A0A077Z5L9_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077Z5L9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 447 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	29.1	Very low	246 Å²	246	163.3 Å²	163.3	100%	1.212	90%	0.895	S	S	*	*				0	80.3	0	-77.4	174.1	165.8	0	0	109.5
2	K	31.5	Very low	29.3	Very low	215 Å²	215	166.1 Å²	166.1	94%	0.935	90%	0.897	S	S	*	*			trans	-151.2	111.7	166.6	-78.6	-167.4	177.1	179.3	0	106.5
3	T	32.9	Very low	29.3	Very low	151 Å²	151	167.5 Å²	167.5	93%	0.926	90%	0.895	S	S	*	*			trans	-79.5	116.9	177.9	28.6	0	0	0	0	109.2
4	G	24.7	Very low	29.2	Very low	78 Å²	78	164.7 Å²	164.7	80%	0.804	89%	0.89	S	S	*	*			trans	-96.7	128.5	162.2	0	0	0	0	0	108.7
5	A	30.8	Very low	29.1	Very low	90 Å²	90	160.4 Å²	160.4	74%	0.744	88%	0.877	S	S	*	*			trans	-108.2	113.5	177.2	0	0	0	0	0	109.7
6	H	25.7	Very low	29.2	Very low	196 Å²	196	158.7 Å²	158.7	91%	0.907	88%	0.877	S	S	*	*			trans	-73.6	138.2	160.2	-86.3	-72.5	0	0	0	109.4
7	F	29.9	Very low	29.1	Very low	201 Å²	201	153.5 Å²	153.5	88%	0.882	87%	0.868	S	S	*	*			trans	-118.5	132	161.7	-95.7	-86.7	0	0	0	110.6
8	K	28.3	Very low	29	Very low	203 Å²	203	154.6 Å²	154.6	88%	0.883	86%	0.857	S	S	*	*			trans	-78.1	147.5	-178.7	-81.3	176.4	167.4	-179.3	0	111.6
9	E	25.3	Very low	28.8	Very low	197 Å²	197	151.8 Å²	151.8	92%	0.921	84%	0.841	S	S	*	*			trans	-70.2	138.5	167.6	-66.1	173.5	153	0	0	111.8
10	V	30.4	Very low	28.7	Very low	147 Å²	147	152.5 Å²	152.5	89%	0.891	84%	0.835	S	S	*	*			trans	-135.8	126.3	158.2	-179.4	0	0	0	0	106.4
11	G	26.1	Very low	28.5	Very low	72 Å²	72	154.6 Å²	154.6	74%	0.742	83%	0.831	S	S	*	*			trans	-84.7	150.8	-172	0	0	0	0	0	114.4
12	E	31.4	Very low	28.1	Very low	197 Å²	197	151.7 Å²	151.7	92%	0.921	81%	0.808	S	S	*	*			trans	-142.8	143.8	160	-94.7	178.4	170.7	0	0	108.2
13	E	29	Very low	27.9	Very low	185 Å²	185	145.3 Å²	145.3	86%	0.864	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-63.3	149.8	-166.4	-64.9	179.2	149.9	0	0	114.7	S15	E13-S15 PolarHBondContact O-N 2.77Å
14	P	28.7	Very low	27.5	Very low	128 Å²	128	146 Å²	146	83%	0.831	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.4	119	-176.4	32.5	-30.6	0	0	0	111.5
15	S	27.1	Very low	27.6	Very low	100 Å²	100	148.5 Å²	148.5	70%	0.699	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.7	155.3	158	35	0	0	0	0	110	E13 G17	E13-S15 PolarHBondContact O-N 2.77Å; S15-G17 PolarHBondContact O-N 3.15Å
16	P	30.1	Very low	27.5	Very low	133 Å²	133	146.9 Å²	146.9	86%	0.864	75%	0.75	S	S	*	*	S	Bend	trans	-59	111.5	-160.8	-18.6	30.2	0	0	0	111.6	Y18	P16-Y18 PolarHBondContact O-N 3.21Å
17	G	27.4	Very low	27.6	Very low	71 Å²	71	143 Å²	143	73%	0.732	74%	0.735	S	S	*	*			trans	-71.5	121.9	-168.9	0	0	0	0	0	113	S15 D19	S15-G17 PolarHBondContact O-N 3.15Å; G17-D19 PolarHBondContact O-N 2.89Å
18	Y	27.3	Very low	27.4	Very low	172 Å²	172	138.8 Å²	138.8	68%	0.675	73%	0.725	S	S	*	*			trans	-66.5	119.8	149.5	-94.4	-98.5	0	0	0	108	P16 F20	P16-Y18 PolarHBondContact O-N 3.21Å; Y18-F20 WeakPolarHBondContact O-CD2 3.15Å; Y18-F20 PolarHBondContact O-N 2.65Å
19	D	25.1	Very low	27.4	Very low	103 Å²	103	132 Å²	132	55%	0.551	70%	0.704	S	S	*	*			trans	-70.9	94	178.7	-168.7	-1.3	0	0	0	110.6	G17 R21 Y22	G17-D19 PolarHBondContact O-N 2.89Å; D19-R21 PolarHBondContact O-N 2.93Å; D19-R21 WeakPolarHBondContact OD1-CB 3.06Å; D19-R21 VanDerWaalsContact OD1-CD 3.31Å; D19-R21 WeakPolarHBondContact OD1-CD 3.4Å; D19-R21 WeakPolarHBondContact OD1-CG 3.46Å; D19-R21 PolarHBondContact OD1-N 3.12Å; D19-Y22 PolarHBondContact O-N 2.66Å
20	F	27.8	Very low	27.5	Very low	164 Å²	164	122.8 Å²	122.8	72%	0.719	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.5	-3.1	174.3	-82.2	-86.8	0	0	0	113.9	Y18 Y22 V23	Y18-F20 WeakPolarHBondContact O-CD2 3.15Å; Y18-F20 PolarHBondContact O-N 2.65Å; F20-Y22 VanDerWaalsContact C-N 3.3Å; F20-Y22 PolarHBondContact O-N 2.77Å; F20-V23 PolarHBondContact O-N 2.93Å
21	R	24.9	Very low	27.6	Very low	197 Å²	197	116.5 Å²	116.5	74%	0.743	62%	0.623	S	S	*	*	H	α-helix	trans	-71.8	-22.2	177.6	-63.5	170.6	-175.2	163.2	2.5	113	D19	D19-R21 PolarHBondContact O-N 2.93Å; D19-R21 WeakPolarHBondContact OD1-CB 3.06Å; D19-R21 VanDerWaalsContact OD1-CD 3.31Å; D19-R21 WeakPolarHBondContact OD1-CD 3.4Å; D19-R21 WeakPolarHBondContact OD1-CG 3.46Å; D19-R21 PolarHBondContact OD1-N 3.12Å
22	Y	25.7	Very low	27.8	Very low	186 Å²	186	119.1 Å²	119.1	73%	0.729	62%	0.616	S	S	*	*	H	α-helix	trans	-72.5	-34	175.8	-139.7	-92.6	0	0	0	112.4	D19 F20 K24 I26	D19-Y22 PolarHBondContact O-N 2.66Å; F20-Y22 VanDerWaalsContact C-N 3.3Å; F20-Y22 PolarHBondContact O-N 2.77Å; Y22-K24 PolarHBondContact O-N 2.77Å; Y22-I26 HydrophobicContact CD1-CD1 4.13Å; Y22-I26 WeakPolarHBondContact O-CG1 3.35Å
23	V	27.7	Very low	28.2	Very low	80 Å²	80	112 Å²	112	49%	0.485	58%	0.584	S	S	.	*	H	α-helix	trans	-72.7	-28.6	-180	-176.8	0	0	0	0	112.1	F20 N25 I26	F20-V23 PolarHBondContact O-N 2.93Å; V23-N25 VanDerWaalsContact C-N 3.34Å; V23-N25 PolarHBondContact O-N 2.88Å; V23-I26 PolarHBondContact O-N 3.12Å
24	K	24.8	Very low	28.5	Very low	165 Å²	165	114.2 Å²	114.2	72%	0.717	59%	0.585	S	S	*	*	H	α-helix	trans	-74.3	-22.1	-177.2	-132.9	177.5	-175.6	179.3	0	113.9	Y22	Y22-K24 PolarHBondContact O-N 2.77Å
25	N	26.2	Very low	29.3	Very low	131 Å²	131	111.2 Å²	111.2	70%	0.701	56%	0.561	S	S	*	*	H	α-helix	trans	-89.7	-15.9	177	-73.3	-19.5	0	0	0	113.3	V23	V23-N25 VanDerWaalsContact C-N 3.34Å; V23-N25 PolarHBondContact O-N 2.88Å
26	I	29.6	Very low	30.2	Very low	57 Å²	57	115.4 Å²	115.4	29%	0.292	57%	0.569	S	S	.	*	H	α-helix	trans	-82.4	-22.3	179.6	-63.5	171.2	0	0	0	111.7	Y22 V23 V28 S29 Y366	Y22-I26 HydrophobicContact CD1-CD1 4.13Å; Y22-I26 WeakPolarHBondContact O-CG1 3.35Å; V23-I26 PolarHBondContact O-N 3.12Å; I26-V28 PolarHBondContact O-N 2.89Å; I26-S29 PolarHBondContact O-N 2.9Å; I26-S29 PolarHBondContact O-OG 3.17Å; I26-Y366 HydrophobicContact CG2-CD1 4.38Å; I26-Y366 HydrophobicContact CG2-CE1 3.75Å
27	L	26.6	Very low	31.1	Very low	115 Å²	115	110 Å²	110	60%	0.602	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-0.4	173.3	-76.7	162.9	0	0	0	114.4	Y366	L27-Y366 VanDerWaalsContact CD2-OH 3.31Å; L27-Y366 WeakPolarHBondContact CD2-OH 3.42Å
28	V	26.6	Very low	32.2	Very low	111 Å²	111	110.5 Å²	110.5	67%	0.673	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	4.2	179.6	-170.2	0	0	0	0	112.4	I26 G30	I26-V28 PolarHBondContact O-N 2.89Å; V28-G30 PolarHBondContact O-N 3.07Å; V28-G30 VanDerWaalsContact O-N 3.08Å
29	S	28.3	Very low	33.7	Very low	61 Å²	61	103.7 Å²	103.7	43%	0.427	50%	0.498	S	S	.	.			trans	-79.8	94.2	174.4	56.9	0	0	0	0	110.9	I26	I26-S29 PolarHBondContact O-N 2.9Å; I26-S29 PolarHBondContact O-OG 3.17Å
30	G	27.8	Very low	35.5	Very low	4 Å²	4	100.9 Å²	100.9	4%	0.041	49%	0.486	C	S	.	.			trans	-66.4	168.1	167.6	0	0	0	0	0	112.7	V28 H32 P73	V28-G30 PolarHBondContact O-N 3.07Å; V28-G30 VanDerWaalsContact O-N 3.08Å; G30-H32 VanDerWaalsContact C-N 3.33Å; G30-H32 PolarHBondContact O-N 3.4Å; G30-P73 CarbonylContact C-O 3.15Å; G30-P73 WeakPolarHBondContact CA-O 3.43Å
31	L	31.8	Very low	37.4	Very low	14 Å²	14	95 Å²	95	7%	0.073	46%	0.464	C	S	.	.			trans	-51	95.5	173	-83.3	175.5	0	0	0	109.9	D33 P73 Y74 F398	L31-D33 PolarHBondContact O-N 3.35Å; L31-P73 PolarHBondContact N-O 3.44Å; L31-Y74 HydrophobicContact CB-CD1 4.41Å; L31-Y74 HydrophobicContact CD1-CD1 3.37Å; L31-Y74 HydrophobicContact CD1-CE1 3.41Å; L31-Y74 VanDerWaalsContact CD1-CE1 3.41Å; L31-Y74 HydrophobicContact CG-CD1 3.87Å; L31-Y74 HydrophobicContact CG-CE1 3.97Å; L31-F398 HydrophobicContact CD2-CD1 3.93Å; L31-F398 HydrophobicContact CD2-CE1 3.8Å
