502 PolarHBondContact O-N 3.02Å; G502-E504 PolarHBondContact O-N 3.09Å
503	C	43.8	Very low	56.5	Low	100 Å²	100	85.9 Å²	85.9	68%	0.676	50%	0.503	S	S	*	.			trans	-93.9	27.9	-168.5	-70	0	0	0	0	116.4	L500 E505	L500-C503 WeakPolarHBondContact O-CB 3.21Å; L500-C503 PolarHBondContact O-N 3.13Å; C503-E505 PolarHBondContact O-N 3.47Å; C503-E505 VanDerWaalsContact O-N 3.1Å
504	E	48.8	Very low	54.3	Low	110 Å²	110	94.5 Å²	94.5	51%	0.514	54%	0.541	S	S	.	.			trans	-77.6	90.6	160.3	-76.4	-147.8	140.7	0	0	109.8	N319 G502 G506	N319-E504 WeakPolarHBondContact CB-OE1 3.28Å; G502-E504 PolarHBondContact O-N 3.09Å; E504-G506 PolarHBondContact O-N 3.3Å
505	E	41.8	Very low	52	Low	192 Å²	192	99 Å²	99	90%	0.897	57%	0.569	S	S	*	*			trans	-58.7	122.5	173.7	-96.7	-177.5	149.2	0	0	111.3	C503 A507	C503-E505 PolarHBondContact O-N 3.47Å; C503-E505 VanDerWaalsContact O-N 3.1Å; E505-A507 PolarHBondContact O-N 2.77Å
506	G	36	Very low	49.3	Very low	74 Å²	74	101.7 Å²	101.7	76%	0.763	60%	0.601	S	S	*	*			trans	-60	132.6	175.3	0	0	0	0	0	111.5	E504 G508	E504-G506 PolarHBondContact O-N 3.3Å; G506-G508 PolarHBondContact O-N 2.91Å
507	A	33.7	Very low	46.5	Very low	111 Å²	111	107.1 Å²	107.1	92%	0.917	63%	0.634	S	S	*	*	S	Bend	trans	-61.4	103.7	-166.3	0	0	0	0	0	114.5	E505	E505-A507 PolarHBondContact O-N 2.77Å
508	G	32.4	Very low	43.8	Very low	73 Å²	73	115 Å²	115	75%	0.753	67%	0.671	S	S	*	*			trans	78.4	54	143.3	0	0	0	0	0	118.3	G506	G506-G508 PolarHBondContact O-N 2.91Å
509	L	29.3	Very low	41.1	Very low	176 Å²	176	118.2 Å²	118.2	92%	0.921	71%	0.707	S	S	*	*			trans	-82.3	119.7	152.8	-81.3	170.5	0	0	0	109.8
510	R	28.8	Very low	38.8	Very low	219 Å²	219	124.5 Å²	124.5	83%	0.826	74%	0.74	S	S	*	*			trans	-74	135.1	175.4	-73.8	-174.2	174.3	-166.7	-1.3	111	D512	R510-D512 PolarHBondContact O-N 3.06Å
511	P	32.8	Very low	36.5	Very low	129 Å²	129	127.4 Å²	127.4	84%	0.838	77%	0.773	S	S	*	*			trans	-89	77.9	173	35.8	-33.4	0	0	0	111.3
512	D	31.3	Very low	34.3	Very low	135 Å²	135	132.2 Å²	132.2	72%	0.722	79%	0.793	S	S	*	*			trans	-134.3	101.3	169.4	-80.2	-54.8	0	0	0	109.2	R510	R510-D512 PolarHBondContact O-N 3.06Å
513	N	32.2	Very low	32.9	Very low	167 Å²	167	141.5 Å²	141.5	89%	0.893	81%	0.814	S	S	*	*			trans	-158.1	78.4	167	-146.7	32	0	0	0	111.1
514	E	31.5	Very low	32.1	Very low	190 Å²	190	142.7 Å²	142.7	89%	0.888	81%	0.813	S	S	*	*			trans	-74.2	167.7	163.1	-72.4	-160.3	135.2	0	0	111.2
515	I	34.5	Very low	31	Very low	169 Å²	169	142.9 Å²	142.9	87%	0.867	83%	0.827	S	S	*	*			trans	-84.7	131.3	-161.7	-62.8	162.8	0	0	0	112	V517	I515-V517 HydrophobicContact CG2-CG2 4.49Å
516	G	29	Very low	30.9	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	82%	0.823	S	S	*	*			trans	-139.4	151.7	171	0	0	0	0	0	111.5
517	V	30.6	Very low	30.5	Very low	120 Å²	120	146 Å²	146	73%	0.727	82%	0.824	S	S	*	*			trans	-131.8	135.1	-162.7	175.6	0	0	0	0	112.3	I515	I515-V517 HydrophobicContact CG2-CG2 4.49Å
518	E	29.6	Very low	30.3	Very low	195 Å²	195	147.9 Å²	147.9	91%	0.911	82%	0.824	S	S	*	*			trans	58.4	145	164.2	-72.6	175	179.7	0	0	120.3
519	G	28.2	Very low	30.2	Very low	82 Å²	82	150.1 Å²	150.1	85%	0.845	82%	0.818	S	S	*	*			trans	164.5	97.2	174.7	0	0	0	0	0	113.3
520	D	28.8	Very low	30.2	Very low	174 Å²	174	148.6 Å²	148.6	93%	0.93	82%	0.816	S	S	*	*			trans	-81	152.8	174.2	-176.9	26.6	0	0	0	111.9
521	G	28.6	Very low	30.4	Very low	72 Å²	72	144 Å²	144	74%	0.742	82%	0.815	S	S	*	*			trans	164.1	97.3	177.9	0	0	0	0	0	116.9
522	Q	28.8	Very low	30.4	Very low	168 Å²	168	143.7 Å²	143.7	79%	0.785	82%	0.816	S	S	*	*			trans	-84.2	141.3	175.2	178.1	171.1	-15.3	0	0	113.9
523	R	30.9	Very low	30.6	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	82%	0.823	S	S	*	*			trans	-163.8	159.6	154.6	-122.6	169.8	-114.4	-159.4	-3.3	114.4
524	D	27.1	Very low	30.5	Very low	125 Å²	125	139.1 Å²	139.1	67%	0.668	82%	0.816	S	S	*	*			trans	-104.1	147.2	-163.5	-57.6	-93.9	0	0	0	116.4
525	S	26.1	Very low	30.5	Very low	114 Å²	114	136 Å²	136	80%	0.797	82%	0.815	S	S	*	*			trans	65.7	163	142.2	-68	0	0	0	0	120.9
526	P	38.1	Very low	30.2	Very low	125 Å²	125	135.8 Å²	135.8	81%	0.812	82%	0.815	S	S	*	*			cis	-122.6	-169.4	-12.9	36	-17.8	0	0	0	113.7
527	R	27.8	Very low	30.6	Very low	207 Å²	207	137.7 Å²	137.7	78%	0.781	82%	0.817	S	S	*	*			trans	-87.6	163.1	-177.7	-50.5	177.2	-170.1	160	-0.1	114.3	D529	R527-D529 VanDerWaalsContact CD-OD2 3.22Å; R527-D529 WeakPolarHBondContact CD-OD2 3.35Å; R527-D529 IonicContact NH1-OD2 3.21Å
528	T	30.4	Very low	30.5	Very low	150 Å²	150	137.1 Å²	137.1	92%	0.92	82%	0.819	S	S	*	*			trans	-135.1	113.9	143	19.4	0	0	0	0	109.6
529	D	29.4	Very low	30.5	Very low	120 Å²	120	133 Å²	133	64%	0.642	81%	0.811	S	S	*	*			trans	-96.9	136.7	-178.6	-62.8	-67.2	0	0	0	111.8	R527	R527-D529 VanDerWaalsContact CD-OD2 3.22Å; R527-D529 WeakPolarHBondContact CD-OD2 3.35Å; R527-D529 IonicContact NH1-OD2 3.21Å
530	T	29.9	Very low	30.6	Very low	143 Å²	143	135 Å²	135	88%	0.877	81%	0.807	S	S	*	*			trans	-147.4	117.1	152.9	22.3	0	0	0	0	110.2
531	P	34	Very low	30.6	Very low	124 Å²	124	132.2 Å²	132.2	81%	0.805	80%	0.801	S	S	*	*			trans	-92.2	157.8	-174.3	35.5	-35.4	0	0	0	113.6
532	S	30.7	Very low	30.7	Very low	122 Å²	122	133.7 Å²	133.7	85%	0.853	80%	0.8	S	S	*	*			trans	-115.3	132	161.7	-59.6	0	0	0	0	109.5
533	P	36.9	Very low	30.7	Very low	134 Å²	134	131.1 Å²	131.1	87%	0.87	80%	0.801	S	S	*	*			trans	-92.2	169.2	-174.2	36.9	-36.5	0	0	0	113.5
534	G	28.9	Very low	30.8	Very low	72 Å²	72	123.8 Å²	123.8	74%	0.742	79%	0.787	S	S	*	*			trans	107.9	38.4	153.7	0	0	0	0	0	118.5
535	S	31.5	Very low	31.1	Very low	125 Å²	125	122.4 Å²	122.4	87%	0.874	79%	0.787	S	S	*	*			trans	-93.3	88.8	165.3	-65.4	0	0	0	0	111.2
536	D	29.2	Very low	31.7	Very low	163 Å²	163	122.9 Å²	122.9	87%	0.872	79%	0.785	S	S	*	*			trans	-80.9	131.7	175.1	-81.8	-21.9	0	0	0	111.9
537	S	36.5	Very low	31.9	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	78%	0.777	S	S	*	*			trans	-92.2	121.8	-171.2	56.8	0	0	0	0	113
538	S	29.4	Very low	32.4	Very low	108 Å²	108	118.6 Å²	118.6	76%	0.755	78%	0.777	S	S	*	*			trans	-129.5	56.1	168.3	54.5	0	0	0	0	111.9	V540	S538-V540 VanDerWaalsContact C-N 3.33Å; S538-V540 PolarHBondContact O-N 3.18Å
539	S	28.5	Very low	32.8	Very low	108 Å²	108	113.8 Å²	113.8	76%	0.755	75%	0.749	S	S	*	*			trans	-69.8	81.6	176.5	57.9	0	0	0	0	112.1	S541	S539-S541 PolarHBondContact O-N 2.97Å
540	V	30.1	Very low	33.3	Very low	126 Å²	126	119.2 Å²	119.2	76%	0.764	76%	0.76	S	S	*	*			trans	-79.1	106.1	166.9	-73.7	0	0	0	0	109.9	S538 S542	S538-V540 VanDerWaalsContact C-N 3.33Å; S538-V540 PolarHBondContact O-N 3.18Å; V540-S542 VanDerWaalsContact C-N 3.28Å; V540-S542 PolarHBondContact O-N 3.11Å
541	S	30.3	Very low	34	Very low	114 Å²	114	117 Å²	117	80%	0.797	76%	0.757	S	S	*	*			trans	-74.5	71.7	-175.2	-60.1	0	0	0	0	113.2	S539 S543	S539-S541 PolarHBondContact O-N 2.97Å; S541-S543 PolarHBondContact O-N 3.38Å
542	S	29.2	Very low	35	Very low	104 Å²	104	113.6 Å²	113.6	73%	0.727	74%	0.744	S	S	*	*			trans	-73.2	88.9	169.1	-67.7	0	0	0	0	110.4	V540 S544	V540-S542 VanDerWaalsContact C-N 3.28Å; V540-S542 PolarHBondContact O-N 3.11Å; S542-S544 PolarHBondContact O-N 3.12Å
543	S	29.1	Very low	37.1	Very low	114 Å²	114	115.8 Å²	115.8	80%	0.797	74%	0.74	S	S	*	*			trans	-72.2	59.1	179.5	50.4	0	0	0	0	113.7	S541 S545	S541-S543 PolarHBondContact O-N 3.38Å; S543-S545 PolarHBondContact O-N 3.42Å
544	S	33	Very low	39.4	Very low	89 Å²	89	110.3 Å²	110.3	62%	0.622	70%	0.703	S	S	*	*			trans	-79.1	102.7	160.4	-70.7	0	0	0	0	108.8	S542 T546	S542-S544 PolarHBondContact O-N 3.12Å; S544-T546 PolarHBondContact O-N 3.04Å
545	S	34.3	Very low	42.1	Very low	96 Å²	96	108.9 Å²	108.9	67%	0.671	68%	0.681	S	S	*	*			trans	-63.2	93.1	-178.2	-55.7	0	0	0	0	111.8	S543 M547	S543-S545 PolarHBondContact O-N 3.42Å; S545-M547 PolarHBondContact O-N 3.45Å
546	T	39.1	Very low	44.7	Very low	123 Å²	123	107.9 Å²	107.9	76%	0.755	67%	0.672	S	S	*	*			trans	-65.7	94.9	170.4	37.1	0	0	0	0	109.4	S544 S548	S544-T546 PolarHBondContact O-N 3.04Å; T546-S548 VanDerWaalsContact C-N 3.31Å; T546-S548 PolarHBondContact O-N 2.9Å
547	M	41	Very low	47.6	Very low	133 Å²	133	104 Å²	104	66%	0.655	66%	0.657	S	S	*	*			trans	-63.5	92.5	170.7	-70.4	-66.3	102.6	0	0	109	S545 C549	S545-M547 PolarHBondContact O-N 3.45Å; M547-C549 PolarHBondContact O-N 3.13Å; M547-C549 PolarHBondContact O-SG 3.4Å
548	S	39.7	Very low	50.2	Low	110 Å²	110	99.6 Å²	99.6	77%	0.769	63%	0.625	S	S	*	*			trans	-57.5	108.9	171.5	179.6	0	0	0	0	108.4	T546 R550	T546-S548 VanDerWaalsContact C-N 3.31Å; T546-S548 PolarHBondContact O-N 2.9Å; S548-R550 PolarHBondContact O-N 3.39Å
549	C	38.4	Very low	53.2	Low	48 Å²	48	94.8 Å²	94.8	32%	0.324	59%	0.59	S	S	.	*			trans	-73.4	89.2	-173.4	-65.4	0	0	0	0	109.5	M547 A551	M547-C549 PolarHBondContact O-N 3.13Å; M547-C549 PolarHBondContact O-SG 3.4Å; C549-A551 PolarHBondContact O-N 3.35Å; C549-A551 VanDerWaalsContact O-N 3.15Å
550	R	39.3	Very low	56.2	Low	235 Å²	235	93.9 Å²	93.9	89%	0.887	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	113.8	174	-80	-174.3	167.9	-171.5	-3.8	109.7	S548	S548-R550 PolarHBondContact O-N 3.39Å
551	A	43.9	Very low	59	Low	97 Å²	97	89.6 Å²	89.6	80%	0.802	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	63.7	168.5	0	0	0	0	0	115.9	C549 E553	C549-A551 PolarHBondContact O-N 3.35Å; C549-A551 VanDerWaalsContact O-N 3.15Å; A551-E553 VanDerWaalsContact C-N 3.26Å; A551-E553 PolarHBondContact O-N 2.78Å
552	G	56.8	Low	61.8	Low	52 Å²	52	86.1 Å²	86.1	54%	0.536	52%	0.524	S	S	.	.	S	Bend	trans	77.4	-25.4	152.2	0	0	0	0	0	118.2
553	E	74.1	Confident	64.6	Low	167 Å²	167	87.5 Å²	87.5	78%	0.78	53%	0.53	S	S	*	.			trans	-81.8	127.8	177	-67	-174.7	179	0	0	111.6	A551 P555	A551-E553 VanDerWaalsContact C-N 3.26Å; A551-E553 PolarHBondContact O-N 2.78Å; E553-P555 WeakPolarHBondContact O-CD 3.36Å
554	I	85.6	Confident	67.4	Low	19 Å²	19	85.5 Å²	85.5	10%	0.097	53%	0.527	C	S	.	.			trans	-87.1	115.8	176.9	-61.9	169.5	0	0	0	108.2	F162 W189 K190 V558 F559	F162-I554 WeakPolarHBondContact O-CD1 3.45Å; W189-I554 HydrophobicContact CB-CG2 4.32Å; K190-I554 VanDerWaalsContact O-CD1 3.3Å; K190-I554 WeakPolarHBondContact O-CD1 3.49Å; I554-V558 HydrophobicContact CG2-CB 4.42Å; I554-V558 HydrophobicContact CG2-CG2 4.42Å; I554-F559 HydrophobicContact CG2-CE2 3.82Å; I554-F559 HydrophobicContact CG2-CZ 3.91Å
555	P	85.6	Confident	70.2	Confident	43 Å²	43	83.4 Å²	83.4	28%	0.279	51%	0.506	S	S	.	.			trans	-69.5	132.5	-173.7	24.4	-30.4	0	0	0	111.1	E553 C557 V558	E553-P555 WeakPolarHBondContact O-CD 3.36Å; P555-C557 PolarHBondContact O-N 3.07Å; P555-V558 HydrophobicContact CG-CG2 3.99Å; P555-V558 WeakPolarHBondContact O-CB 3.3Å; P555-V558 WeakPolarHBondContact O-CG2 3.39Å; P555-V558 PolarHBondContact O-N 3.2Å
556	P	86.2	Confident	72.9	Confident	104 Å²	104	82.8 Å²	82.8	68%	0.675	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-55.7	-26.6	-173.1	-30.8	36.2	0	0	0	115.8	V558 F559	P556-V558 PolarHBondContact O-N 3.14Å; P556-V558 VanDerWaalsContact O-N 3.15Å; P556-F559 PolarHBondContact O-N 2.9Å
557	C	88.9	Confident	75.2	Confident	82 Å²	82	81.9 Å²	81.9	55%	0.554	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-61.9	-16.7	176.5	60.1	0	0	0	0	114.2	P555 F559 E560	P555-C557 PolarHBondContact O-N 3.07Å; C557-F559 PolarHBondContact O-N 2.87Å; C557-E560 PolarHBondContact O-N 2.71Å
558	V	91	Very high	77.1	Confident	20 Å²	20	79.3 Å²	79.3	12%	0.121	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-59.8	-32.3	171.6	170.8	0	0	0	0	111.3	W189 R196 I554 P555 P556 E560	W189-V558 HydrophobicContact CB-CG1 3.99Å; W189-V558 HydrophobicContact CD2-CG1 3.87Å; W189-V558 HydrophobicContact CE3-CG1 4.4Å; W189-V558 HydrophobicContact CG-CG1 3.7Å; R196-V558 HydrophobicContact CB-CG1 4.49Å; R196-V558 WeakPolarHBondContact CD-O 3.45Å; R196-V558 PolarHBondContact NH1-O 3.29Å; I554-V558 HydrophobicContact CG2-CB 4.42Å; I554-V558 HydrophobicContact CG2-CG2 4.42Å; P555-V558 HydrophobicContact CG-CG2 3.99Å; P555-V558 WeakPolarHBondContact O-CB 3.3Å; P555-V558 WeakPolarHBondContact O-CG2 3.39Å; P555-V558 PolarHBondContact O-N 3.2Å; P556-V558 PolarHBondContact O-N 3.14Å; P556-V558 VanDerWaalsContact O-N 3.15Å; V558-E560 VanDerWaalsContact C-N 3.32Å; V558-E560 PolarHBondContact O-N 3.22Å
559	F	92.9	Very high	78.2	Confident	7 Å²	7	77.2 Å²	77.2	3%	0.031	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-93.7	17.9	-178.5	-50	-76.7	0	0	0	113.3	W189 C194 R196 I217 R219 I554 P556 C557	W189-F559 HydrophobicContact CB-CE1 4.14Å; W189-F559 HydrophobicContact CB-CZ 4.09Å; W189-F559 WeakPolarHBondContact O-CE1 3.37Å; C194-F559 HydrophobicContact CB-CB 4.11Å; C194-F559 HydrophobicContact CB-CD1 3.54Å; C194-F559 HydrophobicContact CB-CD2 3.88Å; C194-F559 HydrophobicContact CB-CE1 3.85Å; C194-F559 HydrophobicContact CB-CE2 4.18Å; C194-F559 HydrophobicContact CB-CG 3.55Å; C194-F559 HydrophobicContact CB-CZ 4.17Å; R196-F559 HydrophobicContact CB-CD1 3.93Å; R196-F559 HydrophobicContact CB-CE1 4.03Å; I217-F559 HydrophobicContact CG2-CB 4.14Å; I217-F559 WeakPolarHBondContact CG2-O 3.44Å; R219-F559 WeakPolarHBondContact CD-O 3.49Å; R219-F559 HydrophobicContact CG-CB 4.46Å; I554-F559 HydrophobicContact CG2-CE2 3.82Å; I554-F559 HydrophobicContact CG2-CZ 3.91Å; P556-F559 PolarHBondContact O-N 2.9Å; C557-F559 PolarHBondContact O-N 2.87Å
560	E	91.3	Very high	79	Confident	89 Å²	89	77.2 Å²	77.2	42%	0.416	48%	0.479	S	S	.	.	S	Bend	trans	-117.7	141.7	178.2	-50.4	-146.4	120.2	0	0	110.6	R219 C557 V558	R219-E560 IonicContact CZ-OE1 3.43Å; R219-E560 IonicContact NH1-OE1 2.79Å; R219-E560 PolarHBondContact NH1-OE1 2.97Å; R219-E560 IonicContact NH2-OE1 2.71Å; R219-E560 PolarHBondContact NH2-OE1 3.17Å; C557-E560 PolarHBondContact O-N 2.71Å; V558-E560 VanDerWaalsContact C-N 3.32Å; V558-E560 PolarHBondContact O-N 3.22Å
561	P	89.3	Confident	79.4	Confident	35 Å²	35	76.1 Å²	76.1	23%	0.227	48%	0.481	C	S	.	.	P	Polyproline II helix	trans	-65	144.5	174.5	26.9	-33	0	0	0	110.3	M228 V230 V237 M567	M228-P561 HydrophobicContact SD-CG 4.17Å; V230-P561 HydrophobicContact CG2-CB 4.44Å; V237-P561 HydrophobicContact CG1-CB 4.29Å; V237-P561 HydrophobicContact CG2-CB 3.63Å; P561-M567 HydrophobicContact CG-SD 4.37Å
562	P	89.6	Confident	79.4	Confident	41 Å²	41	79.8 Å²	79.8	27%	0.266	48%	0.481	S	S	.	.	P	Polyproline II helix	trans	-60.3	142.7	-179.1	-23.1	33.6	0	0	0	112.7	G564 Y565	P562-G564 PolarHBondContact O-N 3.2Å; P562-Y565 HydrophobicContact CB-CD1 3.95Å; P562-Y565 HydrophobicContact CB-CE1 3.69Å; P562-Y565 HydrophobicContact CB-CE2 4.43Å; P562-Y565 HydrophobicContact CB-CG 4.45Å; P562-Y565 HydrophobicContact CG-CD2 4.47Å; P562-Y565 HydrophobicContact CG-CE1 4.1Å; P562-Y565 HydrophobicContact CG-CE2 4.01Å; P562-Y565 PolarHBondContact O-N 3.17Å
563	P	88.3	Confident	79.2	Confident	133 Å²	133	79.7 Å²	79.7	86%	0.864	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	137	-178.8	25.8	-34.4	0	0	0	111.4
564	G	87.1	Confident	78	Confident	72 Å²	72	77.2 Å²	77.2	74%	0.742	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.6	-8.1	-178.1	0	0	0	0	0	115.2	P562	P562-G564 PolarHBondContact O-N 3.2Å
565	Y	92.3	Very high	75.8	Confident	46 Å²	46	79.1 Å²	79.1	18%	0.18	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-75.3	150.3	177.5	-76.5	33.9	0	0	0	111.7	V230 H232 Q235 V237 P562	V230-Y565 HydrophobicContact CG1-CD2 3.7Å; V230-Y565 HydrophobicContact CG1-CE2 3.51Å; H232-Y565 AromaticContact ND1-CE2 3.5Å; H232-Y565 WeakPolarHBondContact ND1-CE2 3.36Å; H232-Y565 AromaticContact ND1-CZ 3.61Å; H232-Y565 PolarHBondContact ND1-OH 3.1Å; Q235-Y565 HydrophobicContact CB-CD1 3.81Å; Q235-Y565 HydrophobicContact CB-CD2 4.27Å; Q235-Y565 HydrophobicContact CB-CE1 3.94Å; Q235-Y565 HydrophobicContact CB-CE2 4.41Å; Q235-Y565 HydrophobicContact CB-CG 3.98Å; Q235-Y565 HydrophobicContact CG-CD1 4.11Å; Q235-Y565 HydrophobicContact CG-CE1 3.74Å; Q235-Y565 CarbonylContact O-C 3.56Å; Q235-Y565 WeakPolarHBondContact O-CA 3.41Å; Q235-Y565 WeakPolarHBondContact O-CB 3.33Å; V237-Y565 HydrophobicContact CG2-CD2 4Å; V237-Y565 HydrophobicContact CG2-CG 4.44Å; P562-Y565 HydrophobicContact CB-CD1 3.95Å; P562-Y565 HydrophobicContact CB-CE1 3.69Å; P562-Y565 HydrophobicContact CB-CE2 4.43Å; P562-Y565 HydrophobicContact CB-CG 4.45Å; P562-Y565 HydrophobicContact CG-CD2 4.47Å; P562-Y565 HydrophobicContact CG-CE1 4.1Å; P562-Y565 HydrophobicContact CG-CE2 4.01Å; P562-Y565 PolarHBondContact O-N 3.17Å