32	H	29.8	Very low	39.4	Very low	128 Å²	128	94.1 Å²	94.1	59%	0.593	46%	0.461	S	S	*	.			trans	-93.3	85.8	161.9	-90.8	-27.6	0	0	0	107.1	G30 Q75	G30-H32 VanDerWaalsContact C-N 3.33Å; G30-H32 PolarHBondContact O-N 3.4Å; H32-Q75 PolarHBondContact CE1-OE1 2.97Å
33	D	41.1	Very low	41	Very low	48 Å²	48	86.9 Å²	86.9	26%	0.257	44%	0.443	S	S	.	.			trans	-93.6	103.8	167.9	-138.8	2.7	0	0	0	107.3	L31 D35 S78	L31-D33 PolarHBondContact O-N 3.35Å; D33-D35 PolarHBondContact O-N 2.95Å; D33-S78 WeakPolarHBondContact OD2-CB 3.42Å
34	R	34.6	Very low	42.1	Very low	231 Å²	231	90.2 Å²	90.2	87%	0.872	45%	0.453	S	S	*	.			trans	-89.5	39.6	168.5	-72.2	-170.4	-176.1	175.7	3.7	110.1	H36	R34-H36 PolarHBondContact O-N 2.68Å
35	D	46.2	Very low	43.2	Very low	64 Å²	64	88.7 Å²	88.7	34%	0.342	45%	0.449	S	S	.	.			trans	-73	101.1	-174.1	-89.2	-1.1	0	0	0	110.8	D33 G37	D33-D35 PolarHBondContact O-N 2.95Å; D35-G37 PolarHBondContact O-N 3.47Å
36	H	45.4	Very low	44	Very low	188 Å²	188	84.2 Å²	84.2	87%	0.87	43%	0.43	S	S	*	.			trans	-77.8	28	157.8	-71.9	-59	0	0	0	111.9	R34	R34-H36 PolarHBondContact O-N 2.68Å
37	G	49	Very low	44.3	Very low	20 Å²	20	89.9 Å²	89.9	21%	0.206	46%	0.46	C	S	.	.			trans	-65.2	145.1	-179	0	0	0	0	0	112.7	D35 L39 L79 E266	D35-G37 PolarHBondContact O-N 3.47Å; G37-L39 PolarHBondContact O-N 3.23Å; G37-L79 WeakPolarHBondContact O-CD2 3.21Å; G37-E266 WeakPolarHBondContact CA-OE2 3.32Å
38	I	50.9	Low	45.1	Very low	81 Å²	81	86.3 Å²	86.3	42%	0.415	45%	0.451	S	S	.	.			trans	-94.7	95.7	175.3	-60.7	173	0	0	0	107.8	S40 R263 E266	I38-S40 PolarHBondContact O-N 3.34Å; I38-R263 VanDerWaalsContact CD1-CZ 3.49Å; I38-E266 PolarHBondContact N-OE1 3.46Å; I38-E266 PolarHBondContact N-OE2 3.44Å
39	L	57.8	Low	46	Very low	30 Å²	30	87.9 Å²	87.9	16%	0.157	46%	0.455	C	S	.	.			trans	-72.5	111.7	170.1	-170.3	65.6	0	0	0	109.8	G37 V41 L79 I80 A83 F260 L262	G37-L39 PolarHBondContact O-N 3.23Å; L39-V41 HydrophobicContact CD2-CG2 4.41Å; L39-V41 HydrophobicContact CG-CG2 4.28Å; L39-L79 HydrophobicContact CB-CD2 3.95Å; L39-L79 HydrophobicContact CB-CG 4.26Å; L39-I80 HydrophobicContact CD1-CD1 4.08Å; L39-A83 HydrophobicContact CD2-CB 3.26Å; L39-F260 HydrophobicContact CD1-CB 4.15Å; L39-F260 HydrophobicContact CD1-CD1 4.48Å; L39-F260 HydrophobicContact CD2-CD1 3.68Å; L39-F260 HydrophobicContact CD2-CE1 4.3Å; L39-F260 HydrophobicContact CG-CD1 4.15Å; L39-L262 HydrophobicContact CD1-CD2 3.95Å; L39-L262 HydrophobicContact CD1-CG 4.39Å
40	S	64.2	Low	47.3	Very low	43 Å²	43	86.8 Å²	86.8	30%	0.301	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	129.7	168.4	69.1	0	0	0	0	109.5	I38 R261	I38-S40 PolarHBondContact O-N 3.34Å; S40-R261 PolarHBondContact N-O 3.43Å; S40-R261 PolarHBondContact O-N 3.36Å; S40-R261 WeakPolarHBondContact OG-CB 3.3Å; S40-R261 PolarHBondContact OG-O 3.02Å
41	V	65.9	Low	48.3	Very low	41 Å²	41	89.5 Å²	89.5	25%	0.248	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.8	176	-168.5	0	0	0	0	108.9	L39 A46 Y50 I258 I259 F260	L39-V41 HydrophobicContact CD2-CG2 4.41Å; L39-V41 HydrophobicContact CG-CG2 4.28Å; V41-A46 HydrophobicContact CB-CB 4.42Å; V41-A46 HydrophobicContact CG1-CB 3.96Å; V41-Y50 HydrophobicContact CB-CD2 4.38Å; V41-Y50 HydrophobicContact CG1-CD2 3.96Å; V41-Y50 HydrophobicContact CG1-CE2 3.71Å; V41-Y50 HydrophobicContact CG2-CD2 3.99Å; V41-I258 HydrophobicContact CG1-CG2 3.68Å; V41-I259 WeakPolarHBondContact CA-O 3.23Å; V41-F260 HydrophobicContact CB-CD1 4.46Å; V41-F260 HydrophobicContact CB-CE1 4.39Å; V41-F260 HydrophobicContact CG1-CD1 4.11Å; V41-F260 HydrophobicContact CG1-CE1 3.78Å; V41-F260 HydrophobicContact CG1-CZ 4.35Å; V41-F260 HydrophobicContact CG2-CD1 3.7Å; V41-F260 HydrophobicContact CG2-CE1 3.69Å
42	R	67.3	Low	49.2	Very low	178 Å²	178	91.8 Å²	91.8	67%	0.672	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117	131.5	173.8	-66.4	-177.3	176.7	180	0.1	109.7	I259	R42-I259 HydrophobicContact CB-CB 4.37Å; R42-I259 PolarHBondContact N-O 3.01Å; R42-I259 PolarHBondContact O-N 3.46Å
43	G	58.6	Low	50.4	Low	35 Å²	35	89.1 Å²	89.1	36%	0.361	49%	0.486	S	S	.	.	S	Bend	trans	173.5	156.9	175.7	0	0	0	0	0	111.6	Q45 A46	G43-Q45 PolarHBondContact O-N 3.42Å; G43-A46 PolarHBondContact O-N 3.5Å
44	E	52.4	Low	51.8	Low	149 Å²	149	89 Å²	89	70%	0.696	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-10.5	-175.4	-74.4	-177.5	162	0	0	114.3	R256	E44-R256 IonicContact OE1-CZ 3.59Å; E44-R256 IonicContact OE1-NE 3.87Å; E44-R256 IonicContact OE1-NH1 3.15Å; E44-R256 PolarHBondContact OE1-NH1 2.59Å; E44-R256 VanDerWaalsContact OE1-NH1 3.15Å; E44-R256 WeakPolarHBondContact OE2-CD 3.47Å; E44-R256 IonicContact OE2-CZ 3.69Å; E44-R256 IonicContact OE2-NE 3.93Å; E44-R256 IonicContact OE2-NH1 2.77Å; E44-R256 PolarHBondContact OE2-NH1 3.2Å
45	Q	46.3	Very low	54	Low	133 Å²	133	80.7 Å²	80.7	62%	0.621	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.5	19.2	-178.3	-67.7	-176.6	-18.3	0	0	114.2	G43 L47	G43-Q45 PolarHBondContact O-N 3.42Å; Q45-L47 PolarHBondContact O-N 2.78Å
46	A	43.1	Very low	55.8	Low	38 Å²	38	77.9 Å²	77.9	31%	0.314	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	32.9	-172.3	0	0	0	0	0	115.7	V41 G43	V41-A46 HydrophobicContact CB-CB 4.42Å; V41-A46 HydrophobicContact CG1-CB 3.96Å; G43-A46 PolarHBondContact O-N 3.5Å
47	L	37.7	Very low	57.7	Low	175 Å²	175	73.4 Å²	73.4	92%	0.916	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	1	176.1	-98.8	144	0	0	0	113.6	Q45	Q45-L47 PolarHBondContact O-N 2.78Å
48	G	43	Very low	59.4	Low	41 Å²	41	78.1 Å²	78.1	42%	0.423	44%	0.444	S	S	.	.	S	Bend	trans	-88.1	129.6	168.6	0	0	0	0	0	110.5	Y50	G48-Y50 PolarHBondContact O-N 2.85Å
49	L	45.6	Very low	60.9	Low	143 Å²	143	75 Å²	75	75%	0.749	43%	0.427	S	S	*	.			trans	-58.4	104.3	176.3	-79.2	90	0	0	0	109.3	V51	L49-V51 HydrophobicContact CB-CG2 3.69Å; L49-V51 HydrophobicContact CD2-CG2 4.29Å; L49-V51 WeakPolarHBondContact O-CG2 3.45Å; L49-V51 PolarHBondContact O-N 2.97Å
50	Y	54.8	Low	62.3	Low	39 Å²	39	76.3 Å²	76.3	15%	0.153	45%	0.449	C	S	.	.			trans	-68.6	90.8	155.2	-61.3	-71	0	0	0	106	V41 G48 A52 A87 F260	V41-Y50 HydrophobicContact CB-CD2 4.38Å; V41-Y50 HydrophobicContact CG1-CD2 3.96Å; V41-Y50 HydrophobicContact CG1-CE2 3.71Å; V41-Y50 HydrophobicContact CG2-CD2 3.99Å; G48-Y50 PolarHBondContact O-N 2.85Å; Y50-A52 PolarHBondContact O-N 3.43Å; Y50-A52 VanDerWaalsContact O-N 3.12Å; Y50-A87 HydrophobicContact CD1-CB 3.97Å; Y50-A87 HydrophobicContact CE1-CB 3.44Å; Y50-A87 VanDerWaalsContact CE1-CB 3.44Å; Y50-F260 HydrophobicContact CD1-CE1 4.49Å; Y50-F260 HydrophobicContact CD1-CZ 4.36Å; Y50-F260 HydrophobicContact CD2-CE1 4.03Å; Y50-F260 HydrophobicContact CD2-CZ 4.41Å; Y50-F260 HydrophobicContact CE1-CZ 4.3Å; Y50-F260 HydrophobicContact CE2-CE1 4.3Å; Y50-F260 HydrophobicContact CE2-CZ 4.32Å; Y50-F260 HydrophobicContact CG-CE1 4.11Å; Y50-F260 HydrophobicContact CG-CZ 4.41Å
51	V	48.5	Very low	63.5	Low	61 Å²	61	75 Å²	75	37%	0.37	44%	0.438	S	S	.	.			trans	-68.8	112.5	-168.1	-177.2	0	0	0	0	109.2	L49 L54 S82	L49-V51 HydrophobicContact CB-CG2 3.69Å; L49-V51 HydrophobicContact CD2-CG2 4.29Å; L49-V51 WeakPolarHBondContact O-CG2 3.45Å; L49-V51 PolarHBondContact O-N 2.97Å; V51-L54 HydrophobicContact CB-CD1 4.25Å; V51-L54 HydrophobicContact CB-CD2 4.5Å; V51-L54 HydrophobicContact CB-CG 4.13Å; V51-L54 HydrophobicContact CG1-CD2 4.26Å; V51-L54 HydrophobicContact CG1-CG 4.18Å; V51-S82 PolarHBondContact O-OG 2.75Å
52	A	51.7	Low	64.8	Low	62 Å²	62	76.4 Å²	76.4	51%	0.512	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	136	161.6	0	0	0	0	0	109	Y50 L79	Y50-A52 PolarHBondContact O-N 3.43Å; Y50-A52 VanDerWaalsContact O-N 3.12Å; A52-L79 HydrophobicContact CB-CD1 3.44Å; A52-L79 VanDerWaalsContact CB-CD1 3.44Å