566	T	91	Very high	73.6	Confident	82 Å²	82	81.9 Å²	81.9	50%	0.503	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.9	-176.7	-60	0	0	0	0	111.9	Q235 L236 V237	Q235-T566 PolarHBondContact O-N 2.96Å; L236-T566 WeakPolarHBondContact CA-O 3.32Å; L236-T566 HydrophobicContact CD2-CG2 4.49Å; V237-T566 PolarHBondContact N-O 2.77Å
567	M	86.4	Confident	71.9	Confident	104 Å²	104	80.2 Å²	80.2	51%	0.512	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	133.4	177.7	-56.4	-62	-65.1	0	0	112.1	V237 C239 P561	V237-M567 HydrophobicContact CB-CE 4.18Å; V237-M567 HydrophobicContact CB-SD 3.59Å; V237-M567 VanDerWaalsContact CB-SD 3.59Å; V237-M567 HydrophobicContact CG1-CE 3.71Å; V237-M567 HydrophobicContact CG1-SD 3.73Å; V237-M567 HydrophobicContact CG2-SD 4.08Å; V237-M567 CarbonylContact O-C 3.6Å; V237-M567 WeakPolarHBondContact O-CA 2.99Å; C239-M567 HydrophobicContact CB-CE 3.86Å; P561-M567 HydrophobicContact CG-SD 4.37Å
568	L	82.4	Confident	70.1	Confident	80 Å²	80	77.1 Å²	77.1	42%	0.419	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.2	176.9	-60.6	178.1	0	0	0	110.6	L236 V237 C239	L236-L568 HydrophobicContact CB-CD1 4.32Å; L236-L568 HydrophobicContact CD1-CD1 4.26Å; V237-L568 PolarHBondContact O-N 2.93Å; C239-L568 PolarHBondContact N-O 2.86Å
569	G	61.2	Low	67.8	Low	65 Å²	65	81 Å²	81	67%	0.67	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	137.2	-175.9	0	0	0	0	0	114.3	K571	G569-K571 VanDerWaalsContact C-N 3.35Å; G569-K571 PolarHBondContact O-N 2.76Å
570	G	56	Low	65.5	Low	48 Å²	48	85.1 Å²	85.1	50%	0.495	48%	0.476	S	S	.	.	S	Bend	trans	-67.4	69.1	-174.6	0	0	0	0	0	117.5	C239	C239-G570 PolarHBondContact O-N 3.23Å
571	K	47.8	Very low	63.6	Low	213 Å²	213	83.6 Å²	83.6	93%	0.926	47%	0.469	S	S	*	.	S	Bend	trans	-119.5	-4.3	167.6	-82.7	-169.1	175.2	-177.2	0	115.4	G569	G569-K571 VanDerWaalsContact C-N 3.35Å; G569-K571 PolarHBondContact O-N 2.76Å
572	Q	44.4	Very low	61.5	Low	174 Å²	174	85.1 Å²	85.1	81%	0.813	48%	0.475	S	S	*	.	S	Bend	trans	-119.5	-6.3	-165.7	-162.4	170.2	0.6	0	0	114.7
573	R	52.2	Low	59.2	Low	50 Å²	50	86.7 Å²	86.7	19%	0.189	48%	0.481	C	S	.	.			trans	-105.3	-4.5	-161.4	-155	174.3	174.9	146.3	0.6	116.9	E229 F238 S575 M576 R577	E229-R573 VanDerWaalsContact CD-NH2 3.28Å; E229-R573 IonicContact OE1-CZ 3.49Å; E229-R573 IonicContact OE1-NH1 3.79Å; E229-R573 PolarHBondContact OE1-NH1 3.36Å; E229-R573 IonicContact OE1-NH2 3.56Å; E229-R573 PolarHBondContact OE1-NH2 2.61Å; E229-R573 IonicContact OE2-CZ 3.95Å; E229-R573 IonicContact OE2-NE 2.98Å; E229-R573 IonicContact OE2-NH1 2.73Å; E229-R573 PolarHBondContact OE2-NH1 3.25Å; E229-R573 IonicContact OE2-NH2 3.55Å; E229-R573 PolarHBondContact OE2-NH2 3.34Å; F238-R573 HydrophobicContact CD2-CB 4.44Å; F238-R573 HydrophobicContact CE1-CB 4.19Å; F238-R573 HydrophobicContact CE2-CB 3.61Å; F238-R573 HydrophobicContact CE2-CG 4.35Å; F238-R573 HydrophobicContact CZ-CB 3.46Å; F238-R573 VanDerWaalsContact CZ-CB 3.46Å; F238-R573 HydrophobicContact CZ-CG 4.22Å; R573-S575 PolarHBondContact O-N 3.34Å; R573-M576 HydrophobicContact CG-CB 3.81Å; R573-M576 HydrophobicContact CG-CG 4.09Å; R573-M576 PolarHBondContact O-N 2.93Å; R573-R577 PolarHBondContact O-N 2.97Å; R573-R577 VanDerWaalsContact O-N 3.12Å
574	D	48.6	Very low	57.3	Low	115 Å²	115	83.4 Å²	83.4	62%	0.615	46%	0.456	S	S	*	.	H	α-helix	trans	-70.4	-19	179	-68.2	-29.2	0	0	0	113.5	R577	D574-R577 IonicContact OD1-CZ 3.3Å; D574-R577 IonicContact OD1-NE 3.41Å; D574-R577 IonicContact OD1-NH2 2.67Å; D574-R577 PolarHBondContact OD1-NH2 2.99Å
575	S	38.8	Very low	55.3	Low	59 Å²	59	82.4 Å²	82.4	41%	0.413	43%	0.432	S	S	.	.	H	α-helix	trans	-69.6	-58	166.2	-165.2	0	0	0	0	111.1	R573 R577 E578 E579	R573-S575 PolarHBondContact O-N 3.34Å; S575-R577 PolarHBondContact O-N 3.16Å; S575-E578 PolarHBondContact O-N 3.29Å; S575-E579 WeakPolarHBondContact CB-OE1 3.43Å; S575-E579 PolarHBondContact O-N 3.47Å; S575-E579 VanDerWaalsContact O-N 3.15Å; S575-E579 PolarHBondContact OG-OE1 2.97Å
576	M	40.2	Very low	52.9	Low	100 Å²	100	85.1 Å²	85.1	49%	0.493	45%	0.445	S	S	.	.	H	α-helix	trans	-52.1	-35.3	-178.7	-56.3	-69.8	-56.7	0	0	113.1	R573 E579 E580	R573-M576 HydrophobicContact CG-CB 3.81Å; R573-M576 HydrophobicContact CG-CG 4.09Å; R573-M576 PolarHBondContact O-N 2.93Å; M576-E579 PolarHBondContact N-OE1 2.8Å; M576-E579 PolarHBondContact O-N 3.12Å; M576-E580 WeakPolarHBondContact O-CB 3.4Å; M576-E580 PolarHBondContact O-N 3.48Å
577	R	50.4	Low	50.4	Low	69 Å²	69	82.3 Å²	82.3	26%	0.26	43%	0.43	S	S	.	.	H	α-helix	trans	-67.2	-32.7	177.9	-97.8	-167.5	-73.7	-135.7	6.8	113.6	E240 R573 D574 S575 E581	E240-R577 IonicContact OE1-CZ 2.72Å; E240-R577 IonicContact OE1-NH1 2.81Å; E240-R577 IonicContact OE1-NH2 3.33Å; E240-R577 PolarHBondContact OE1-NH2 3.35Å; E240-R577 IonicContact OE2-CZ 2.96Å; E240-R577 IonicContact OE2-NH1 3.82Å; E240-R577 PolarHBondContact OE2-NH1 3.2Å; E240-R577 IonicContact OE2-NH2 2.71Å; E240-R577 PolarHBondContact OE2-NH2 2.78Å; R573-R577 PolarHBondContact O-N 2.97Å; R573-R577 VanDerWaalsContact O-N 3.12Å; D574-R577 IonicContact OD1-CZ 3.3Å; D574-R577 IonicContact OD1-NE 3.41Å; D574-R577 IonicContact OD1-NH2 2.67Å; D574-R577 PolarHBondContact OD1-NH2 2.99Å; S575-R577 PolarHBondContact O-N 3.16Å; R577-E581 WeakPolarHBondContact O-CB 3.27Å; R577-E581 PolarHBondContact O-N 3.15Å; R577-E581 VanDerWaalsContact O-N 3.12Å
578	E	50.3	Low	48.4	Very low	17 Å²	17	79.6 Å²	79.6	8%	0.079	42%	0.417	C	S	.	.	H	α-helix	trans	-80.9	-33.6	176.2	-170.2	161.3	-125	0	0	111.4	R137 Q279 R283 S575 E580 E581 D582	R137-E578 IonicContact CZ-OE1 3.67Å; R137-E578 IonicContact NH1-OE1 3.13Å; R137-E578 PolarHBondContact NH1-OE1 3.24Å; R137-E578 IonicContact NH2-OE1 3.92Å; R137-E578 PolarHBondContact NH2-OE1 2.9Å; Q279-E578 PolarHBondContact NE2-OE2 2.95Å; R283-E578 IonicContact CZ-OE1 3.03Å; R283-E578 VanDerWaalsContact CZ-OE1 3.28Å; R283-E578 VanDerWaalsContact NH1-CD 3.34Å; R283-E578 IonicContact NH1-OE1 2.85Å; R283-E578 PolarHBondContact NH1-OE1 3.14Å; R283-E578 IonicContact NH1-OE2 2.89Å; R283-E578 VanDerWaalsContact NH2-CD 3.28Å; R283-E578 VanDerWaalsContact NH2-CG 3.27Å; R283-E578 IonicContact NH2-OE1 3.23Å; R283-E578 PolarHBondContact NH2-OE1 3.47Å; S575-E578 PolarHBondContact O-N 3.29Å; E578-E580 VanDerWaalsContact C-N 3.32Å; E578-E580 PolarHBondContact O-N 3.16Å; E578-E581 PolarHBondContact O-N 2.85Å; E578-D582 WeakPolarHBondContact O-CB 3.28Å; E578-D582 PolarHBondContact O-N 3.1Å
579	E	42.8	Very low	46.5	Very low	103 Å²	103	77.3 Å²	77.3	48%	0.481	40%	0.404	S	S	.	.	H	α-helix	trans	-60.8	-40.4	170.8	-65.5	158	-127.5	0	0	111.5	S575 M576 L583	S575-E579 WeakPolarHBondContact CB-OE1 3.43Å; S575-E579 PolarHBondContact O-N 3.47Å; S575-E579 VanDerWaalsContact O-N 3.15Å; S575-E579 PolarHBondContact OG-OE1 2.97Å; M576-E579 PolarHBondContact N-OE1 2.8Å; M576-E579 PolarHBondContact O-N 3.12Å; E579-L583 WeakPolarHBondContact O-CB 3.45Å; E579-L583 PolarHBondContact O-N 3.01Å
580	E	46.3	Very low	45.5	Very low	92 Å²	92	76.1 Å²	76.1	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-70.3	-40.6	174.6	-166.5	-179.4	162.3	0	0	112.5	M576 E578 L584	M576-E580 WeakPolarHBondContact O-CB 3.4Å; M576-E580 PolarHBondContact O-N 3.48Å; E578-E580 VanDerWaalsContact C-N 3.32Å; E578-E580 PolarHBondContact O-N 3.16Å; E580-L584 WeakPolarHBondContact O-CB 3.26Å; E580-L584 PolarHBondContact O-N 3.07Å
581	E	49.4	Very low	44.8	Very low	57 Å²	57	75.7 Å²	75.7	27%	0.266	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-43.1	175.1	-168.9	172.7	-172	0	0	111.4	R141 R577 E578 Q585	R141-E581 IonicContact CZ-OE1 3.48Å; R141-E581 IonicContact CZ-OE2 3.66Å; R141-E581 IonicContact NH1-OE1 2.79Å; R141-E581 IonicContact NH1-OE2 3.46Å; R141-E581 PolarHBondContact NH1-OE2 3.42Å; R141-E581 IonicContact NH2-OE1 3.6Å; R141-E581 PolarHBondContact NH2-OE1 2.85Å; R141-E581 IonicContact NH2-OE2 2.75Å; R141-E581 PolarHBondContact NH2-OE2 2.99Å; R141-E581 VanDerWaalsContact NH2-OE2 3.16Å; R577-E581 WeakPolarHBondContact O-CB 3.27Å; R577-E581 PolarHBondContact O-N 3.15Å; R577-E581 VanDerWaalsContact O-N 3.12Å; E578-E581 PolarHBondContact O-N 2.85Å; E581-Q585 VanDerWaalsContact O-CB 3.23Å; E581-Q585 WeakPolarHBondContact O-CB 3.35Å; E581-Q585 PolarHBondContact O-N 2.77Å
582	D	45.2	Very low	44.3	Very low	68 Å²	68	66.8 Å²	66.8	36%	0.364	33%	0.333	S	S	.	.	H	α-helix	trans	-73.2	-37.4	177.6	-79.6	-8.3	0	0	0	112.5	R283 E578 Q585 F586	R283-D582 IonicContact CZ-OD1 2.61Å; R283-D582 IonicContact CZ-OD2 3.21Å; R283-D582 IonicContact NE-OD1 2.68Å; R283-D582 IonicContact NE-OD2 2.84Å; R283-D582 PolarHBondContact NE-OD2 3.13Å; R283-D582 IonicContact NH2-OD1 3.6Å; R283-D582 PolarHBondContact NH2-OD1 3.48Å; R283-D582 IonicContact NH2-OD2 3.45Å; R283-D582 PolarHBondContact NH2-OD2 2.96Å; E578-D582 WeakPolarHBondContact O-CB 3.28Å; E578-D582 PolarHBondContact O-N 3.1Å; D582-Q585 PolarHBondContact O-N 3.24Å; D582-F586 VanDerWaalsContact O-CB 3.3Å; D582-F586 WeakPolarHBondContact O-CB 3.18Å; D582-F586 PolarHBondContact O-N 3.28Å
583	L	42.8	Very low	44.2	Very low	74 Å²	74	62.4 Å²	62.4	39%	0.387	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.3	178.9	64.9	0	0	0	111.7	E579 F586 A587	E579-L583 WeakPolarHBondContact O-CB 3.45Å; E579-L583 PolarHBondContact O-N 3.01Å; L583-F586 WeakPolarHBondContact O-CB 3.44Å; L583-F586 PolarHBondContact O-N 3.06Å; L583-A587 PolarHBondContact O-N 3.05Å
584	L	48.1	Very low	43.7	Very low	63 Å²	63	62.2 Å²	62.2	33%	0.33	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-43	176.3	-179.6	57	0	0	0	111.5	L463 E580 F586 A587 I588	L463-L584 HydrophobicContact CD1-CD1 4.07Å; L463-L584 HydrophobicContact CD1-CD2 3.72Å; L463-L584 HydrophobicContact CD1-CG 4.12Å; L463-L584 HydrophobicContact CG-CD2 4.05Å; E580-L584 WeakPolarHBondContact O-CB 3.26Å; E580-L584 PolarHBondContact O-N 3.07Å; L584-F586 VanDerWaalsContact C-N 3.29Å; L584-F586 PolarHBondContact O-N 3.23Å; L584-A587 PolarHBondContact O-N 3.48Å; L584-I588 HydrophobicContact CD1-CD1 4.34Å; L584-I588 HydrophobicContact CG-CD1 4.28Å; L584-I588 VanDerWaalsContact O-CG1 3.32Å; L584-I588 WeakPolarHBondContact O-CG1 3.33Å; L584-I588 PolarHBondContact O-N 3.35Å
585	Q	44.1	Very low	43.2	Very low	52 Å²	52	58.3 Å²	58.3	24%	0.243	30%	0.299	C	S	.	.	H	α-helix	trans	-64.9	-32.4	173.7	-178.1	53.9	73.4	0	0	111.8	E581 D582 Q589	E581-Q585 VanDerWaalsContact O-CB 3.23Å; E581-Q585 WeakPolarHBondContact O-CB 3.35Å; E581-Q585 PolarHBondContact O-N 2.77Å; D582-Q585 PolarHBondContact O-N 3.24Å; Q585-Q589 WeakPolarHBondContact O-CB 3.41Å; Q585-Q589 PolarHBondContact O-N 3.11Å
586	F	41.8	Very low	42.9	Very low	102 Å²	102	57 Å²	57	45%	0.447	30%	0.296	S	S	.	.	H	α-helix	trans	-69.1	-44.6	171.9	176.2	-93.9	0	0	0	112.6	D582 L583 L584 I588 Q589 Q590	D582-F586 VanDerWaalsContact O-CB 3.3Å; D582-F586 WeakPolarHBondContact O-CB 3.18Å; D582-F586 PolarHBondContact O-N 3.28Å; L583-F586 WeakPolarHBondContact O-CB 3.44Å; L583-F586 PolarHBondContact O-N 3.06Å; L584-F586 VanDerWaalsContact C-N 3.29Å; L584-F586 PolarHBondContact O-N 3.23Å; F586-I588 PolarHBondContact O-N 3.27Å; F586-Q589 CarbonylContact O-C 3.57Å; F586-Q589 WeakPolarHBondContact O-CB 3.31Å; F586-Q589 PolarHBondContact O-N 3.2Å; F586-Q589 VanDerWaalsContact O-N 3.13Å; F586-Q590 HydrophobicContact CD1-CG 4.16Å; F586-Q590 HydrophobicContact CE1-CG 3.73Å; F586-Q590 HydrophobicContact CE2-CG 4.17Å; F586-Q590 HydrophobicContact CZ-CG 3.75Å; F586-Q590 WeakPolarHBondContact O-CG 3.43Å; F586-Q590 PolarHBondContact O-N 2.93Å
587	A	39.4	Very low	42.8	Very low	24 Å²	24	55 Å²	55	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-44.2	176	0	0	0	0	0	111.8	L583 L584 Q590 S591	L583-A587 PolarHBondContact O-N 3.05Å; L584-A587 PolarHBondContact O-N 3.48Å; A587-Q590 PolarHBondContact O-N 3.23Å; A587-S591 PolarHBondContact O-N 2.63Å; A587-S591 VanDerWaalsContact O-N 3.14Å
588	I	44.2	Very low	42.2	Very low	46 Å²	46	59.7 Å²	59.7	24%	0.236	32%	0.316	C	S	.	.	H	α-helix	trans	-61.6	-44.8	172	-67.5	165.1	0	0	0	110.4	L463 L584 F586 Q590 S591 L592	L463-I588 HydrophobicContact CD1-CD1 4.3Å; L463-I588 HydrophobicContact CD2-CD1 3.76Å; L584-I588 HydrophobicContact CD1-CD1 4.34Å; L584-I588 HydrophobicContact CG-CD1 4.28Å; L584-I588 VanDerWaalsContact O-CG1 3.32Å; L584-I588 WeakPolarHBondContact O-CG1 3.33Å; L584-I588 PolarHBondContact O-N 3.35Å; F586-I588 PolarHBondContact O-N 3.27Å; I588-Q590 PolarHBondContact O-N 3.03Å; I588-S591 PolarHBondContact O-N 2.94Å; I588-L592 HydrophobicContact CG2-CD1 3.73Å; I588-L592 HydrophobicContact CG2-CG 4.37Å; I588-L592 WeakPolarHBondContact O-CB 3.38Å; I588-L592 VanDerWaalsContact O-CG 3.26Å; I588-L592 WeakPolarHBondContact O-CG 3.48Å; I588-L592 PolarHBondContact O-N 2.91Å
589	Q	43.3	Very low	41.5	Very low	33 Å²	33	69.3 Å²	69.3	15%	0.154	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-42.9	179.5	176.3	178.3	-26.4	0	0	112.6	Q585 F586 L592 L593	Q585-Q589 WeakPolarHBondContact O-CB 3.41Å; Q585-Q589 PolarHBondContact O-N 3.11Å; F586-Q589 CarbonylContact O-C 3.57Å; F586-Q589 WeakPolarHBondContact O-CB 3.31Å; F586-Q589 PolarHBondContact O-N 3.2Å; F586-Q589 VanDerWaalsContact O-N 3.13Å; Q589-L592 PolarHBondContact O-N 3.42Å; Q589-L593 HydrophobicContact CG-CD1 3.48Å; Q589-L593 VanDerWaalsContact CG-CD1 3.48Å; Q589-L593 WeakPolarHBondContact O-CB 3.28Å; Q589-L593 WeakPolarHBondContact O-CD1 3.25Å; Q589-L593 PolarHBondContact O-N 3.42Å
590	Q	38.5	Very low	41	Very low	40 Å²	40	69.8 Å²	69.8	19%	0.187	36%	0.359	C	S	.	.	H	α-helix	trans	-61.2	-51	176.2	-71.6	-62.6	-11.6	0	0	110.6	F586 A587 I588 L592 L593 E594	F586-Q590 HydrophobicContact CD1-CG 4.16Å; F586-Q590 HydrophobicContact CE1-CG 3.73Å; F586-Q590 HydrophobicContact CE2-CG 4.17Å; F586-Q590 HydrophobicContact CZ-CG 3.75Å; F586-Q590 WeakPolarHBondContact O-CG 3.43Å; F586-Q590 PolarHBondContact O-N 2.93Å; A587-Q590 PolarHBondContact O-N 3.23Å; I588-Q590 PolarHBondContact O-N 3.03Å; Q590-L592 PolarHBondContact O-N 2.95Å; Q590-L593 PolarHBondContact O-N 2.87Å; Q590-E594 WeakPolarHBondContact O-CB 3.46Å; Q590-E594 WeakPolarHBondContact O-CG 3.44Å; Q590-E594 PolarHBondContact O-N 3.07Å
591	S	41.8	Very low	40.4	Very low	38 Å²	38	74.2 Å²	74.2	27%	0.266	38%	0.38	S	S	.	.	H	α-helix	trans	-56.7	-39.1	179.1	-171.5	0	0	0	0	112.3	Y488 A587 I588 A595	Y488-S591 VanDerWaalsContact OH-CA 3.23Å; Y488-S591 WeakPolarHBondContact OH-CA 3.25Å; Y488-S591 PolarHBondContact OH-O 3.35Å; Y488-S591 PolarHBondContact OH-OG 3.29Å; A587-S591 PolarHBondContact O-N 2.63Å; A587-S591 VanDerWaalsContact O-N 3.14Å; I588-S591 PolarHBondContact O-N 2.94Å; S591-A595 WeakPolarHBondContact O-CB 3.48Å; S591-A595 PolarHBondContact O-N 3.22Å
592	L	38.2	Very low	39.9	Very low	27 Å²	27	75 Å²	75	14%	0.141	39%	0.389	C	S	.	.	H	α-helix	trans	-81.2	-16.9	177.2	-62.1	178.2	0	0	0	115	T291 L333 I588 Q589 Q590	T291-L592 HydrophobicContact CG2-CD1 3.66Å; L333-L592 HydrophobicContact CD2-CD1 3.83Å; L333-L592 HydrophobicContact CD2-CD2 3.53Å; L333-L592 HydrophobicContact CD2-CG 4.36Å; I588-L592 HydrophobicContact CG2-CD1 3.73Å; I588-L592 HydrophobicContact CG2-CG 4.37Å; I588-L592 WeakPolarHBondContact O-CB 3.38Å; I588-L592 VanDerWaalsContact O-CG 3.26Å; I588-L592 WeakPolarHBondContact O-CG 3.48Å; I588-L592 PolarHBondContact O-N 2.91Å; Q589-L592 PolarHBondContact O-N 3.42Å; Q590-L592 PolarHBondContact O-N 2.95Å
593	L	41.4	Very low	39.6	Very low	82 Å²	82	75.5 Å²	75.5	43%	0.429	39%	0.394	S	S	.	.	H	α-helix	trans	-80.8	-40.9	169.7	-102.9	123.1	0	0	0	111.2	Q589 Q590 G596	Q589-L593 HydrophobicContact CG-CD1 3.48Å; Q589-L593 VanDerWaalsContact CG-CD1 3.48Å; Q589-L593 WeakPolarHBondContact O-CB 3.28Å; Q589-L593 WeakPolarHBondContact O-CD1 3.25Å; Q589-L593 PolarHBondContact O-N 3.42Å; Q590-L593 PolarHBondContact O-N 2.87Å; L593-G596 WeakPolarHBondContact O-CA 3.47Å; L593-G596 PolarHBondContact O-N 3.18Å
594	E	41.9	Very low	39.3	Very low	45 Å²	45	78.2 Å²	78.2	21%	0.21	41%	0.407	C	S	.	.	H	α-helix	trans	-68.3	-33.3	176	-68.8	175.6	157.7	0	0	112.3	Y488 Q590 G596	Y488-E594 HydrophobicContact CE1-CB 4.37Å; Q590-E594 WeakPolarHBondContact O-CB 3.46Å; Q590-E594 WeakPolarHBondContact O-CG 3.44Å; Q590-E594 PolarHBondContact O-N 3.07Å; E594-G596 PolarHBondContact O-N 3.45Å