53	G	55.1	Low	66.1	Low	72 Å²	72	72 Å²	72	74%	0.742	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	11.4	173.6	0	0	0	0	0	116.7
54	L	69.1	Low	67.8	Low	46 Å²	46	74 Å²	74	24%	0.241	44%	0.437	C	S	.	.			trans	-70.8	142.7	167.4	-63.7	176.8	0	0	0	110.5	V51 Q58 L59 P77	V51-L54 HydrophobicContact CB-CD1 4.25Å; V51-L54 HydrophobicContact CB-CD2 4.5Å; V51-L54 HydrophobicContact CB-CG 4.13Å; V51-L54 HydrophobicContact CG1-CD2 4.26Å; V51-L54 HydrophobicContact CG1-CG 4.18Å; L54-Q58 HydrophobicContact CB-CB 4.16Å; L54-Q58 HydrophobicContact CD2-CB 4.04Å; L54-L59 HydrophobicContact CB-CD2 4.07Å; L54-L59 HydrophobicContact CD1-CD2 3.85Å; L54-P77 VanDerWaalsContact O-CD 3.28Å; L54-P77 WeakPolarHBondContact O-CD 3.11Å; L54-P77 WeakPolarHBondContact O-CG 3.14Å
55	T	81.1	Confident	69.7	Low	56 Å²	56	66.9 Å²	66.9	34%	0.344	40%	0.404	S	S	.	.			trans	-77.5	164	165.8	68.3	0	0	0	0	110.4	D57 Q58 L59	T55-D57 PolarHBondContact O-N 2.95Å; T55-Q58 PolarHBondContact O-N 3.15Å; T55-Q58 WeakPolarHBondContact OG1-CG 3.49Å; T55-Q58 PolarHBondContact OG1-N 2.95Å; T55-L59 PolarHBondContact O-N 2.89Å
56	F	84.1	Confident	72	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.018	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-57	-37.7	175.2	-75	-69.5	0	0	0	112.4	Q58 L59 L61 L66 I69 S76 P77	F56-Q58 VanDerWaalsContact C-N 3.27Å; F56-Q58 PolarHBondContact O-N 2.87Å; F56-L59 HydrophobicContact CD1-CD1 4Å; F56-L59 WeakPolarHBondContact O-CB 3.42Å; F56-L59 PolarHBondContact O-N 2.91Å; F56-L61 HydrophobicContact CD1-CD1 4.4Å; F56-L66 HydrophobicContact CB-CD2 3.87Å; F56-L66 WeakPolarHBondContact O-CD2 3.38Å; F56-I69 HydrophobicContact CD1-CD1 3.73Å; F56-I69 HydrophobicContact CD1-CG2 4.17Å; F56-I69 HydrophobicContact CD2-CG2 3.67Å; F56-I69 HydrophobicContact CE1-CD1 4.01Å; F56-I69 HydrophobicContact CE1-CG2 4.2Å; F56-I69 HydrophobicContact CE2-CG2 3.73Å; F56-I69 HydrophobicContact CG-CD1 4.28Å; F56-I69 HydrophobicContact CG-CG2 3.9Å; F56-I69 HydrophobicContact CZ-CG2 3.99Å; F56-S76 VanDerWaalsContact CE2-C 3.46Å; F56-P77 HydrophobicContact CD1-CB 4.25Å; F56-P77 HydrophobicContact CE1-CB 3.76Å; F56-P77 HydrophobicContact CE2-CB 4.22Å; F56-P77 HydrophobicContact CZ-CB 3.74Å
57	D	85	Confident	74.3	Confident	94 Å²	94	64.7 Å²	64.7	50%	0.503	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-61.8	-34.2	175.6	-58.6	-83.9	0	0	0	112.9	T55 L59 G60 Y70	T55-D57 PolarHBondContact O-N 2.95Å; D57-L59 VanDerWaalsContact C-N 3.29Å; D57-L59 PolarHBondContact O-N 2.78Å; D57-G60 PolarHBondContact O-N 3.4Å; D57-Y70 PolarHBondContact OD2-OH 3.03Å
58	Q	84.4	Confident	76.9	Confident	120 Å²	120	56.4 Å²	56.4	56%	0.561	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-77.7	-14.9	-179.1	-69.7	172.8	-27.1	0	0	113.2	L54 T55 F56 G60	L54-Q58 HydrophobicContact CB-CB 4.16Å; L54-Q58 HydrophobicContact CD2-CB 4.04Å; T55-Q58 PolarHBondContact O-N 3.15Å; T55-Q58 WeakPolarHBondContact OG1-CG 3.49Å; T55-Q58 PolarHBondContact OG1-N 2.95Å; F56-Q58 VanDerWaalsContact C-N 3.27Å; F56-Q58 PolarHBondContact O-N 2.87Å; Q58-G60 PolarHBondContact O-N 2.89Å
59	L	84.2	Confident	79.1	Confident	14 Å²	14	54.5 Å²	54.5	7%	0.073	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-73.2	-15.8	175.6	-64	172.6	0	0	0	112.4	L54 T55 F56 D57 L61 P77 I85 S86 L89	L54-L59 HydrophobicContact CB-CD2 4.07Å; L54-L59 HydrophobicContact CD1-CD2 3.85Å; T55-L59 PolarHBondContact O-N 2.89Å; F56-L59 HydrophobicContact CD1-CD1 4Å; F56-L59 WeakPolarHBondContact O-CB 3.42Å; F56-L59 PolarHBondContact O-N 2.91Å; D57-L59 VanDerWaalsContact C-N 3.29Å; D57-L59 PolarHBondContact O-N 2.78Å; L59-L61 HydrophobicContact CB-CD1 4.41Å; L59-L61 HydrophobicContact CB-CG 4.09Å; L59-L61 HydrophobicContact CD1-CD1 4.45Å; L59-P77 HydrophobicContact CD1-CG 4.47Å; L59-I85 HydrophobicContact CB-CG2 4.33Å; L59-I85 HydrophobicContact CD1-CB 4.28Å; L59-I85 HydrophobicContact CD1-CD1 4.16Å; L59-I85 HydrophobicContact CD1-CG2 3.91Å; L59-I85 HydrophobicContact CG-CG2 4.48Å; L59-S86 WeakPolarHBondContact CD2-OG 3.38Å; L59-L89 WeakPolarHBondContact O-CD1 3.39Å
60	G	85.2	Confident	81	Confident	59 Å²	59	52.5 Å²	52.5	61%	0.608	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	33.5	178.2	0	0	0	0	0	114.3	D57 Q58	D57-G60 PolarHBondContact O-N 3.4Å; Q58-G60 PolarHBondContact O-N 2.89Å
61	L	91.2	Very high	82.4	Confident	14 Å²	14	56.4 Å²	56.4	7%	0.073	33%	0.332	C	S	.	.			trans	-73.1	158.1	177.7	-63.2	172.8	0	0	0	112.6	F56 L59 I65 L66 I69 I85 L89 V112	F56-L61 HydrophobicContact CD1-CD1 4.4Å; L59-L61 HydrophobicContact CB-CD1 4.41Å; L59-L61 HydrophobicContact CB-CG 4.09Å; L59-L61 HydrophobicContact CD1-CD1 4.45Å; L61-I65 HydrophobicContact CD1-CG2 4.5Å; L61-L66 HydrophobicContact CB-CD2 4.04Å; L61-L66 HydrophobicContact CB-CG 4.03Å; L61-L66 HydrophobicContact CD1-CD2 4.09Å; L61-I69 HydrophobicContact CD1-CD1 3.84Å; L61-I85 HydrophobicContact CD2-CG2 3.82Å; L61-L89 HydrophobicContact CD2-CD1 4.15Å; L61-V112 HydrophobicContact CD1-CG1 3.82Å; L61-V112 HydrophobicContact CD2-CG1 3.6Å; L61-V112 HydrophobicContact CG-CG1 4.38Å
62	K	92.8	Very high	83.5	Confident	71 Å²	71	58.5 Å²	58.5	31%	0.309	33%	0.334	S	S	.	.			trans	-55.5	141.9	169.4	-67	170.4	-165.2	167.5	0	111.4	E64 I65 L66 L115 E116	K62-E64 PolarHBondContact O-N 2.9Å; K62-I65 HydrophobicContact CB-CD1 4.01Å; K62-I65 HydrophobicContact CB-CG1 4.15Å; K62-I65 HydrophobicContact CD-CD1 4.24Å; K62-I65 HydrophobicContact CG-CD1 4.48Å; K62-I65 WeakPolarHBondContact O-CB 3.27Å; K62-I65 PolarHBondContact O-N 2.91Å; K62-L66 PolarHBondContact O-N 2.85Å; K62-L66 VanDerWaalsContact O-N 3.09Å; K62-L115 PolarHBondContact NZ-O 2.78Å; K62-E116 WeakPolarHBondContact CE-O 3.37Å; K62-E116 WeakPolarHBondContact CE-OE1 3.46Å; K62-E116 WeakPolarHBondContact CG-OE2 3.41Å; K62-E116 PolarHBondContact N-OE2 3.08Å; K62-E116 PolarHBondContact NZ-O 3.19Å
63	S	93.6	Very high	84.2	Confident	85 Å²	85	58.4 Å²	58.4	59%	0.594	33%	0.328	S	S	*	.	H	α-helix	trans	-55.2	-36.9	-177.9	41.7	0	0	0	0	113.9	I65 L66 Q67	S63-I65 VanDerWaalsContact C-N 3.33Å; S63-L66 PolarHBondContact O-N 3.36Å; S63-Q67 WeakPolarHBondContact O-CB 3.16Å; S63-Q67 PolarHBondContact O-N 2.8Å
64	E	94.4	Very high	85	Confident	77 Å²	77	56.7 Å²	56.7	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-68.6	-35	-178.7	-58.4	92.9	134.6	0	0	111.3	K62 G68 F150 M151	K62-E64 PolarHBondContact O-N 2.9Å; E64-G68 PolarHBondContact O-N 3.14Å; E64-F150 HydrophobicContact CB-CB 4.04Å; E64-M151 HydrophobicContact CB-CG 3.86Å
65	I	93.9	Very high	85	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-72.8	-45.1	176	-57.9	173.5	0	0	0	109.5	L61 K62 S63 Q67 G68 I69 V112 L115 E116 M151	L61-I65 HydrophobicContact CD1-CG2 4.5Å; K62-I65 HydrophobicContact CB-CD1 4.01Å; K62-I65 HydrophobicContact CB-CG1 4.15Å; K62-I65 HydrophobicContact CD-CD1 4.24Å; K62-I65 HydrophobicContact CG-CD1 4.48Å; K62-I65 WeakPolarHBondContact O-CB 3.27Å; K62-I65 PolarHBondContact O-N 2.91Å; S63-I65 VanDerWaalsContact C-N 3.33Å; I65-Q67 VanDerWaalsContact C-N 3.28Å; I65-Q67 PolarHBondContact O-N 3.23Å; I65-G68 CarbonylContact O-C 3.59Å; I65-G68 WeakPolarHBondContact O-CA 3.35Å; I65-G68 PolarHBondContact O-N 2.94Å; I65-G68 VanDerWaalsContact O-N 3.07Å; I65-I69 HydrophobicContact CG2-CD1 3.96Å; I65-I69 HydrophobicContact CG2-CG1 4.41Å; I65-I69 WeakPolarHBondContact O-CG1 3.4Å; I65-I69 PolarHBondContact O-N 3.48Å; I65-V112 HydrophobicContact CG2-CG1 4.18Å; I65-V112 HydrophobicContact CG2-CG2 4.2Å; I65-L115 HydrophobicContact CD1-CB 3.61Å; I65-L115 HydrophobicContact CG1-CB 3.89Å; I65-L115 HydrophobicContact CG1-CD1 4.49Å; I65-L115 HydrophobicContact CG2-CD1 4.48Å; I65-E116 HydrophobicContact CD1-CB 4.2Å; I65-E116 WeakPolarHBondContact CD1-OE2 3.22Å; I65-M151 HydrophobicContact CG1-SD 4.03Å