595	A	37.6	Very low	38.7	Very low	33 Å²	33	83.9 Å²	83.9	27%	0.273	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	14.7	171.1	0	0	0	0	0	114.2	Y488 S591	Y488-A595 HydrophobicContact CD1-CB 4.2Å; Y488-A595 HydrophobicContact CE1-CB 3.82Å; S591-A595 WeakPolarHBondContact O-CB 3.48Å; S591-A595 PolarHBondContact O-N 3.22Å
596	G	33.5	Very low	38.8	Very low	32 Å²	32	83.6 Å²	83.6	33%	0.33	42%	0.423	S	S	.	.			trans	-126.5	30.1	-156.4	0	0	0	0	0	116.5	K428 L593 E594	K428-G596 PolarHBondContact NZ-O 2.95Å; L593-G596 WeakPolarHBondContact O-CA 3.47Å; L593-G596 PolarHBondContact O-N 3.18Å; E594-G596 PolarHBondContact O-N 3.45Å
597	S	37.3	Very low	38.7	Very low	57 Å²	57	81.1 Å²	81.1	40%	0.399	42%	0.422	S	S	.	.			trans	-134.5	101.1	170.1	56.1	0	0	0	0	111.4
598	E	37.3	Very low	38.4	Very low	168 Å²	168	86.5 Å²	86.5	79%	0.785	45%	0.447	S	S	*	.			trans	-85.3	151.3	162.9	-68.1	-171.9	137.8	0	0	109.9
599	Y	37.3	Very low	38.1	Very low	219 Å²	219	86.7 Å²	86.7	86%	0.859	45%	0.45	S	S	*	.			trans	69.9	73.1	-175.7	-64.3	-86.6	0	0	0	116.9
600	D	32	Very low	37.8	Very low	114 Å²	114	93.2 Å²	93.2	61%	0.61	49%	0.486	S	S	*	.				-143.3	139.7	104.5	-129.1	-17.1	0	0	0	110.7	V602	D600-V602 VanDerWaalsContact C-N 3.34Å; D600-V602 PolarHBondContact O-N 2.97Å; D600-V602 VanDerWaalsContact O-N 3.16Å
601	Q	34	Very low	37.7	Very low	184 Å²	184	94.4 Å²	94.4	86%	0.86	50%	0.498	S	S	*	.			trans	-86.9	76	174.7	-79.3	-168.1	-4.2	0	0	109.7	T603	Q601-T603 PolarHBondContact O-N 2.9Å; Q601-T603 VanDerWaalsContact O-N 3.1Å
602	V	37.2	Very low	37.2	Very low	75 Å²	75	100.3 Å²	100.3	46%	0.455	52%	0.519	S	S	.	.			trans	-59.8	116.1	171	-174.4	0	0	0	0	108.3	D600 E606 A607	D600-V602 VanDerWaalsContact C-N 3.34Å; D600-V602 PolarHBondContact O-N 2.97Å; D600-V602 VanDerWaalsContact O-N 3.16Å; V602-E606 HydrophobicContact CG1-CB 3.85Å; V602-A607 HydrophobicContact CG1-CB 4.1Å
603	T	39.8	Very low	36.8	Very low	78 Å²	78	104.8 Å²	104.8	48%	0.479	55%	0.55	S	S	.	*			trans	-71.6	151.9	179.3	57.8	0	0	0	0	110.5	Q601 W605 E606 A607	Q601-T603 PolarHBondContact O-N 2.9Å; Q601-T603 VanDerWaalsContact O-N 3.1Å; T603-W605 PolarHBondContact O-N 2.88Å; T603-E606 PolarHBondContact N-OE2 3.47Å; T603-E606 VanDerWaalsContact N-OE2 3.12Å; T603-E606 PolarHBondContact O-N 3.14Å; T603-E606 PolarHBondContact OG1-OE2 3.4Å; T603-A607 PolarHBondContact O-N 2.98Å; T603-A607 VanDerWaalsContact O-N 3.16Å
604	I	37.3	Very low	36.6	Very low	130 Å²	130	104.4 Å²	104.4	67%	0.667	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-28.7	-179.7	-62.4	171.2	0	0	0	111.6	L608	I604-L608 HydrophobicContact CG2-CD1 3.98Å; I604-L608 WeakPolarHBondContact O-CD1 3.23Å; I604-L608 VanDerWaalsContact O-CG 3.23Å; I604-L608 WeakPolarHBondContact O-CG 3.37Å; I604-L608 PolarHBondContact O-N 3.46Å
605	W	35.3	Very low	35.9	Very low	182 Å²	182	106.8 Å²	106.8	69%	0.689	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-47.4	176.3	-124.8	85.6	0	0	0	113.2	T603 A607 L608 T609	T603-W605 PolarHBondContact O-N 2.88Å; W605-A607 VanDerWaalsContact C-N 3.28Å; W605-A607 PolarHBondContact O-N 3.19Å; W605-L608 PolarHBondContact O-N 3.45Å; W605-T609 HydrophobicContact CD2-CG2 4.18Å; W605-T609 HydrophobicContact CE3-CG2 3.58Å; W605-T609 HydrophobicContact CH2-CG2 4.02Å; W605-T609 HydrophobicContact CZ3-CG2 3.5Å; W605-T609 VanDerWaalsContact CZ3-CG2 3.5Å; W605-T609 PolarHBondContact O-N 3.06Å; W605-T609 PolarHBondContact O-OG1 3.21Å
606	E	46	Very low	35.4	Very low	47 Å²	47	114 Å²	114	22%	0.22	62%	0.621	C	S	.	*	H	α-helix	trans	-59.2	-40.1	176.8	-75.7	168.9	113.9	0	0	111.9	V602 T603 L608 N610 K612	V602-E606 HydrophobicContact CG1-CB 3.85Å; T603-E606 PolarHBondContact N-OE2 3.47Å; T603-E606 VanDerWaalsContact N-OE2 3.12Å; T603-E606 PolarHBondContact O-N 3.14Å; T603-E606 PolarHBondContact OG1-OE2 3.4Å; E606-L608 PolarHBondContact O-N 2.91Å; E606-N610 PolarHBondContact O-N 3.19Å; E606-K612 WeakPolarHBondContact OE1-CE 3.37Å
607	A	38.7	Very low	35.1	Very low	50 Å²	50	118.5 Å²	118.5	41%	0.413	64%	0.644	S	S	.	*	H	α-helix	trans	-66.2	-18.4	177	0	0	0	0	0	114.1	V602 T603 W605	V602-A607 HydrophobicContact CG1-CB 4.1Å; T603-A607 PolarHBondContact O-N 2.98Å; T603-A607 VanDerWaalsContact O-N 3.16Å; W605-A607 VanDerWaalsContact C-N 3.28Å; W605-A607 PolarHBondContact O-N 3.19Å
608	L	33.4	Very low	34.6	Very low	137 Å²	137	124 Å²	124	72%	0.717	67%	0.668	S	S	*	*	H	α-helix	trans	-104.8	-19.6	-178.6	-71.1	173.4	0	0	0	113.9	I604 W605 E606	I604-L608 HydrophobicContact CG2-CD1 3.98Å; I604-L608 WeakPolarHBondContact O-CD1 3.23Å; I604-L608 VanDerWaalsContact O-CG 3.23Å; I604-L608 WeakPolarHBondContact O-CG 3.37Å; I604-L608 PolarHBondContact O-N 3.46Å; W605-L608 PolarHBondContact O-N 3.45Å; E606-L608 PolarHBondContact O-N 2.91Å
609	T	38.2	Very low	34.2	Very low	50 Å²	50	121.6 Å²	121.6	31%	0.307	67%	0.67	S	S	.	*	H	α-helix	trans	-124.2	1.6	-172.9	72.6	0	0	0	0	115.8	W605 S611	W605-T609 HydrophobicContact CD2-CG2 4.18Å; W605-T609 HydrophobicContact CE3-CG2 3.58Å; W605-T609 HydrophobicContact CH2-CG2 4.02Å; W605-T609 HydrophobicContact CZ3-CG2 3.5Å; W605-T609 VanDerWaalsContact CZ3-CG2 3.5Å; W605-T609 PolarHBondContact O-N 3.06Å; W605-T609 PolarHBondContact O-OG1 3.21Å; T609-S611 WeakPolarHBondContact O-CB 3.38Å; T609-S611 PolarHBondContact O-N 2.83Å; T609-S611 PolarHBondContact O-OG 3.46Å; T609-S611 PolarHBondContact OG1-OG 3.13Å; T609-S611 VanDerWaalsContact OG1-OG 3.04Å
610	N	37.9	Very low	33.6	Very low	170 Å²	170	117.4 Å²	117.4	91%	0.909	67%	0.672	S	S	*	*	S	Bend	trans	53.2	25.5	175.7	-99.5	-20.7	0	0	0	114.6	E606	E606-N610 PolarHBondContact O-N 3.19Å
611	S	35.5	Very low	33.3	Very low	64 Å²	64	119.1 Å²	119.1	45%	0.448	68%	0.68	S	S	.	*			trans	-146.4	129.1	-169	42.5	0	0	0	0	112.2	T609	T609-S611 WeakPolarHBondContact O-CB 3.38Å; T609-S611 PolarHBondContact O-N 2.83Å; T609-S611 PolarHBondContact O-OG 3.46Å; T609-S611 PolarHBondContact OG1-OG 3.13Å; T609-S611 VanDerWaalsContact OG1-OG 3.04Å
612	K	32.3	Very low	33.1	Very low	163 Å²	163	116 Å²	116	71%	0.709	68%	0.677	S	S	*	*			trans	-84.3	123.6	175.9	-84.9	-169.3	169.3	-176.3	0	111.5	E606 G614	E606-K612 WeakPolarHBondContact OE1-CE 3.37Å; K612-G614 PolarHBondContact O-N 2.81Å
613	P	28.1	Very low	32.6	Very low	121 Å²	121	117.7 Å²	117.7	79%	0.786	69%	0.691	S	S	*	*	S	Bend	trans	-78.1	87.2	175.7	31.8	-33.9	0	0	0	110.7
614	G	37	Very low	32.1	Very low	74 Å²	74	125.1 Å²	125.1	76%	0.763	71%	0.711	S	S	*	*			trans	165.6	44	178.6	0	0	0	0	0	118.1	K612	K612-G614 PolarHBondContact O-N 2.81Å
615	A	28.5	Very low	31.7	Very low	95 Å²	95	124.8 Å²	124.8	79%	0.785	71%	0.714	S	S	*	*			trans	-134.5	107.7	169.9	0	0	0	0	0	110.6
616	H	26.5	Very low	31.4	Very low	185 Å²	185	123.7 Å²	123.7	86%	0.856	72%	0.717	S	S	*	*			trans	-73.2	132.9	173.9	-70.9	-84.1	0	0	0	110.2	L618	H616-L618 PolarHBondContact O-N 2.79Å
617	P	27.4	Very low	30.5	Very low	126 Å²	126	130.4 Å²	130.4	82%	0.818	75%	0.745	S	S	*	*			trans	-72.7	115.3	176.6	28.8	-33.1	0	0	0	110.5
618	L	27	Very low	30.2	Very low	171 Å²	171	134.3 Å²	134.3	90%	0.895	76%	0.764	S	S	*	*			trans	-86.2	126.6	163	-70.8	175.8	0	0	0	109.2	H616	H616-L618 PolarHBondContact O-N 2.79Å
619	S	28.4	Very low	30.3	Very low	118 Å²	118	133.5 Å²	133.5	83%	0.825	77%	0.767	S	S	*	*			trans	-74.7	147.8	177.3	54.3	0	0	0	0	112.5
620	C	25.7	Very low	29.8	Very low	132 Å²	132	139.4 Å²	139.4	89%	0.892	79%	0.791	S	S	*	*			trans	-147.7	145.1	156.6	-156.1	0	0	0	0	112.1
621	D	26	Very low	29.2	Very low	149 Å²	149	138.2 Å²	138.2	80%	0.797	78%	0.78	S	S	*	*			trans	-62.2	152.7	-170.1	-96.9	-57.2	0	0	0	116.6
622	P	29.6	Very low	28.7	Very low	120 Å²	120	143.2 Å²	143.2	78%	0.779	79%	0.793	S	S	*	*			trans	-91.4	113	168.1	34.5	-29.4	0	0	0	112.5
623	S	26.2	Very low	28.5	Very low	109 Å²	109	141.5 Å²	141.5	76%	0.762	80%	0.799	S	S	*	*			trans	-157.7	152.4	164.1	65	0	0	0	0	115.2
624	R	28.3	Very low	28.4	Very low	235 Å²	235	147.3 Å²	147.3	89%	0.887	81%	0.806	S	S	*	*			trans	65.4	105	170.6	-100.7	166.6	171.5	161.9	-1.8	117.2