66	L	92.7	Very high	84.7	Confident	26 Å²	26	59.3 Å²	59.3	14%	0.136	31%	0.312	C	S	.	.	H	α-helix	trans	-57.1	-43.6	174.8	-70.5	175.2	0	0	0	111.3	F56 L61 K62 S63 G68 I69 Y70	F56-L66 HydrophobicContact CB-CD2 3.87Å; F56-L66 WeakPolarHBondContact O-CD2 3.38Å; L61-L66 HydrophobicContact CB-CD2 4.04Å; L61-L66 HydrophobicContact CB-CG 4.03Å; L61-L66 HydrophobicContact CD1-CD2 4.09Å; K62-L66 PolarHBondContact O-N 2.85Å; K62-L66 VanDerWaalsContact O-N 3.09Å; S63-L66 PolarHBondContact O-N 3.36Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.21Å; L66-I69 PolarHBondContact O-N 2.96Å; L66-Y70 WeakPolarHBondContact O-CD2 3.18Å; L66-Y70 PolarHBondContact O-N 3.44Å
67	Q	92.1	Very high	84.6	Confident	99 Å²	99	59.9 Å²	59.9	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-62.6	-39.5	175.9	-160.8	-178.9	-5.2	0	0	111.8	S63 I65 N71 F150	S63-Q67 WeakPolarHBondContact O-CB 3.16Å; S63-Q67 PolarHBondContact O-N 2.8Å; I65-Q67 VanDerWaalsContact C-N 3.28Å; I65-Q67 PolarHBondContact O-N 3.23Å; Q67-N71 WeakPolarHBondContact O-CB 3.04Å; Q67-N71 PolarHBondContact O-N 3.44Å; Q67-F150 HydrophobicContact CB-CD2 3.69Å; Q67-F150 HydrophobicContact CB-CE2 3.93Å; Q67-F150 HydrophobicContact CB-CG 4.06Å; Q67-F150 HydrophobicContact CB-CZ 4.49Å; Q67-F150 HydrophobicContact CG-CD1 4.13Å; Q67-F150 HydrophobicContact CG-CD2 3.71Å; Q67-F150 HydrophobicContact CG-CE1 3.96Å; Q67-F150 HydrophobicContact CG-CE2 3.49Å; Q67-F150 VanDerWaalsContact CG-CE2 3.49Å; Q67-F150 HydrophobicContact CG-CG 4Å; Q67-F150 HydrophobicContact CG-CZ 3.6Å; Q67-F150 WeakPolarHBondContact O-CE2 3.34Å
68	G	92.4	Very high	84.4	Confident	2 Å²	2	55.5 Å²	55.5	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-64.5	-39.7	174.1	0	0	0	0	0	113.5	E64 I65 L66	E64-G68 PolarHBondContact O-N 3.14Å; I65-G68 CarbonylContact O-C 3.59Å; I65-G68 WeakPolarHBondContact O-CA 3.35Å; I65-G68 PolarHBondContact O-N 2.94Å; I65-G68 VanDerWaalsContact O-N 3.07Å; L66-G68 VanDerWaalsContact C-N 3.31Å; L66-G68 PolarHBondContact O-N 3.21Å
69	I	89.3	Confident	84.1	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-49.8	175.6	-69.6	166.6	0	0	0	110.4	F56 L61 I65 L66 N71 Y72 Y74 V112 L147	F56-I69 HydrophobicContact CD1-CD1 3.73Å; F56-I69 HydrophobicContact CD1-CG2 4.17Å; F56-I69 HydrophobicContact CD2-CG2 3.67Å; F56-I69 HydrophobicContact CE1-CD1 4.01Å; F56-I69 HydrophobicContact CE1-CG2 4.2Å; F56-I69 HydrophobicContact CE2-CG2 3.73Å; F56-I69 HydrophobicContact CG-CD1 4.28Å; F56-I69 HydrophobicContact CG-CG2 3.9Å; F56-I69 HydrophobicContact CZ-CG2 3.99Å; L61-I69 HydrophobicContact CD1-CD1 3.84Å; I65-I69 HydrophobicContact CG2-CD1 3.96Å; I65-I69 HydrophobicContact CG2-CG1 4.41Å; I65-I69 WeakPolarHBondContact O-CG1 3.4Å; I65-I69 PolarHBondContact O-N 3.48Å; L66-I69 PolarHBondContact O-N 2.96Å; I69-N71 VanDerWaalsContact C-N 3.3Å; I69-N71 PolarHBondContact O-N 3.26Å; I69-Y72 CarbonylContact O-C 3.52Å; I69-Y72 WeakPolarHBondContact O-CA 3.33Å; I69-Y72 WeakPolarHBondContact O-CB 3.38Å; I69-Y72 PolarHBondContact O-N 3.02Å; I69-Y74 HydrophobicContact CG2-CD2 3.99Å; I69-Y74 HydrophobicContact CG2-CG 4.37Å; I69-V112 HydrophobicContact CD1-CG2 3.99Å; I69-V112 HydrophobicContact CG1-CG2 4.42Å; I69-L147 HydrophobicContact CB-CD2 4.49Å; I69-L147 HydrophobicContact CG1-CD2 3.82Å
70	Y	86.1	Confident	84	Confident	101 Å²	101	50.5 Å²	50.5	40%	0.396	27%	0.27	S	S	.	.	H	α-helix	trans	-74.6	-16.9	-177.7	-71.2	-52.1	0	0	0	114.4	D57 L66 Y72	D57-Y70 PolarHBondContact OD2-OH 3.03Å; L66-Y70 WeakPolarHBondContact O-CD2 3.18Å; L66-Y70 PolarHBondContact O-N 3.44Å; Y70-Y72 CarbonylContact C-O 3.12Å; Y70-Y72 PolarHBondContact O-N 2.94Å
71	N	83.7	Confident	84.1	Confident	120 Å²	120	47.8 Å²	47.8	64%	0.642	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-10.4	165.9	-102.6	21.6	0	0	0	113.1	Q67 I69 F150	Q67-N71 WeakPolarHBondContact O-CB 3.04Å; Q67-N71 PolarHBondContact O-N 3.44Å; I69-N71 VanDerWaalsContact C-N 3.3Å; I69-N71 PolarHBondContact O-N 3.26Å; N71-F150 HydrophobicContact CB-CE2 4.21Å; N71-F150 VanDerWaalsContact ND2-CE2 3.34Å; N71-F150 WeakPolarHBondContact ND2-CE2 3.43Å; N71-F150 WeakPolarHBondContact ND2-CZ 3.41Å
72	Y	71.7	Confident	83.8	Confident	105 Å²	105	47.2 Å²	47.2	41%	0.412	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.1	157.5	171.8	-147.7	-106.1	0	0	0	109.1	I69 Y70 Y74 K146	I69-Y72 CarbonylContact O-C 3.52Å; I69-Y72 WeakPolarHBondContact O-CA 3.33Å; I69-Y72 WeakPolarHBondContact O-CB 3.38Å; I69-Y72 PolarHBondContact O-N 3.02Å; Y70-Y72 CarbonylContact C-O 3.12Å; Y70-Y72 PolarHBondContact O-N 2.94Å; Y72-Y74 HydrophobicContact CD1-CD1 4.12Å; Y72-Y74 AromaticContact CD1-CD2 3.81Å; Y72-Y74 HydrophobicContact CD1-CD2 3.81Å; Y72-Y74 AromaticContact CD1-CE1 3.76Å; Y72-Y74 HydrophobicContact CD1-CE1 3.76Å; Y72-Y74 AromaticContact CD1-CE2 3.4Å; Y72-Y74 HydrophobicContact CD1-CE2 3.4Å; Y72-Y74 HydrophobicContact CD1-CG 4.17Å; Y72-Y74 AromaticContact CD1-CZ 3.4Å; Y72-Y74 HydrophobicContact CE1-CE1 4.16Å; Y72-Y74 HydrophobicContact CE1-CE2 4.29Å; Y72-Y74 AromaticContact CE1-CZ 3.87Å; Y72-Y74 HydrophobicContact CG-CD2 4.19Å; Y72-Y74 AromaticContact CG-CE2 3.91Å; Y72-Y74 HydrophobicContact CG-CE2 3.91Å; Y72-Y74 PolarHBondContact O-N 2.92Å; Y72-K146 HydrophobicContact CE2-CD 4.47Å
73	P	67.3	Low	83.4	Confident	61 Å²	61	44 Å²	44	40%	0.396	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	51.4	175.7	31.4	-39.7	0	0	0	112.4	G30 L31	G30-P73 CarbonylContact C-O 3.15Å; G30-P73 WeakPolarHBondContact CA-O 3.43Å; L31-P73 PolarHBondContact N-O 3.44Å
74	Y	70	Confident	83.2	Confident	36 Å²	36	39.9 Å²	39.9	14%	0.141	20%	0.197	C	C	.	.			trans	-94.4	120.3	168.3	-64.7	-44.7	0	0	0	108.9	L31 I69 Y72 L147	L31-Y74 HydrophobicContact CB-CD1 4.41Å; L31-Y74 HydrophobicContact CD1-CD1 3.37Å; L31-Y74 HydrophobicContact CD1-CE1 3.41Å; L31-Y74 VanDerWaalsContact CD1-CE1 3.41Å; L31-Y74 HydrophobicContact CG-CD1 3.87Å; L31-Y74 HydrophobicContact CG-CE1 3.97Å; I69-Y74 HydrophobicContact CG2-CD2 3.99Å; I69-Y74 HydrophobicContact CG2-CG 4.37Å; Y72-Y74 HydrophobicContact CD1-CD1 4.12Å; Y72-Y74 AromaticContact CD1-CD2 3.81Å; Y72-Y74 HydrophobicContact CD1-CD2 3.81Å; Y72-Y74 AromaticContact CD1-CE1 3.76Å; Y72-Y74 HydrophobicContact CD1-CE1 3.76Å; Y72-Y74 AromaticContact CD1-CE2 3.4Å; Y72-Y74 HydrophobicContact CD1-CE2 3.4Å; Y72-Y74 HydrophobicContact CD1-CG 4.17Å; Y72-Y74 AromaticContact CD1-CZ 3.4Å; Y72-Y74 HydrophobicContact CE1-CE1 4.16Å; Y72-Y74 HydrophobicContact CE1-CE2 4.29Å; Y72-Y74 AromaticContact CE1-CZ 3.87Å; Y72-Y74 HydrophobicContact CG-CD2 4.19Å; Y72-Y74 AromaticContact CG-CE2 3.91Å; Y72-Y74 HydrophobicContact CG-CE2 3.91Å; Y72-Y74 PolarHBondContact O-N 2.92Å; Y74-L147 HydrophobicContact CD2-CD2 4.44Å; Y74-L147 HydrophobicContact CE2-CD2 3.99Å
75	Q	69.9	Low	82.9	Confident	108 Å²	108	36.4 Å²	36.4	51%	0.505	18%	0.18	S	C	.	.			trans	-96.8	-44.7	177.7	-66.5	-174.2	-5.3	0	0	111.6	H32	H32-Q75 PolarHBondContact CE1-OE1 2.97Å
76	S	75.8	Confident	82.5	Confident	48 Å²	48	36.8 Å²	36.8	34%	0.336	18%	0.183	S	C	.	.	S	Bend	trans	-143.9	150.6	179.9	52.8	0	0	0	0	109.8	F56	F56-S76 VanDerWaalsContact CE2-C 3.46Å
77	P	82.2	Confident	82.2	Confident	16 Å²	16	35.5 Å²	35.5	10%	0.104	18%	0.176	C	C	.	.			trans	-66.6	143.4	173.2	28.3	-32.8	0	0	0	110.1	L54 F56 L59 Q81	L54-P77 VanDerWaalsContact O-CD 3.28Å; L54-P77 WeakPolarHBondContact O-CD 3.11Å; L54-P77 WeakPolarHBondContact O-CG 3.14Å; F56-P77 HydrophobicContact CD1-CB 4.25Å; F56-P77 HydrophobicContact CE1-CB 3.76Å; F56-P77 HydrophobicContact CE2-CB 4.22Å; F56-P77 HydrophobicContact CZ-CB 3.74Å; L59-P77 HydrophobicContact CD1-CG 4.47Å; P77-Q81 VanDerWaalsContact CA-OE1 3.27Å; P77-Q81 HydrophobicContact CB-CB 3.87Å
78	S	79.1	Confident	81.8	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.014	16%	0.155	C	C	.	.			trans	-65.4	166.1	165	64.1	0	0	0	0	111	D33 I80 Q81 S82 T104	D33-S78 WeakPolarHBondContact OD2-CB 3.42Å; S78-I80 VanDerWaalsContact C-N 3.26Å; S78-I80 PolarHBondContact O-N 3.49Å; S78-I80 WeakPolarHBondContact OG-CG2 3.35Å; S78-Q81 PolarHBondContact O-N 2.97Å; S78-Q81 VanDerWaalsContact O-N 3.12Å; S78-Q81 WeakPolarHBondContact OG-CB 3.26Å; S78-Q81 WeakPolarHBondContact OG-CG 3.22Å; S78-Q81 PolarHBondContact OG-N 3.12Å; S78-Q81 PolarHBondContact OG-OE1 2.75Å; S78-S82 PolarHBondContact O-N 3.3Å; S78-T104 VanDerWaalsContact CB-O 3.3Å; S78-T104 WeakPolarHBondContact CB-O 3.1Å; S78-T104 PolarHBondContact OG-O 3.11Å
79	L	78.1	Confident	81.4	Confident	26 Å²	26	32.9 Å²	32.9	14%	0.136	17%	0.165	C	C	.	.	H	α-helix	trans	-53.4	-45.2	176.4	-178.4	64.4	0	0	0	111.7	G37 L39 A52 A83 L262	G37-L79 WeakPolarHBondContact O-CD2 3.21Å; L39-L79 HydrophobicContact CB-CD2 3.95Å; L39-L79 HydrophobicContact CB-CG 4.26Å; A52-L79 HydrophobicContact CB-CD1 3.44Å; A52-L79 VanDerWaalsContact CB-CD1 3.44Å; L79-A83 WeakPolarHBondContact O-CB 3.2Å; L79-A83 PolarHBondContact O-N 2.91Å; L79-L262 HydrophobicContact CD2-CD2 4.13Å
80	I	83.1	Confident	80.9	Confident	4 Å²	4	38.8 Å²	38.8	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-35.7	-179.9	-159.6	63	0	0	0	112.3	L39 S78 V84 V98 T104 F260	L39-I80 HydrophobicContact CD1-CD1 4.08Å; S78-I80 VanDerWaalsContact C-N 3.26Å; S78-I80 PolarHBondContact O-N 3.49Å; S78-I80 WeakPolarHBondContact OG-CG2 3.35Å; I80-V84 HydrophobicContact CD1-CG2 4.23Å; I80-V84 HydrophobicContact CG1-CG2 4.15Å; I80-V84 VanDerWaalsContact O-CB 3.3Å; I80-V84 WeakPolarHBondContact O-CB 3.25Å; I80-V84 WeakPolarHBondContact O-CG2 3.45Å; I80-V84 PolarHBondContact O-N 2.64Å; I80-V98 HydrophobicContact CD1-CG1 3.4Å; I80-V98 HydrophobicContact CG1-CG1 3.63Å; I80-T104 WeakPolarHBondContact CG2-O 3.36Å; I80-F260 HydrophobicContact CD1-CB 4.29Å
81	Q	87.2	Confident	80.1	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-48.9	175.1	-76.2	169	-8.4	0	0	110.6	P77 S78 A83 I85 G105 A109	P77-Q81 VanDerWaalsContact CA-OE1 3.27Å; P77-Q81 HydrophobicContact CB-CB 3.87Å; S78-Q81 PolarHBondContact O-N 2.97Å; S78-Q81 VanDerWaalsContact O-N 3.12Å; S78-Q81 WeakPolarHBondContact OG-CB 3.26Å; S78-Q81 WeakPolarHBondContact OG-CG 3.22Å; S78-Q81 PolarHBondContact OG-N 3.12Å; S78-Q81 PolarHBondContact OG-OE1 2.75Å; Q81-A83 PolarHBondContact O-N 3.36Å; Q81-I85 HydrophobicContact CB-CD1 4.25Å; Q81-I85 WeakPolarHBondContact O-CB 3.16Å; Q81-I85 WeakPolarHBondContact O-CD1 3.4Å; Q81-I85 WeakPolarHBondContact O-CG1 3.42Å; Q81-I85 PolarHBondContact O-N 2.98Å; Q81-G105 PolarHBondContact NE2-O 3.27Å; Q81-A109 HydrophobicContact CB-CB 4.39Å; Q81-A109 HydrophobicContact CG-CB 3.88Å
82	S	84.9	Confident	79.3	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-57.9	-49.1	178.1	-168.7	0	0	0	0	110.9	V51 S78 S86	V51-S82 PolarHBondContact O-OG 2.75Å; S78-S82 PolarHBondContact O-N 3.3Å; S82-S86 WeakPolarHBondContact O-CB 3.33Å; S82-S86 PolarHBondContact O-N 3.18Å; S82-S86 PolarHBondContact O-OG 3.31Å
83	A	84.2	Confident	79.6	Confident	3 Å²	3	35.6 Å²	35.6	3%	0.025	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-49.4	-177.7	0	0	0	0	0	112.9	L39 L79 Q81 A87 F260	L39-A83 HydrophobicContact CD2-CB 3.26Å; L79-A83 WeakPolarHBondContact O-CB 3.2Å; L79-A83 PolarHBondContact O-N 2.91Å; Q81-A83 PolarHBondContact O-N 3.36Å; A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.27Å; A83-F260 HydrophobicContact CB-CD1 4.14Å; A83-F260 HydrophobicContact CB-CE1 3.95Å
84	V	88.4	Confident	80.6	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.5	-46.8	-178.5	171.9	0	0	0	0	110.9	I80 A87 V88 V98 A109 F238	I80-V84 HydrophobicContact CD1-CG2 4.23Å; I80-V84 HydrophobicContact CG1-CG2 4.15Å; I80-V84 VanDerWaalsContact O-CB 3.3Å; I80-V84 WeakPolarHBondContact O-CB 3.25Å; I80-V84 WeakPolarHBondContact O-CG2 3.45Å; I80-V84 PolarHBondContact O-N 2.64Å; V84-A87 PolarHBondContact O-N 3.18Å; V84-V88 HydrophobicContact CG1-CG2 4.47Å; V84-V88 WeakPolarHBondContact O-CB 3.44Å; V84-V88 WeakPolarHBondContact O-CG2 3.34Å; V84-V88 PolarHBondContact O-N 3.4Å; V84-V98 HydrophobicContact CG2-CG1 3.92Å; V84-V98 HydrophobicContact CG2-CG2 3.78Å; V84-A109 HydrophobicContact CB-CB 4.2Å; V84-A109 HydrophobicContact CG1-CB 4.19Å; V84-F238 HydrophobicContact CG1-CE1 4.19Å; V84-F238 HydrophobicContact CG1-CZ 4.04Å; V84-F238 HydrophobicContact CG2-CE1 4.25Å
85	I	89.2	Confident	81.8	Confident	3 Å²	3	34 Å²	34	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-64.2	-46.7	-178.9	-66.3	166.2	0	0	0	110.1	L59 L61 Q81 A87 V88 L89 V112	L59-I85 HydrophobicContact CB-CG2 4.33Å; L59-I85 HydrophobicContact CD1-CB 4.28Å; L59-I85 HydrophobicContact CD1-CD1 4.16Å; L59-I85 HydrophobicContact CD1-CG2 3.91Å; L59-I85 HydrophobicContact CG-CG2 4.48Å; L61-I85 HydrophobicContact CD2-CG2 3.82Å; Q81-I85 HydrophobicContact CB-CD1 4.25Å; Q81-I85 WeakPolarHBondContact O-CB 3.16Å; Q81-I85 WeakPolarHBondContact O-CD1 3.4Å; Q81-I85 WeakPolarHBondContact O-CG1 3.42Å; Q81-I85 PolarHBondContact O-N 2.98Å; I85-A87 PolarHBondContact O-N 2.92Å; I85-V88 PolarHBondContact O-N 3.04Å; I85-L89 HydrophobicContact CG2-CD1 3.83Å; I85-L89 HydrophobicContact CG2-CG 4.43Å; I85-L89 VanDerWaalsContact O-CG 3.27Å; I85-L89 WeakPolarHBondContact O-CG 3.38Å; I85-L89 PolarHBondContact O-N 3.09Å; I85-L89 VanDerWaalsContact O-N 3.07Å; I85-V112 HydrophobicContact CD1-CB 4.05Å; I85-V112 HydrophobicContact CD1-CG1 3.85Å; I85-V112 HydrophobicContact CD1-CG2 4.36Å; I85-V112 HydrophobicContact CG1-CB 4.29Å; I85-V112 HydrophobicContact CG1-CG1 4.02Å; I85-V112 HydrophobicContact CG2-CG1 4.28Å
86	S	85.6	Confident	82.9	Confident	8 Å²	8	28.9 Å²	28.9	6%	0.056	14%	0.142	C	C	.	.	H	α-helix	trans	-60.8	-44.9	178.2	-56.4	0	0	0	0	111.4	L59 S82 V88 L89 E90	L59-S86 WeakPolarHBondContact CD2-OG 3.38Å; S82-S86 WeakPolarHBondContact O-CB 3.33Å; S82-S86 PolarHBondContact O-N 3.18Å; S82-S86 PolarHBondContact O-OG 3.31Å; S86-V88 VanDerWaalsContact C-N 3.3Å; S86-V88 PolarHBondContact O-N 2.91Å; S86-L89 PolarHBondContact O-N 2.55Å; S86-L89 VanDerWaalsContact O-N 3.17Å; S86-E90 WeakPolarHBondContact O-CB 3.15Å; S86-E90 WeakPolarHBondContact O-CG 3.19Å; S86-E90 PolarHBondContact O-N 3.13Å
87	A	85.5	Confident	83.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.2	-37.9	178.9	0	0	0	0	0	113	Y50 A83 V84 I85 L89 D91 M96 F260	Y50-A87 HydrophobicContact CD1-CB 3.97Å; Y50-A87 HydrophobicContact CE1-CB 3.44Å; Y50-A87 VanDerWaalsContact CE1-CB 3.44Å; A83-A87 WeakPolarHBondContact O-CB 3.42Å; A83-A87 PolarHBondContact O-N 3.27Å; V84-A87 PolarHBondContact O-N 3.18Å; I85-A87 PolarHBondContact O-N 2.92Å; A87-L89 VanDerWaalsContact C-N 3.32Å; A87-D91 WeakPolarHBondContact O-CA 3.47Å; A87-D91 WeakPolarHBondContact O-CB 3.33Å; A87-D91 PolarHBondContact O-N 3.2Å; A87-M96 HydrophobicContact CB-CE 3.44Å; A87-M96 VanDerWaalsContact CB-CE 3.44Å; A87-M96 HydrophobicContact CB-SD 4.09Å; A87-F260 HydrophobicContact CB-CE2 4.02Å; A87-F260 HydrophobicContact CB-CZ 3.69Å