625	V	29.5	Very low	28.8	Very low	122 Å²	122	149.4 Å²	149.4	74%	0.739	81%	0.805	S	S	*	*				90.1	111.8	53.5	171.5	0	0	0	0	113.9
626	E	28.5	Very low	28.7	Very low	159 Å²	159	149.7 Å²	149.7	74%	0.743	81%	0.808	S	S	*	*			trans	47.1	129.4	157.2	-58	178.3	164.1	0	0	122.2
627	K	29.1	Very low	28.9	Very low	189 Å²	189	146.3 Å²	146.3	82%	0.822	81%	0.805	S	S	*	*				179.8	151.2	96.3	-94.3	167.3	-169.7	171.7	0	113.8
628	T	30.7	Very low	29.1	Very low	131 Å²	131	144.9 Å²	144.9	80%	0.804	80%	0.798	S	S	*	*			trans	-114.8	152.4	167.7	49.4	0	0	0	0	110.9
629	P	37.1	Very low	29.3	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	80%	0.797	S	S	*	*				-141.9	135	115.7	29.3	-11.6	0	0	0	112.4
630	Q	26.3	Very low	29.1	Very low	173 Å²	173	145.5 Å²	145.5	81%	0.808	80%	0.801	S	S	*	*				71.4	121	79.2	-72.8	-159.8	4.7	0	0	118.3
631	H	26.6	Very low	29.3	Very low	145 Å²	145	144.1 Å²	144.1	67%	0.671	79%	0.793	S	S	*	*			trans	107.2	106.6	130	-120.2	-130.7	0	0	0	123.7
632	K	24.8	Very low	29.3	Very low	169 Å²	169	142.7 Å²	142.7	74%	0.735	79%	0.79	S	S	*	*			trans	47.8	130	138.1	-65.8	-173.5	-175.4	172	0	123.5
633	P	28	Very low	29.8	Very low	128 Å²	128	141.9 Å²	141.9	83%	0.831	79%	0.785	S	S	*	*			trans	-99.9	163.5	147.5	37.7	-31.4	0	0	0	113.5
634	R	25.3	Very low	29.9	Very low	243 Å²	243	141.9 Å²	141.9	92%	0.917	79%	0.785	S	S	*	*			trans	-159	169	166.5	-129.2	-162.5	178.7	-169.4	0.6	110
635	P	45.7	Very low	30.1	Very low	117 Å²	117	141 Å²	141	76%	0.76	79%	0.787	S	S	*	*				-123.2	-172.3	-97.9	42.6	-28.6	0	0	0	113.8
636	A	26.7	Very low	30.4	Very low	102 Å²	102	145.2 Å²	145.2	84%	0.843	80%	0.796	S	S	*	*			trans	-120.9	154	171.3	0	0	0	0	0	113.3
637	S	29.6	Very low	30.6	Very low	114 Å²	114	146.5 Å²	146.5	80%	0.797	80%	0.802	S	S	*	*			trans	-104	168	177.7	53.5	0	0	0	0	110.2
638	S	31.4	Very low	31.2	Very low	95 Å²	95	142.7 Å²	142.7	66%	0.664	80%	0.796	S	S	*	*			cis	-173.8	151.3	-3.4	34.1	0	0	0	0	111.6
639	L	31.4	Very low	31.8	Very low	167 Å²	167	142.8 Å²	142.8	87%	0.874	80%	0.799	S	S	*	*			trans	56	119	143.7	-65.6	167.1	0	0	0	122.2
640	C	23.9	Very low	32.1	Very low	136 Å²	136	142.1 Å²	142.1	92%	0.919	80%	0.797	S	S	*	*				-158.5	171.3	123.7	-125.5	0	0	0	0	111.6
641	S	30.2	Very low	33.3	Very low	102 Å²	102	136.4 Å²	136.4	71%	0.713	78%	0.776	S	S	*	*			trans	-145.7	-178.1	-171	67.4	0	0	0	0	111.8
642	T	26.4	Very low	35.4	Very low	120 Å²	120	133.5 Å²	133.5	74%	0.736	77%	0.768	S	S	*	*			cis	-167.4	-176	18.2	-8.2	0	0	0	0	107
643	P	39.3	Very low	37.4	Very low	102 Å²	102	133.3 Å²	133.3	66%	0.662	76%	0.764	S	S	*	*			cis	-136.7	162	-22.2	39.5	-22.1	0	0	0	116.4
644	S	30.2	Very low	39.1	Very low	110 Å²	110	132.8 Å²	132.8	77%	0.769	76%	0.755	S	S	*	*			trans	46.5	116.7	143.1	67.3	0	0	0	0	123.7
645	K	31.3	Very low	41.3	Very low	215 Å²	215	125.2 Å²	125.2	94%	0.935	73%	0.729	S	S	*	*				-139.7	148.4	125.8	-104.5	177.1	-178.7	175.3	0	108.6
646	K	35.6	Very low	42.4	Very low	211 Å²	211	124.8 Å²	124.8	92%	0.917	72%	0.718	S	S	*	*			trans	-86.9	144.8	-175.2	-66.7	-176.4	178.9	-178.7	0	111.8
647	Q	32.3	Very low	44.3	Very low	186 Å²	186	123.5 Å²	123.5	87%	0.869	70%	0.696	S	S	*	*			trans	-132.1	161.4	168.3	-97	-177.9	-34.5	0	0	110.4
648	P	41.7	Very low	46.6	Very low	109 Å²	109	125.3 Å²	125.3	71%	0.708	69%	0.685	S	S	*	*	S	Bend	trans	-67.1	168.7	-178.7	28.3	-35.4	0	0	0	112.8	S650	P648-S650 PolarHBondContact O-N 3.19Å
649	P	44	Very low	48.9	Very low	134 Å²	134	124.4 Å²	124.4	87%	0.87	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-61.9	120.6	-167.8	24.1	-35.3	0	0	0	112.7
650	S	43.9	Very low	50.6	Low	106 Å²	106	119.1 Å²	119.1	74%	0.741	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-71.5	126.3	173.6	52.4	0	0	0	0	110.9	P648 T652	P648-S650 PolarHBondContact O-N 3.19Å; S650-T652 PolarHBondContact O-N 2.85Å
651	C	51.5	Low	53	Low	54 Å²	54	118.8 Å²	118.8	37%	0.365	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-52	132.1	153	172.1	0	0	0	0	108.3	E655 Q656	C651-E655 PolarHBondContact SG-OE2 3.49Å; C651-Q656 HydrophobicContact CB-CG 4.42Å
652	T	70.5	Confident	55.7	Low	83 Å²	83	119.7 Å²	119.7	51%	0.509	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-63.3	143.5	-173.3	13.7	0	0	0	0	111.9	S650 D654 E655 Q656	S650-T652 PolarHBondContact O-N 2.85Å; T652-D654 PolarHBondContact O-N 2.98Å; T652-E655 WeakPolarHBondContact O-CA 3.23Å; T652-E655 WeakPolarHBondContact O-CB 3.19Å; T652-E655 PolarHBondContact O-N 3.05Å; T652-Q656 PolarHBondContact O-N 3.38Å
653	Y	66.8	Low	58.1	Low	165 Å²	165	119 Å²	119	65%	0.647	62%	0.623	S	S	*	*	H	α-helix	trans	-53	-40.9	-180	176	-94	0	0	0	112.5	E655 Q656 L657	Y653-E655 PolarHBondContact O-N 3.39Å; Y653-Q656 PolarHBondContact O-N 3.38Å; Y653-L657 HydrophobicContact CE1-CD2 4.3Å; Y653-L657 VanDerWaalsContact O-CB 3.3Å; Y653-L657 WeakPolarHBondContact O-CB 3.42Å; Y653-L657 PolarHBondContact O-N 2.76Å
654	D	64.4	Low	59.8	Low	118 Å²	118	117.3 Å²	117.3	63%	0.631	61%	0.613	S	S	*	*	H	α-helix	trans	-65.5	-27.2	178.4	-53.5	-51	0	0	0	113.1	T652 R658	T652-D654 PolarHBondContact O-N 2.98Å; D654-R658 WeakPolarHBondContact O-CB 3.26Å; D654-R658 PolarHBondContact O-N 3.38Å
655	E	70.5	Confident	62.5	Low	83 Å²	83	115 Å²	115	39%	0.388	60%	0.601	S	S	.	*	H	α-helix	trans	-82.5	-39.2	177.5	-173	171.3	-136.9	0	0	111.2	C651 T652 Y653 L657 R658 I659	C651-E655 PolarHBondContact SG-OE2 3.49Å; T652-E655 WeakPolarHBondContact O-CA 3.23Å; T652-E655 WeakPolarHBondContact O-CB 3.19Å; T652-E655 PolarHBondContact O-N 3.05Å; Y653-E655 PolarHBondContact O-N 3.39Å; E655-L657 VanDerWaalsContact C-N 3.32Å; E655-R658 PolarHBondContact O-N 3.15Å; E655-I659 HydrophobicContact CG-CD1 4.47Å; E655-I659 VanDerWaalsContact O-CG1 3.31Å; E655-I659 WeakPolarHBondContact O-CG1 3.5Å; E655-I659 PolarHBondContact O-N 3.42Å
656	Q	67.9	Low	65.2	Low	109 Å²	109	112.4 Å²	112.4	51%	0.509	59%	0.586	S	S	.	*	H	α-helix	trans	-60.8	-41.9	168	-65.2	-174.9	-21.3	0	0	111.5	C651 T652 Y653 I659 A660	C651-Q656 HydrophobicContact CB-CG 4.42Å; T652-Q656 PolarHBondContact O-N 3.38Å; Y653-Q656 PolarHBondContact O-N 3.38Å; Q656-I659 PolarHBondContact O-N 3.02Å; Q656-A660 WeakPolarHBondContact O-CB 3.47Å; Q656-A660 PolarHBondContact O-N 3.1Å
657	L	67.1	Low	67.4	Low	75 Å²	75	108.8 Å²	108.8	39%	0.393	57%	0.572	S	S	.	*	H	α-helix	trans	-63.4	-42.7	174.8	179.8	60.9	0	0	0	111.5	Y653 E655 A660 M661	Y653-L657 HydrophobicContact CE1-CD2 4.3Å; Y653-L657 VanDerWaalsContact O-CB 3.3Å; Y653-L657 WeakPolarHBondContact O-CB 3.42Å; Y653-L657 PolarHBondContact O-N 2.76Å; E655-L657 VanDerWaalsContact C-N 3.32Å; L657-A660 PolarHBondContact O-N 3.22Å; L657-M661 HydrophobicContact CD1-CG 4.46Å; L657-M661 HydrophobicContact CG-SD 4.37Å; L657-M661 WeakPolarHBondContact O-CG 3.45Å; L657-M661 PolarHBondContact O-N 2.82Å
658	R	77.3	Confident	69.6	Low	151 Å²	151	105.3 Å²	105.3	57%	0.57	56%	0.556	S	S	*	*	H	α-helix	trans	-61.4	-44.9	175.7	-158.5	-170.2	83.7	-148.2	1	111.6	D654 E655 A660 M661 E662	D654-R658 WeakPolarHBondContact O-CB 3.26Å; D654-R658 PolarHBondContact O-N 3.38Å; E655-R658 PolarHBondContact O-N 3.15Å; R658-A660 PolarHBondContact O-N 2.84Å; R658-M661 PolarHBondContact O-N 2.94Å; R658-E662 WeakPolarHBondContact O-CB 3.48Å; R658-E662 PolarHBondContact O-N 3.38Å
659	I	79.9	Confident	71.8	Confident	77 Å²	77	106.7 Å²	106.7	40%	0.395	55%	0.552	S	S	.	*	H	α-helix	trans	-62.4	-42	176.6	-68.3	164	0	0	0	110.9	E655 Q656 E662 I663	E655-I659 HydrophobicContact CG-CD1 4.47Å; E655-I659 VanDerWaalsContact O-CG1 3.31Å; E655-I659 WeakPolarHBondContact O-CG1 3.5Å; E655-I659 PolarHBondContact O-N 3.42Å; Q656-I659 PolarHBondContact O-N 3.02Å; I659-E662 PolarHBondContact O-N 2.73Å; I659-I663 HydrophobicContact CG2-CD1 3.78Å; I659-I663 HydrophobicContact CG2-CG1 4.43Å; I659-I663 VanDerWaalsContact O-CG1 3.29Å; I659-I663 WeakPolarHBondContact O-CG1 3.42Å; I659-I663 PolarHBondContact O-N 3.47Å
660	A	68.7	Low	73.7	Confident	55 Å²	55	104.4 Å²	104.4	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-40.1	176.5	0	0	0	0	0	112.7	Q656 L657 R658 S664	Q656-A660 WeakPolarHBondContact O-CB 3.47Å; Q656-A660 PolarHBondContact O-N 3.1Å; L657-A660 PolarHBondContact O-N 3.22Å; R658-A660 PolarHBondContact O-N 2.84Å; A660-S664 WeakPolarHBondContact O-CB 3.47Å; A660-S664 PolarHBondContact O-N 3.17Å