88	V	84.2	Confident	84.3	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.012	12%	0.121	C	C	.	.	H	α-helix	trans	-68.4	-34.4	178.1	162.7	0	0	0	0	111.7	V84 I85 S86 M96 T113 K117 L236	V84-V88 HydrophobicContact CG1-CG2 4.47Å; V84-V88 WeakPolarHBondContact O-CB 3.44Å; V84-V88 WeakPolarHBondContact O-CG2 3.34Å; V84-V88 PolarHBondContact O-N 3.4Å; I85-V88 PolarHBondContact O-N 3.04Å; S86-V88 VanDerWaalsContact C-N 3.3Å; S86-V88 PolarHBondContact O-N 2.91Å; V88-M96 HydrophobicContact CG2-CE 3.77Å; V88-M96 HydrophobicContact CG2-SD 4.01Å; V88-T113 HydrophobicContact CB-CG2 4.19Å; V88-T113 HydrophobicContact CG1-CG2 3.46Å; V88-T113 VanDerWaalsContact CG1-CG2 3.46Å; V88-T113 HydrophobicContact CG2-CG2 3.71Å; V88-K117 HydrophobicContact CG1-CG 4.43Å; V88-K117 WeakPolarHBondContact O-CE 3.35Å; V88-K117 PolarHBondContact O-NZ 3Å; V88-L236 HydrophobicContact CG2-CD1 4.48Å
89	L	83.5	Confident	84.7	Confident	43 Å²	43	25.9 Å²	25.9	23%	0.225	12%	0.121	C	C	.	.	H	α-helix	trans	-76.2	-44.6	179.3	-71.5	172.9	0	0	0	112.2	L59 L61 I85 S86 A87 E116	L59-L89 WeakPolarHBondContact O-CD1 3.39Å; L61-L89 HydrophobicContact CD2-CD1 4.15Å; I85-L89 HydrophobicContact CG2-CD1 3.83Å; I85-L89 HydrophobicContact CG2-CG 4.43Å; I85-L89 VanDerWaalsContact O-CG 3.27Å; I85-L89 WeakPolarHBondContact O-CG 3.38Å; I85-L89 PolarHBondContact O-N 3.09Å; I85-L89 VanDerWaalsContact O-N 3.07Å; S86-L89 PolarHBondContact O-N 2.55Å; S86-L89 VanDerWaalsContact O-N 3.17Å; A87-L89 VanDerWaalsContact C-N 3.32Å; L89-E116 HydrophobicContact CD2-CG 3.68Å
90	E	79.2	Confident	84.8	Confident	126 Å²	126	24.7 Å²	24.7	59%	0.589	11%	0.114	S	C	*	.	H	α-helix	trans	-75	-46.4	-179.1	-69.6	178.5	179.9	0	0	112.5	S86	S86-E90 WeakPolarHBondContact O-CB 3.15Å; S86-E90 WeakPolarHBondContact O-CG 3.19Å; S86-E90 PolarHBondContact O-N 3.13Å
91	D	68.5	Low	84.3	Confident	36 Å²	36	25.7 Å²	25.7	19%	0.193	12%	0.119	C	C	.	.	S	Bend	trans	-112.1	67.2	-167.3	-153.2	-17.8	0	0	0	110.3	A87 W93 K94	A87-D91 WeakPolarHBondContact O-CA 3.47Å; A87-D91 WeakPolarHBondContact O-CB 3.33Å; A87-D91 PolarHBondContact O-N 3.2Å; D91-W93 PolarHBondContact O-N 3.28Å; D91-K94 VanDerWaalsContact CG-CE 3.47Å; D91-K94 PolarHBondContact O-N 3.19Å; D91-K94 VanDerWaalsContact O-N 3.12Å; D91-K94 WeakPolarHBondContact OD1-CD 2.94Å; D91-K94 WeakPolarHBondContact OD1-CE 3.42Å; D91-K94 WeakPolarHBondContact OD1-CG 3.42Å; D91-K94 IonicContact OD1-NZ 3.52Å; D91-K94 WeakPolarHBondContact OD2-CD 3.46Å; D91-K94 WeakPolarHBondContact OD2-CE 3.1Å; D91-K94 IonicContact OD2-NZ 2.65Å; D91-K94 PolarHBondContact OD2-NZ 3.41Å
92	Q	68.1	Low	83.5	Confident	115 Å²	115	26.7 Å²	26.7	54%	0.537	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-15.6	-148.9	-70.1	-141.4	-25.4	0	0	118.4	K117	Q92-K117 PolarHBondContact O-NZ 3.28Å
93	W	78.2	Confident	82.7	Confident	108 Å²	108	28.3 Å²	28.3	41%	0.409	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-149.4	19	-177.1	-61	95.1	0	0	0	114.8	D91 K117 K202 Q234	D91-W93 PolarHBondContact O-N 3.28Å; W93-K117 HydrophobicContact CH2-CD 4.13Å; W93-K117 HydrophobicContact CZ2-CD 4.25Å; W93-K202 HydrophobicContact CH2-CB 3.8Å; W93-K202 HydrophobicContact CH2-CD 4.13Å; W93-K202 HydrophobicContact CZ3-CB 3.62Å; W93-K202 WeakPolarHBondContact CZ3-O 3.4Å; W93-Q234 HydrophobicContact CE3-CB 3.83Å; W93-Q234 HydrophobicContact CZ3-CB 4.48Å
94	K	89	Confident	82	Confident	58 Å²	58	28.4 Å²	28.4	25%	0.252	14%	0.141	S	C	.	.			trans	-75.9	139.3	176.2	-77.6	-165	-161.1	150.6	0	112.4	D91 Q234 I258	D91-K94 VanDerWaalsContact CG-CE 3.47Å; D91-K94 PolarHBondContact O-N 3.19Å; D91-K94 VanDerWaalsContact O-N 3.12Å; D91-K94 WeakPolarHBondContact OD1-CD 2.94Å; D91-K94 WeakPolarHBondContact OD1-CE 3.42Å; D91-K94 WeakPolarHBondContact OD1-CG 3.42Å; D91-K94 IonicContact OD1-NZ 3.52Å; D91-K94 WeakPolarHBondContact OD2-CD 3.46Å; D91-K94 WeakPolarHBondContact OD2-CE 3.1Å; D91-K94 IonicContact OD2-NZ 2.65Å; D91-K94 PolarHBondContact OD2-NZ 3.41Å; K94-Q234 WeakPolarHBondContact O-CG 3.28Å; K94-Q234 PolarHBondContact O-NE2 3.28Å; K94-I258 HydrophobicContact CB-CD1 4.19Å; K94-I258 HydrophobicContact CD-CD1 4.18Å; K94-I258 HydrophobicContact CD-CG1 4.37Å
95	D	94.2	Very high	81.6	Confident	6 Å²	6	29.1 Å²	29.1	3%	0.032	15%	0.149	C	C	.	.			trans	-62.9	150.4	174.5	-70.3	-4.5	0	0	0	109.8	Q234 K235 C254 N255 P257 I258	D95-Q234 WeakPolarHBondContact OD1-CA 3.44Å; D95-K235 CarbonylContact C-O 3.4Å; D95-K235 WeakPolarHBondContact CA-O 3.41Å; D95-K235 HydrophobicContact CB-CB 4.49Å; D95-K235 WeakPolarHBondContact CB-O 3.19Å; D95-K235 PolarHBondContact OD1-N 3.43Å; D95-K235 IonicContact OD1-NZ 2.85Å; D95-K235 PolarHBondContact OD1-NZ 3.06Å; D95-K235 IonicContact OD2-NZ 2.8Å; D95-K235 PolarHBondContact OD2-NZ 2.98Å; D95-C254 HydrophobicContact CB-CB 3.99Å; D95-C254 WeakPolarHBondContact OD2-CA 3.23Å; D95-N255 PolarHBondContact OD2-N 2.97Å; D95-P257 HydrophobicContact CB-CB 4.12Å; D95-P257 CarbonylContact O-C 3.51Å; D95-P257 WeakPolarHBondContact O-CA 3.47Å; D95-I258 PolarHBondContact O-N 2.8Å
96	M	93.5	Very high	81.5	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.2	179.7	-55.2	179.6	-175.6	0	0	111.8	A87 V88 V98 K235 L236 F237 I258 F260	A87-M96 HydrophobicContact CB-CE 3.44Å; A87-M96 VanDerWaalsContact CB-CE 3.44Å; A87-M96 HydrophobicContact CB-SD 4.09Å; V88-M96 HydrophobicContact CG2-CE 3.77Å; V88-M96 HydrophobicContact CG2-SD 4.01Å; M96-V98 HydrophobicContact CB-CG2 4.32Å; M96-K235 PolarHBondContact N-O 2.94Å; M96-L236 HydrophobicContact CB-CD2 3.63Å; M96-L236 HydrophobicContact CG-CD2 3.62Å; M96-L236 WeakPolarHBondContact O-CA 3.42Å; M96-L236 HydrophobicContact SD-CD2 3.94Å; M96-F237 PolarHBondContact O-N 3.28Å; M96-I258 CarbonylContact C-O 3.58Å; M96-I258 VanDerWaalsContact CA-O 3.26Å; M96-I258 WeakPolarHBondContact CA-O 3.44Å; M96-I258 HydrophobicContact CE-CD1 4.49Å; M96-I258 HydrophobicContact CG-CB 4.44Å; M96-F260 HydrophobicContact CG-CE2 4.46Å; M96-F260 HydrophobicContact SD-CE2 3.97Å
97	I	93.9	Very high	81.8	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.3	168.2	-59.1	174.1	0	0	0	106.7	F237 L242 I250 H251 P257 I258 I259 F260	I97-F237 CarbonylContact C-O 3.56Å; I97-F237 WeakPolarHBondContact CA-O 3.35Å; I97-L242 HydrophobicContact CG2-CD1 3.56Å; I97-L242 HydrophobicContact CG2-CD2 4.3Å; I97-I250 HydrophobicContact CD1-CB 4.46Å; I97-I250 HydrophobicContact CD1-CG2 3.61Å; I97-I250 HydrophobicContact CG1-CG2 3.72Å; I97-I250 HydrophobicContact CG2-CG2 4.24Å; I97-H251 HydrophobicContact CD1-CB 4.33Å; I97-P257 HydrophobicContact CD1-CB 4.13Å; I97-P257 HydrophobicContact CD1-CG 3.68Å; I97-P257 HydrophobicContact CG1-CB 3.96Å; I97-P257 HydrophobicContact CG1-CG 4.1Å; I97-I258 PolarHBondContact N-O 3.08Å; I97-I259 HydrophobicContact CB-CG1 4.31Å; I97-I259 HydrophobicContact CB-CG2 4.48Å; I97-I259 HydrophobicContact CD1-CG1 4.45Å; I97-I259 CarbonylContact O-C 3.54Å; I97-I259 WeakPolarHBondContact O-CA 3.24Å; I97-F260 PolarHBondContact O-N 3.26Å
98	V	91.8	Very high	82	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	111	-172.3	-174.2	0	0	0	0	109.1	I80 V84 M96 F237 F238 S239 F260	I80-V98 HydrophobicContact CD1-CG1 3.4Å; I80-V98 HydrophobicContact CG1-CG1 3.63Å; V84-V98 HydrophobicContact CG2-CG1 3.92Å; V84-V98 HydrophobicContact CG2-CG2 3.78Å; M96-V98 HydrophobicContact CB-CG2 4.32Å; V98-F237 PolarHBondContact N-O 3.47Å; V98-F238 HydrophobicContact CB-CD1 3.6Å; V98-F238 HydrophobicContact CB-CE1 3.76Å; V98-F238 HydrophobicContact CB-CG 4.35Å; V98-F238 HydrophobicContact CG1-CD1 3.84Å; V98-F238 HydrophobicContact CG1-CE1 3.93Å; V98-F238 HydrophobicContact CG2-CD1 4.02Å; V98-F238 HydrophobicContact CG2-CE1 3.65Å; V98-F238 HydrophobicContact CG2-CZ 4.13Å; V98-F238 WeakPolarHBondContact O-CA 3.23Å; V98-S239 PolarHBondContact O-N 3.43Å; V98-F260 HydrophobicContact CG1-CB 4.35Å; V98-F260 HydrophobicContact CG2-CB 4.47Å; V98-F260 HydrophobicContact CG2-CD2 4.1Å
99	Q	88.4	Confident	82.4	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.009	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.5	170.3	-175.9	-167.4	-6.8	0	0	110.3	S239 L242 F260 L262 L267	Q99-S239 WeakPolarHBondContact CA-O 3.5Å; Q99-L242 HydrophobicContact CB-CD1 3.7Å; Q99-L242 HydrophobicContact CB-CG 4.1Å; Q99-L242 HydrophobicContact CG-CD1 4.39Å; Q99-L242 HydrophobicContact CG-CG 4.31Å; Q99-F260 PolarHBondContact N-O 3.43Å; Q99-L262 PolarHBondContact O-N 2.81Å; Q99-L267 VanDerWaalsContact NE2-CD1 3.31Å
100	S	80.6	Confident	82.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.147	C	C	.	.			trans	-151.8	155.2	168.4	73.1	0	0	0	0	111.2	T104 K106 S239 A240	S100-T104 PolarHBondContact OG-OG1 3.46Å; S100-K106 WeakPolarHBondContact O-CE 3.32Å; S100-K106 PolarHBondContact O-NZ 3.1Å; S100-K106 WeakPolarHBondContact OG-CD 3.45Å; S100-K106 WeakPolarHBondContact OG-CG 3.24Å; S100-S239 PolarHBondContact N-O 3.42Å; S100-S239 VanDerWaalsContact N-O 3.1Å; S100-A240 VanDerWaalsContact O-CA 3.27Å; S100-A240 WeakPolarHBondContact O-CA 3.42Å
101	Q	72.5	Confident	83.7	Confident	26 Å²	26	22.6 Å²	22.6	12%	0.121	12%	0.119	C	C	.	.			trans	-57.4	166	179.3	66.1	-177.2	-12.4	0	0	113.6	T104 K106 E266 L267	Q101-T104 HydrophobicContact CB-CG2 4.42Å; Q101-T104 HydrophobicContact CG-CG2 3.28Å; Q101-T104 PolarHBondContact O-OG1 3.09Å; Q101-T104 VanDerWaalsContact O-OG1 3.08Å; Q101-K106 WeakPolarHBondContact O-CE 3.45Å; Q101-E266 PolarHBondContact OE1-O 2.85Å; Q101-L267 HydrophobicContact CB-CD2 4.31Å; Q101-L267 PolarHBondContact OE1-O 3.27Å
102	N	70	Confident	84.9	Confident	22 Å²	22	21 Å²	21	12%	0.118	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	142.1	172.4	-67.7	-26.7	0	0	0	109.6
103	G	67.5	Low	86.1	Confident	35 Å²	35	15.7 Å²	15.7	36%	0.361	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	91	-11.4	179.6	0	0	0	0	0	115.6	G105	G103-G105 PolarHBondContact O-N 3.04Å
104	T	70.3	Confident	86.9	Confident	5 Å²	5	10.5 Å²	10.5	3%	0.031	7%	0.066	C	C	.	.	S	Bend	trans	-71	1.4	176.1	58.7	0	0	0	0	114.3	S78 I80 S100 Q101 L262	S78-T104 VanDerWaalsContact CB-O 3.3Å; S78-T104 WeakPolarHBondContact CB-O 3.1Å; S78-T104 PolarHBondContact OG-O 3.11Å; I80-T104 WeakPolarHBondContact CG2-O 3.36Å; S100-T104 PolarHBondContact OG-OG1 3.46Å; Q101-T104 HydrophobicContact CB-CG2 4.42Å; Q101-T104 HydrophobicContact CG-CG2 3.28Å; Q101-T104 PolarHBondContact O-OG1 3.09Å; Q101-T104 VanDerWaalsContact O-OG1 3.08Å; T104-L262 HydrophobicContact CG2-CD1 4.45Å
105	G	79.7	Confident	87.3	Confident	16 Å²	16	7.8 Å²	7.8	17%	0.165	5%	0.054	C	C	.	.			trans	83.3	22.6	177.5	0	0	0	0	0	115.8	Q81 G103 T107 A108 A109	Q81-G105 PolarHBondContact NE2-O 3.27Å; G103-G105 PolarHBondContact O-N 3.04Å; G105-T107 VanDerWaalsContact C-N 3.27Å; G105-T107 PolarHBondContact O-N 2.82Å; G105-A108 PolarHBondContact O-N 2.9Å; G105-A108 VanDerWaalsContact O-N 3.11Å; G105-A109 PolarHBondContact O-N 2.98Å
106	K	87.9	Confident	87.3	Confident	13 Å²	13	9.3 Å²	9.3	6%	0.057	6%	0.061	C	C	.	.	H	α-helix	trans	-45.8	-48	171.7	-70.7	-179	-73.6	-163.5	0	113.2	S100 Q101 A108 A109 F110 F238 S239	S100-K106 WeakPolarHBondContact O-CE 3.32Å; S100-K106 PolarHBondContact O-NZ 3.1Å; S100-K106 WeakPolarHBondContact OG-CD 3.45Å; S100-K106 WeakPolarHBondContact OG-CG 3.24Å; Q101-K106 WeakPolarHBondContact O-CE 3.45Å; K106-A108 VanDerWaalsContact C-N 3.33Å; K106-A108 PolarHBondContact O-N 3.35Å; K106-A109 WeakPolarHBondContact O-CB 3.31Å; K106-A109 PolarHBondContact O-N 2.88Å; K106-A109 VanDerWaalsContact O-N 3.09Å; K106-F110 WeakPolarHBondContact O-CD1 3.4Å; K106-F110 PolarHBondContact O-N 2.83Å; K106-F238 HydrophobicContact CB-CD1 4.12Å; K106-F238 HydrophobicContact CD-CB 4.41Å; K106-F238 HydrophobicContact CD-CD1 4.41Å; K106-F238 HydrophobicContact CG-CD1 4.25Å; K106-S239 PolarHBondContact NZ-O 3.09Å
107	T	90.5	Very high	87.2	Confident	25 Å²	25	11 Å²	11	15%	0.153	7%	0.069	C	C	.	.	H	α-helix	trans	-60.3	-42.4	-178.7	-49.3	0	0	0	0	112.3	G105 F110 A111 V140 V143	G105-T107 VanDerWaalsContact C-N 3.27Å; G105-T107 PolarHBondContact O-N 2.82Å; T107-F110 VanDerWaalsContact CA-CE1 3.42Å; T107-F110 HydrophobicContact CG2-CE1 4.21Å; T107-F110 HydrophobicContact CG2-CE2 4.31Å; T107-F110 HydrophobicContact CG2-CZ 3.73Å; T107-A111 WeakPolarHBondContact O-CB 3.48Å; T107-A111 PolarHBondContact O-N 2.96Å; T107-V140 HydrophobicContact CG2-CG2 3.98Å; T107-V143 HydrophobicContact CG2-CB 4.06Å; T107-V143 HydrophobicContact CG2-CG1 4.06Å; T107-V143 HydrophobicContact CG2-CG2 4.07Å
108	A	90.9	Very high	87.2	Confident	7 Å²	7	11.3 Å²	11.3	6%	0.058	7%	0.07	C	C	.	.	H	α-helix	trans	-68.3	-38.6	174.8	0	0	0	0	0	111.5	G105 K106 F110 A111 V112 L147	G105-A108 PolarHBondContact O-N 2.9Å; G105-A108 VanDerWaalsContact O-N 3.11Å; K106-A108 VanDerWaalsContact C-N 3.33Å; K106-A108 PolarHBondContact O-N 3.35Å; A108-F110 PolarHBondContact O-N 2.87Å; A108-A111 PolarHBondContact O-N 2.91Å; A108-V112 WeakPolarHBondContact O-CG2 3.28Å; A108-V112 PolarHBondContact O-N 2.81Å; A108-L147 HydrophobicContact CB-CD1 4.25Å
109	A	91.6	Very high	87.4	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.1	-50	178.5	0	0	0	0	0	112.3	Q81 V84 G105 K106 T113	Q81-A109 HydrophobicContact CB-CB 4.39Å; Q81-A109 HydrophobicContact CG-CB 3.88Å; V84-A109 HydrophobicContact CB-CB 4.2Å; V84-A109 HydrophobicContact CG1-CB 4.19Å; G105-A109 PolarHBondContact O-N 2.98Å; K106-A109 WeakPolarHBondContact O-CB 3.31Å; K106-A109 PolarHBondContact O-N 2.88Å; K106-A109 VanDerWaalsContact O-N 3.09Å; A109-T113 PolarHBondContact O-N 2.82Å; A109-T113 VanDerWaalsContact O-N 3.12Å; A109-T113 PolarHBondContact O-OG1 2.78Å
110	F	94.3	Very high	87.8	Confident	0 Å²	0	16 Å²	16	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-75.5	-30	177.8	73.8	-117.3	0	0	0	112.3	K106 T107 A108 T113 I114 V140 I205 D207 F238	K106-F110 WeakPolarHBondContact O-CD1 3.4Å; K106-F110 PolarHBondContact O-N 2.83Å; T107-F110 VanDerWaalsContact CA-CE1 3.42Å; T107-F110 HydrophobicContact CG2-CE1 4.21Å; T107-F110 HydrophobicContact CG2-CE2 4.31Å; T107-F110 HydrophobicContact CG2-CZ 3.73Å; A108-F110 PolarHBondContact O-N 2.87Å; F110-T113 VanDerWaalsContact O-CB 3.3Å; F110-T113 WeakPolarHBondContact O-CB 3.28Å; F110-T113 PolarHBondContact O-N 3.19Å; F110-I114 HydrophobicContact CD2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CD1 4.41Å; F110-I114 VanDerWaalsContact O-CG1 3.24Å; F110-I114 WeakPolarHBondContact O-CG1 3.38Å; F110-I114 PolarHBondContact O-N 2.8Å; F110-V140 HydrophobicContact CE2-CG1 3.61Å; F110-V140 HydrophobicContact CZ-CG1 3.76Å; F110-V140 HydrophobicContact CZ-CG2 3.96Å; F110-I205 HydrophobicContact CB-CD1 4.07Å; F110-I205 HydrophobicContact CB-CG2 4.45Å; F110-I205 HydrophobicContact CD1-CG2 4.32Å; F110-I205 HydrophobicContact CD2-CD1 4.12Å; F110-I205 HydrophobicContact CD2-CG2 4.19Å; F110-I205 HydrophobicContact CG-CD1 4.39Å; F110-I205 HydrophobicContact CG-CG2 4.11Å; F110-D207 HydrophobicContact CE1-CB 4.12Å; F110-D207 WeakPolarHBondContact CE1-OD2 3.29Å; F110-D207 HydrophobicContact CZ-CB 4.38Å; F110-F238 HydrophobicContact CB-CD2 4.33Å; F110-F238 HydrophobicContact CB-CE1 4.35Å; F110-F238 HydrophobicContact CB-CE2 3.54Å; F110-F238 HydrophobicContact CB-CZ 3.57Å; F110-F238 HydrophobicContact CD1-CD1 4.42Å; F110-F238 AromaticContact CD1-CD2 3.87Å; F110-F238 HydrophobicContact CD1-CD2 3.87Å; F110-F238 HydrophobicContact CD1-CE1 4.47Å; F110-F238 AromaticContact CD1-CE2 3.93Å; F110-F238 HydrophobicContact CD1-CE2 3.93Å; F110-F238 HydrophobicContact CD1-CG 4.13Å; F110-F238 HydrophobicContact CD1-CZ 4.27Å; F110-F238 HydrophobicContact CG-CD2 4.45Å; F110-F238 HydrophobicContact CG-CE2 4.12Å; F110-F238 HydrophobicContact CG-CZ 4.42Å