661	M	73.1	Confident	75.3	Confident	129 Å²	129	101.2 Å²	101.2	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-66.5	-38.4	173.9	-70.5	179	68.3	0	0	112.3	L657 R658 S664 A665	L657-M661 HydrophobicContact CD1-CG 4.46Å; L657-M661 HydrophobicContact CG-SD 4.37Å; L657-M661 WeakPolarHBondContact O-CG 3.45Å; L657-M661 PolarHBondContact O-N 2.82Å; R658-M661 PolarHBondContact O-N 2.94Å; M661-S664 PolarHBondContact O-N 3.04Å; M661-A665 WeakPolarHBondContact O-CB 3.29Å; M661-A665 PolarHBondContact O-N 2.99Å
662	E	86.6	Confident	76.7	Confident	121 Å²	121	101.2 Å²	101.2	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-67.6	-41.2	178.2	-167.5	170.3	169.1	0	0	111.7	R658 I659 R666	R658-E662 WeakPolarHBondContact O-CB 3.48Å; R658-E662 PolarHBondContact O-N 3.38Å; I659-E662 PolarHBondContact O-N 2.73Å; E662-R666 WeakPolarHBondContact O-CB 3.17Å; E662-R666 PolarHBondContact O-N 3.07Å; E662-R666 VanDerWaalsContact O-N 3.14Å
663	I	78.4	Confident	77.5	Confident	106 Å²	106	101.5 Å²	101.5	54%	0.544	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-48.1	172	-68.9	166.6	0	0	0	110.9	I659 A665 R666 E667	I659-I663 HydrophobicContact CG2-CD1 3.78Å; I659-I663 HydrophobicContact CG2-CG1 4.43Å; I659-I663 VanDerWaalsContact O-CG1 3.29Å; I659-I663 WeakPolarHBondContact O-CG1 3.42Å; I659-I663 PolarHBondContact O-N 3.47Å; I663-A665 PolarHBondContact O-N 3.25Å; I663-R666 PolarHBondContact O-N 2.99Å; I663-E667 WeakPolarHBondContact O-CB 3.48Å; I663-E667 PolarHBondContact O-N 3.12Å
664	S	74.4	Confident	78.4	Confident	66 Å²	66	101.2 Å²	101.2	46%	0.462	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-38.2	-179.5	178.9	0	0	0	0	112.8	A660 M661 R666 E667 Q668	A660-S664 WeakPolarHBondContact O-CB 3.47Å; A660-S664 PolarHBondContact O-N 3.17Å; M661-S664 PolarHBondContact O-N 3.04Å; S664-R666 VanDerWaalsContact C-N 3.33Å; S664-E667 PolarHBondContact O-N 2.7Å; S664-Q668 WeakPolarHBondContact O-CB 3.21Å; S664-Q668 PolarHBondContact O-N 3.09Å
665	A	85.8	Confident	79	Confident	63 Å²	63	101.1 Å²	101.1	52%	0.521	49%	0.493	S	S	.	.	H	α-helix	trans	-64.2	-38.5	174.3	0	0	0	0	0	112.2	M661 I663 Q668 E669	M661-A665 WeakPolarHBondContact O-CB 3.29Å; M661-A665 PolarHBondContact O-N 2.99Å; I663-A665 PolarHBondContact O-N 3.25Å; A665-Q668 WeakPolarHBondContact O-CB 3.36Å; A665-E669 PolarHBondContact O-N 3.25Å
666	R	88.1	Confident	79.9	Confident	160 Å²	160	103.7 Å²	103.7	60%	0.604	50%	0.5	S	S	*	.	H	α-helix	trans	-69	-42.1	175	-179.4	179.6	170.4	145.3	7.3	112.6	E662 I663 S664 Q668 E669 E670	E662-R666 WeakPolarHBondContact O-CB 3.17Å; E662-R666 PolarHBondContact O-N 3.07Å; E662-R666 VanDerWaalsContact O-N 3.14Å; I663-R666 PolarHBondContact O-N 2.99Å; S664-R666 VanDerWaalsContact C-N 3.33Å; R666-Q668 VanDerWaalsContact C-N 3.28Å; R666-Q668 PolarHBondContact O-N 3.13Å; R666-E669 PolarHBondContact O-N 3.03Å; R666-E670 IonicContact CZ-OE1 3.77Å; R666-E670 VanDerWaalsContact CZ-OE1 3.31Å; R666-E670 IonicContact NE-OE1 2.9Å; R666-E670 PolarHBondContact NE-OE1 3.13Å; R666-E670 IonicContact NH2-OE1 3.69Å; R666-E670 PolarHBondContact NH2-OE1 2.94Å; R666-E670 PolarHBondContact O-N 3.42Å
667	E	82.1	Confident	80.7	Confident	135 Å²	135	104 Å²	104	63%	0.631	50%	0.501	S	S	*	.	H	α-helix	trans	-62	-38.7	175.6	-174.4	171.8	-152.3	0	0	111.2	I663 S664 A671	I663-E667 WeakPolarHBondContact O-CB 3.48Å; I663-E667 PolarHBondContact O-N 3.12Å; S664-E667 PolarHBondContact O-N 2.7Å; E667-A671 VanDerWaalsContact O-CB 3.26Å; E667-A671 WeakPolarHBondContact O-CB 3.47Å; E667-A671 PolarHBondContact O-N 3.42Å
668	Q	79.1	Confident	80.9	Confident	113 Å²	113	105.9 Å²	105.9	53%	0.528	51%	0.508	S	S	.	.	H	α-helix	trans	-61.6	-43	172	-170	72	52.7	0	0	112.1	S664 A665 R666 A671 D672	S664-Q668 WeakPolarHBondContact O-CB 3.21Å; S664-Q668 PolarHBondContact O-N 3.09Å; A665-Q668 WeakPolarHBondContact O-CB 3.36Å; R666-Q668 VanDerWaalsContact C-N 3.28Å; R666-Q668 PolarHBondContact O-N 3.13Å; Q668-A671 PolarHBondContact O-N 3.42Å; Q668-D672 PolarHBondContact O-N 2.94Å
669	E	87.1	Confident	80.9	Confident	137 Å²	137	104.2 Å²	104.2	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-68.6	-42.6	177.6	-174.7	171.1	-148.4	0	0	112.3	A665 R666 A671 D672 L673	A665-E669 PolarHBondContact O-N 3.25Å; R666-E669 PolarHBondContact O-N 3.03Å; E669-A671 VanDerWaalsContact C-N 3.29Å; E669-A671 PolarHBondContact O-N 3.31Å; E669-D672 PolarHBondContact O-N 2.92Å; E669-L673 WeakPolarHBondContact O-CB 3.19Å; E669-L673 PolarHBondContact O-N 2.92Å
670	E	84.4	Confident	81.4	Confident	86 Å²	86	106.2 Å²	106.2	40%	0.402	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-33.2	174.8	-70	-175.8	-162	0	0	111.5	R666 L673 R674	R666-E670 IonicContact CZ-OE1 3.77Å; R666-E670 VanDerWaalsContact CZ-OE1 3.31Å; R666-E670 IonicContact NE-OE1 2.9Å; R666-E670 PolarHBondContact NE-OE1 3.13Å; R666-E670 IonicContact NH2-OE1 3.69Å; R666-E670 PolarHBondContact NH2-OE1 2.94Å; R666-E670 PolarHBondContact O-N 3.42Å; E670-L673 PolarHBondContact O-N 3.45Å; E670-R674 WeakPolarHBondContact O-CG 3.48Å; E670-R674 PolarHBondContact O-N 3.5Å; E670-R674 VanDerWaalsContact O-N 3.09Å
671	A	77.2	Confident	82.1	Confident	40 Å²	40	109.7 Å²	109.7	33%	0.331	52%	0.521	S	S	.	.	H	α-helix	trans	-76.2	-30.2	174	0	0	0	0	0	114.2	E667 Q668 E669 R675	E667-A671 VanDerWaalsContact O-CB 3.26Å; E667-A671 WeakPolarHBondContact O-CB 3.47Å; E667-A671 PolarHBondContact O-N 3.42Å; Q668-A671 PolarHBondContact O-N 3.42Å; E669-A671 VanDerWaalsContact C-N 3.29Å; E669-A671 PolarHBondContact O-N 3.31Å; A671-R675 PolarHBondContact O-N 2.91Å; A671-R675 PolarHBondContact O-NE 2.91Å
672	D	81.4	Confident	82.2	Confident	53 Å²	53	108.3 Å²	108.3	28%	0.283	52%	0.516	S	S	.	.	H	α-helix	trans	-69.1	-37.2	168.1	-86.2	-2.9	0	0	0	110.9	Q668 E669 R675 R676	Q668-D672 PolarHBondContact O-N 2.94Å; E669-D672 PolarHBondContact O-N 2.92Å; D672-R675 IonicContact OD1-CZ 2.99Å; D672-R675 VanDerWaalsContact OD1-CZ 3.3Å; D672-R675 IonicContact OD1-NH1 3.64Å; D672-R675 PolarHBondContact OD1-NH1 3.19Å; D672-R675 IonicContact OD1-NH2 2.76Å; D672-R675 PolarHBondContact OD1-NH2 3.21Å; D672-R676 WeakPolarHBondContact O-CG 3.01Å; D672-R676 PolarHBondContact O-N 2.83Å
673	L	87.5	Confident	81.7	Confident	90 Å²	90	109.1 Å²	109.1	47%	0.471	52%	0.519	S	S	.	.	H	α-helix	trans	-66.7	-43.6	178.3	-156.4	94.3	0	0	0	111.8	E669 E670 R676 Q677	E669-L673 WeakPolarHBondContact O-CB 3.19Å; E669-L673 PolarHBondContact O-N 2.92Å; E670-L673 PolarHBondContact O-N 3.45Å; L673-R676 PolarHBondContact O-N 3.39Å; L673-Q677 PolarHBondContact O-N 3.39Å; L673-Q677 VanDerWaalsContact O-N 3.13Å
674	R	84.9	Confident	81.8	Confident	158 Å²	158	112.2 Å²	112.2	60%	0.596	52%	0.524	S	S	*	.	H	α-helix	trans	-59.6	-46.6	174.8	-73.5	-176.8	-165.2	-171.6	7.3	112	E670 R676 Q677 E678	E670-R674 WeakPolarHBondContact O-CG 3.48Å; E670-R674 PolarHBondContact O-N 3.5Å; E670-R674 VanDerWaalsContact O-N 3.09Å; R674-R676 VanDerWaalsContact C-N 3.29Å; R674-R676 PolarHBondContact O-N 3.3Å; R674-Q677 WeakPolarHBondContact O-CA 3.12Å; R674-Q677 WeakPolarHBondContact O-CB 3.47Å; R674-Q677 PolarHBondContact O-N 3.28Å; R674-E678 WeakPolarHBondContact O-CG 3.43Å; R674-E678 PolarHBondContact O-N 2.97Å
675	R	78.1	Confident	81.8	Confident	117 Å²	117	113.7 Å²	113.7	44%	0.442	53%	0.526	S	S	.	.	H	α-helix	trans	-58.5	-38	177.2	-90.9	179.2	-75.4	138.6	-0.3	113.1	A671 D672 E678 E679	A671-R675 PolarHBondContact O-N 2.91Å; A671-R675 PolarHBondContact O-NE 2.91Å; D672-R675 IonicContact OD1-CZ 2.99Å; D672-R675 VanDerWaalsContact OD1-CZ 3.3Å; D672-R675 IonicContact OD1-NH1 3.64Å; D672-R675 PolarHBondContact OD1-NH1 3.19Å; D672-R675 IonicContact OD1-NH2 2.76Å; D672-R675 PolarHBondContact OD1-NH2 3.21Å; R675-E678 PolarHBondContact O-N 3.02Å; R675-E679 WeakPolarHBondContact O-CB 3.45Å; R675-E679 VanDerWaalsContact O-CG 3.3Å; R675-E679 WeakPolarHBondContact O-CG 3.37Å; R675-E679 PolarHBondContact O-N 3.21Å
676	R	88.6	Confident	81	Confident	137 Å²	137	114.9 Å²	114.9	52%	0.517	52%	0.523	S	S	.	.	H	α-helix	trans	-66.3	-38.3	173.8	-66.3	177.6	-152.8	154.7	11.7	112.4	D672 L673 R674 E679 E680	D672-R676 WeakPolarHBondContact O-CG 3.01Å; D672-R676 PolarHBondContact O-N 2.83Å; L673-R676 PolarHBondContact O-N 3.39Å; R674-R676 VanDerWaalsContact C-N 3.29Å; R674-R676 PolarHBondContact O-N 3.3Å; R676-E679 PolarHBondContact O-N 2.7Å; R676-E680 WeakPolarHBondContact O-CB 3.47Å; R676-E680 WeakPolarHBondContact O-CG 3.36Å; R676-E680 PolarHBondContact O-N 2.83Å
677	Q	85.1	Confident	80.2	Confident	116 Å²	116	113.2 Å²	113.2	54%	0.542	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-41.7	175.1	-69.3	176.2	-17.2	0	0	111.7	L673 R674 E680 E681	L673-Q677 PolarHBondContact O-N 3.39Å; L673-Q677 VanDerWaalsContact O-N 3.13Å; R674-Q677 WeakPolarHBondContact O-CA 3.12Å; R674-Q677 WeakPolarHBondContact O-CB 3.47Å; R674-Q677 PolarHBondContact O-N 3.28Å; Q677-E680 PolarHBondContact O-N 3.49Å; Q677-E681 WeakPolarHBondContact O-CB 3.32Å; Q677-E681 PolarHBondContact O-N 2.91Å
678	E	72.1	Confident	79.7	Confident	114 Å²	114	112.4 Å²	112.4	53%	0.533	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-41.6	174	-68.7	161.3	-169.8	0	0	111.5	R674 R675 L682	R674-E678 WeakPolarHBondContact O-CG 3.43Å; R674-E678 PolarHBondContact O-N 2.97Å; R675-E678 PolarHBondContact O-N 3.02Å; E678-L682 WeakPolarHBondContact O-CB 3.34Å; E678-L682 PolarHBondContact O-N 3.47Å
679	E	77.2	Confident	78.8	Confident	115 Å²	115	110.8 Å²	110.8	54%	0.537	52%	0.522	S	S	.	.	H	α-helix	trans	-66.6	-41.6	174.5	-76.1	173.8	-175.9	0	0	112.7	R675 R676 Q683	R675-E679 WeakPolarHBondContact O-CB 3.45Å; R675-E679 VanDerWaalsContact O-CG 3.3Å; R675-E679 WeakPolarHBondContact O-CG 3.37Å; R675-E679 PolarHBondContact O-N 3.21Å; R676-E679 PolarHBondContact O-N 2.7Å; E679-Q683 WeakPolarHBondContact O-CG 3.38Å; E679-Q683 PolarHBondContact O-N 3.02Å
680	E	89.5	Confident	77.9	Confident	119 Å²	119	109.9 Å²	109.9	56%	0.556	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-40.8	175.7	-78.2	-179	-156.6	0	0	112.3	R676 Q677 Q683 R684	R676-E680 WeakPolarHBondContact O-CB 3.47Å; R676-E680 WeakPolarHBondContact O-CG 3.36Å; R676-E680 PolarHBondContact O-N 2.83Å; Q677-E680 PolarHBondContact O-N 3.49Å; E680-Q683 PolarHBondContact O-N 3.31Å; E680-R684 WeakPolarHBondContact O-CG 3.31Å; E680-R684 PolarHBondContact O-N 3.13Å
681	E	82.9	Confident	76.8	Confident	129 Å²	129	113 Å²	113	60%	0.603	54%	0.537	S	S	*	.	H	α-helix	trans	-66.6	-43.3	175.3	-176.7	164.6	-138.3	0	0	111.2	Q677 Q683 R684 I685	Q677-E681 WeakPolarHBondContact O-CB 3.32Å; Q677-E681 PolarHBondContact O-N 2.91Å; E681-Q683 VanDerWaalsContact C-N 3.34Å; E681-Q683 PolarHBondContact O-N 3.18Å; E681-R684 WeakPolarHBondContact O-CB 3.46Å; E681-R684 PolarHBondContact O-N 2.87Å; E681-I685 HydrophobicContact CG-CD1 3.94Å; E681-I685 WeakPolarHBondContact O-CG1 3.24Å; E681-I685 PolarHBondContact O-N 3.25Å
682	L	75.3	Confident	75.8	Confident	100 Å²	100	119.5 Å²	119.5	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-59.7	-42.4	174	-177.3	63	0	0	0	111.8	E678 I685 I686	E678-L682 WeakPolarHBondContact O-CB 3.34Å; E678-L682 PolarHBondContact O-N 3.47Å; L682-I685 PolarHBondContact O-N 3.24Å; L682-I686 HydrophobicContact CD1-CD1 4.25Å; L682-I686 HydrophobicContact CG-CD1 3.98Å; L682-I686 VanDerWaalsContact O-CG1 3.28Å; L682-I686 WeakPolarHBondContact O-CG1 3.39Å; L682-I686 PolarHBondContact O-N 3.31Å
683	Q	76.8	Confident	73.9	Confident	137 Å²	137	128.6 Å²	128.6	64%	0.64	60%	0.598	S	S	*	*	H	α-helix	trans	-62.3	-41.1	174.7	-77	-176.6	30.6	0	0	112.4	E679 E680 E681 I686 Q687	E679-Q683 WeakPolarHBondContact O-CG 3.38Å; E679-Q683 PolarHBondContact O-N 3.02Å; E680-Q683 PolarHBondContact O-N 3.31Å; E681-Q683 VanDerWaalsContact C-N 3.34Å; E681-Q683 PolarHBondContact O-N 3.18Å; Q683-I686 PolarHBondContact O-N 3.03Å; Q683-Q687 WeakPolarHBondContact O-CB 3.45Å; Q683-Q687 PolarHBondContact O-N 3.37Å
684	R	79.3	Confident	73.3	Confident	172 Å²	172	130.6 Å²	130.6	65%	0.649	61%	0.605	S	S	*	*	H	α-helix	trans	-62.4	-44.2	173.7	-73.5	-178.1	-176.4	179.7	5.6	112.2	E680 E681 I686 Q687 L688	E680-R684 WeakPolarHBondContact O-CG 3.31Å; E680-R684 PolarHBondContact O-N 3.13Å; E681-R684 WeakPolarHBondContact O-CB 3.46Å; E681-R684 PolarHBondContact O-N 2.87Å; R684-I686 VanDerWaalsContact C-N 3.35Å; R684-I686 PolarHBondContact O-N 3.07Å; R684-Q687 PolarHBondContact O-N 3.32Å; R684-L688 WeakPolarHBondContact O-CB 3.36Å; R684-L688 VanDerWaalsContact O-CG 3.3Å; R684-L688 WeakPolarHBondContact O-CG 3.3Å; R684-L688 PolarHBondContact O-N 3.34Å
685	I	75.2	Confident	72.6	Confident	96 Å²	96	129.1 Å²	129.1	49%	0.492	61%	0.605	S	S	.	*	H	α-helix	trans	-61.9	-43.8	178.7	-69	165.3	0	0	0	110.6	E681 L682 L688 S689	E681-I685 HydrophobicContact CG-CD1 3.94Å; E681-I685 WeakPolarHBondContact O-CG1 3.24Å; E681-I685 PolarHBondContact O-N 3.25Å; L682-I685 PolarHBondContact O-N 3.24Å; I685-L688 PolarHBondContact O-N 3.21Å; I685-S689 WeakPolarHBondContact O-CB 3.45Å; I685-S689 PolarHBondContact O-N 3.15Å
686	I	69.4	Low	72.3	Confident	89 Å²	89	129.8 Å²	129.8	46%	0.456	61%	0.614	S	S	.	*	H	α-helix	trans	-62.1	-44	174.8	-69.2	165.5	0	0	0	111	L682 Q683 R684 S689 L690	L682-I686 HydrophobicContact CD1-CD1 4.25Å; L682-I686 HydrophobicContact CG-CD1 3.98Å; L682-I686 VanDerWaalsContact O-CG1 3.28Å; L682-I686 WeakPolarHBondContact O-CG1 3.39Å; L682-I686 PolarHBondContact O-N 3.31Å; Q683-I686 PolarHBondContact O-N 3.03Å; R684-I686 VanDerWaalsContact C-N 3.35Å; R684-I686 PolarHBondContact O-N 3.07Å; I686-S689 PolarHBondContact O-N 3.37Å; I686-L690 HydrophobicContact CG2-CD1 4Å; I686-L690 WeakPolarHBondContact O-CG 3.43Å; I686-L690 PolarHBondContact O-N 3.26Å
687	Q	72.1	Confident	71.4	Confident	125 Å²	125	129.4 Å²	129.4	58%	0.584	62%	0.62	S	S	*	*	H	α-helix	trans	-64.8	-42.6	179.8	-170.2	174.1	16	0	0	112.2	Q683 R684 L690 M691	Q683-Q687 WeakPolarHBondContact O-CB 3.45Å; Q683-Q687 PolarHBondContact O-N 3.37Å; R684-Q687 PolarHBondContact O-N 3.32Å; Q687-L690 PolarHBondContact O-N 2.89Å; Q687-M691 WeakPolarHBondContact O-CG 3.34Å; Q687-M691 PolarHBondContact O-N 3.25Å
688	L	70.7	Confident	70.5	Confident	118 Å²	118	130.2 Å²	130.2	62%	0.618	63%	0.625	S	S	*	*	H	α-helix	trans	-63	-47.1	174.7	-70.5	165.5	0	0	0	111.2	R684 I685 L690 M691 E692	R684-L688 WeakPolarHBondContact O-CB 3.36Å; R684-L688 VanDerWaalsContact O-CG 3.3Å; R684-L688 WeakPolarHBondContact O-CG 3.3Å; R684-L688 PolarHBondContact O-N 3.34Å; I685-L688 PolarHBondContact O-N 3.21Å; L688-L690 PolarHBondContact O-N 2.99Å; L688-L690 VanDerWaalsContact O-N 3.15Å; L688-M691 PolarHBondContact O-N 3.3Å; L688-E692 PolarHBondContact O-N 3.23Å
689	S	59.2	Low	70.4	Confident	79 Å²	79	131.3 Å²	131.3	55%	0.552	63%	0.631	S	S	*	*	H	α-helix	trans	-63.4	-18.9	177.2	-177.3	0	0	0	0	114.1	I685 I686	I685-S689 WeakPolarHBondContact O-CB 3.45Å; I685-S689 PolarHBondContact O-N 3.15Å; I686-S689 PolarHBondContact O-N 3.37Å
690	L	68.6	Low	69.9	Low	118 Å²	118	132.4 Å²	132.4	62%	0.618	64%	0.637	S	S	*	*	H	α-helix	trans	-86.4	-18.2	173.1	-76.1	168.4	0	0	0	113.4	I686 Q687 L688	I686-L690 HydrophobicContact CG2-CD1 4Å; I686-L690 WeakPolarHBondContact O-CG 3.43Å; I686-L690 PolarHBondContact O-N 3.26Å; Q687-L690 PolarHBondContact O-N 2.89Å; L688-L690 PolarHBondContact O-N 2.99Å; L688-L690 VanDerWaalsContact O-N 3.15Å
691	M	62.7	Low	68.4	Low	150 Å²	150	133.5 Å²	133.5	74%	0.739	64%	0.644	S	S	*	*	H	α-helix	trans	-93.6	-17	177.2	-68	-179.2	64.9	0	0	113.3	Q687 L688 K693	Q687-M691 WeakPolarHBondContact O-CG 3.34Å; Q687-M691 PolarHBondContact O-N 3.25Å; L688-M691 PolarHBondContact O-N 3.3Å; M691-K693 VanDerWaalsContact C-N 3.32Å; M691-K693 PolarHBondContact O-N 3.4Å
692	E	55.1	Low	67.2	Low	177 Å²	177	133.8 Å²	133.8	83%	0.827	65%	0.647	S	S	*	*			trans	-91.8	50.1	-177	-157.9	169.9	-129.7	0	0	112.3	L688	L688-E692 PolarHBondContact O-N 3.23Å
693	K	42.2	Very low	66.5	Low	245 Å²	245	136.9 Å²	136.9	100%	1.065	66%	0.658	S	S	*	*			trans	-123.2	0	-175.4	-94	-170.9	175	179.8	0	114.2	M691	M691-K693 VanDerWaalsContact C-N 3.32Å; M691-K693 PolarHBondContact O-N 3.4Å

Retrieved 693 of 693 residues in 396.9 ms (Link to these results)

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