111	A	95.5	Very high	88.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-44.5	174.5	0	0	0	0	0	111.1	T107 A108 T113 I114 L115 V143 I144 L147	T107-A111 WeakPolarHBondContact O-CB 3.48Å; T107-A111 PolarHBondContact O-N 2.96Å; A108-A111 PolarHBondContact O-N 2.91Å; A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.85Å; A111-I114 WeakPolarHBondContact O-CB 3.48Å; A111-I114 PolarHBondContact O-N 3.13Å; A111-L115 VanDerWaalsContact O-CG 3.29Å; A111-L115 WeakPolarHBondContact O-CG 3.38Å; A111-L115 PolarHBondContact O-N 2.84Å; A111-V143 HydrophobicContact CB-CG1 4.03Å; A111-I144 HydrophobicContact CB-CG1 3.74Å; A111-L147 HydrophobicContact CB-CD1 3.75Å
112	V	94.1	Very high	89.6	Confident	3 Å²	3	21.6 Å²	21.6	2%	0.018	13%	0.13	C	C	.	.	H	α-helix	trans	-58.8	-44.4	172.1	170	0	0	0	0	110.8	L61 I65 I69 I85 A108 I114 L115 E116 L147	L61-V112 HydrophobicContact CD1-CG1 3.82Å; L61-V112 HydrophobicContact CD2-CG1 3.6Å; L61-V112 HydrophobicContact CG-CG1 4.38Å; I65-V112 HydrophobicContact CG2-CG1 4.18Å; I65-V112 HydrophobicContact CG2-CG2 4.2Å; I69-V112 HydrophobicContact CD1-CG2 3.99Å; I69-V112 HydrophobicContact CG1-CG2 4.42Å; I85-V112 HydrophobicContact CD1-CB 4.05Å; I85-V112 HydrophobicContact CD1-CG1 3.85Å; I85-V112 HydrophobicContact CD1-CG2 4.36Å; I85-V112 HydrophobicContact CG1-CB 4.29Å; I85-V112 HydrophobicContact CG1-CG1 4.02Å; I85-V112 HydrophobicContact CG2-CG1 4.28Å; A108-V112 WeakPolarHBondContact O-CG2 3.28Å; A108-V112 PolarHBondContact O-N 2.81Å; V112-I114 VanDerWaalsContact C-N 3.32Å; V112-I114 PolarHBondContact O-N 3.14Å; V112-L115 PolarHBondContact O-N 3.03Å; V112-E116 WeakPolarHBondContact O-CB 3.24Å; V112-E116 PolarHBondContact O-N 2.88Å; V112-L147 HydrophobicContact CG2-CD1 4.21Å
113	T	93.5	Very high	90.8	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.012	15%	0.147	C	C	.	.	H	α-helix	trans	-56.5	-44.3	175	-63.6	0	0	0	0	112.4	V88 A109 F110 A111 E116 K117 L203 L236	V88-T113 HydrophobicContact CB-CG2 4.19Å; V88-T113 HydrophobicContact CG1-CG2 3.46Å; V88-T113 VanDerWaalsContact CG1-CG2 3.46Å; V88-T113 HydrophobicContact CG2-CG2 3.71Å; A109-T113 PolarHBondContact O-N 2.82Å; A109-T113 VanDerWaalsContact O-N 3.12Å; A109-T113 PolarHBondContact O-OG1 2.78Å; F110-T113 VanDerWaalsContact O-CB 3.3Å; F110-T113 WeakPolarHBondContact O-CB 3.28Å; F110-T113 PolarHBondContact O-N 3.19Å; A111-T113 VanDerWaalsContact C-N 3.31Å; A111-T113 PolarHBondContact O-N 2.85Å; T113-E116 PolarHBondContact O-N 3.22Å; T113-K117 WeakPolarHBondContact O-CB 3.3Å; T113-K117 VanDerWaalsContact O-CG 3.25Å; T113-K117 WeakPolarHBondContact O-CG 3.13Å; T113-K117 PolarHBondContact O-N 3.23Å; T113-K117 VanDerWaalsContact O-N 3.11Å; T113-L203 HydrophobicContact CG2-CD2 4.07Å; T113-L236 HydrophobicContact CG2-CD1 3.77Å
114	I	95.6	Very high	92.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-53.9	176.6	-66.9	167.3	0	0	0	109.9	F110 A111 V112 E116 K117 V118 C127 I144 V178 L203 I205	F110-I114 HydrophobicContact CD2-CD1 3.95Å; F110-I114 HydrophobicContact CE2-CD1 4.41Å; F110-I114 VanDerWaalsContact O-CG1 3.24Å; F110-I114 WeakPolarHBondContact O-CG1 3.38Å; F110-I114 PolarHBondContact O-N 2.8Å; A111-I114 WeakPolarHBondContact O-CB 3.48Å; A111-I114 PolarHBondContact O-N 3.13Å; V112-I114 VanDerWaalsContact C-N 3.32Å; V112-I114 PolarHBondContact O-N 3.14Å; I114-E116 PolarHBondContact O-N 3.35Å; I114-K117 PolarHBondContact O-N 2.76Å; I114-K117 VanDerWaalsContact O-N 3.12Å; I114-V118 HydrophobicContact CG2-CG1 4.02Å; I114-V118 WeakPolarHBondContact O-CG1 3.44Å; I114-V118 WeakPolarHBondContact O-CG2 3.14Å; I114-V118 PolarHBondContact O-N 3.04Å; I114-C127 HydrophobicContact CG2-CB 4.17Å; I114-I144 HydrophobicContact CD1-CD1 3.67Å; I114-I144 HydrophobicContact CD1-CG1 4.29Å; I114-V178 HydrophobicContact CD1-CG1 4.47Å; I114-V178 HydrophobicContact CG2-CB 4.45Å; I114-V178 HydrophobicContact CG2-CG1 4.1Å; I114-V178 HydrophobicContact CG2-CG2 3.45Å; I114-V178 VanDerWaalsContact CG2-CG2 3.45Å; I114-L203 HydrophobicContact CB-CD2 4.48Å; I114-L203 HydrophobicContact CG1-CD2 3.89Å; I114-I205 HydrophobicContact CD1-CD1 3.56Å; I114-I205 HydrophobicContact CG1-CD1 3.39Å
115	L	96.1	Very high	93.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61	-35.1	-176.4	-64.4	172.7	0	0	0	112.2	K62 I65 A111 V112 I144 L147 M151 L154	K62-L115 PolarHBondContact NZ-O 2.78Å; I65-L115 HydrophobicContact CD1-CB 3.61Å; I65-L115 HydrophobicContact CG1-CB 3.89Å; I65-L115 HydrophobicContact CG1-CD1 4.49Å; I65-L115 HydrophobicContact CG2-CD1 4.48Å; A111-L115 VanDerWaalsContact O-CG 3.29Å; A111-L115 WeakPolarHBondContact O-CG 3.38Å; A111-L115 PolarHBondContact O-N 2.84Å; V112-L115 PolarHBondContact O-N 3.03Å; L115-I144 HydrophobicContact CD2-CG2 4.1Å; L115-L147 HydrophobicContact CD1-CB 3.6Å; L115-M151 HydrophobicContact CB-SD 4.07Å; L115-M151 HydrophobicContact CD2-SD 3.9Å; L115-M151 HydrophobicContact CG-SD 4.43Å; L115-L154 HydrophobicContact CD2-CD1 4.11Å; L115-L154 HydrophobicContact CD2-CD2 3.41Å; L115-L154 VanDerWaalsContact CD2-CD2 3.41Å; L115-L154 HydrophobicContact CD2-CG 4.41Å
116	E	94	Very high	94.1	Very high	39 Å²	39	26.9 Å²	26.9	18%	0.182	14%	0.136	C	C	.	.	H	α-helix	trans	-69.6	-39	177.3	-169.7	55	-137.1	0	0	111.9	K62 I65 L89 V112 T113 I114	K62-E116 WeakPolarHBondContact CE-O 3.37Å; K62-E116 WeakPolarHBondContact CE-OE1 3.46Å; K62-E116 WeakPolarHBondContact CG-OE2 3.41Å; K62-E116 PolarHBondContact N-OE2 3.08Å; K62-E116 PolarHBondContact NZ-O 3.19Å; I65-E116 HydrophobicContact CD1-CB 4.2Å; I65-E116 WeakPolarHBondContact CD1-OE2 3.22Å; L89-E116 HydrophobicContact CD2-CG 3.68Å; V112-E116 WeakPolarHBondContact O-CB 3.24Å; V112-E116 PolarHBondContact O-N 2.88Å; T113-E116 PolarHBondContact O-N 3.22Å; I114-E116 PolarHBondContact O-N 3.35Å
117	K	92.4	Very high	94.6	Very high	35 Å²	35	26.3 Å²	26.3	15%	0.152	13%	0.133	C	C	.	.	H	α-helix	trans	-88.1	-24.2	-173.9	-65.5	-73.2	179.1	-178.8	0	115.1	V88 Q92 W93 T113 I114	V88-K117 HydrophobicContact CG1-CG 4.43Å; V88-K117 WeakPolarHBondContact O-CE 3.35Å; V88-K117 PolarHBondContact O-NZ 3Å; Q92-K117 PolarHBondContact O-NZ 3.28Å; W93-K117 HydrophobicContact CH2-CD 4.13Å; W93-K117 HydrophobicContact CZ2-CD 4.25Å; T113-K117 WeakPolarHBondContact O-CB 3.3Å; T113-K117 VanDerWaalsContact O-CG 3.25Å; T113-K117 WeakPolarHBondContact O-CG 3.13Å; T113-K117 PolarHBondContact O-N 3.23Å; T113-K117 VanDerWaalsContact O-N 3.11Å; I114-K117 PolarHBondContact O-N 2.76Å; I114-K117 VanDerWaalsContact O-N 3.12Å
118	V	93.9	Very high	95	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.042	13%	0.126	C	C	.	.			trans	-72.1	135.7	-179.2	-67.5	0	0	0	0	111.8	I114 L120 Q126 C127 L154 V178	I114-V118 HydrophobicContact CG2-CG1 4.02Å; I114-V118 WeakPolarHBondContact O-CG1 3.44Å; I114-V118 WeakPolarHBondContact O-CG2 3.14Å; I114-V118 PolarHBondContact O-N 3.04Å; V118-L120 HydrophobicContact CG2-CD2 4.01Å; V118-Q126 HydrophobicContact CG1-CB 4.4Å; V118-C127 HydrophobicContact CG1-CB 4.47Å; V118-L154 HydrophobicContact CG2-CD1 4.3Å; V118-V178 HydrophobicContact CG1-CG2 4.1Å
119	D	95.6	Very high	95.3	Very high	63 Å²	63	24.8 Å²	24.8	34%	0.337	12%	0.123	S	C	.	.			trans	-96	105.7	170.8	178.1	-2.9	0	0	0	109.5	S121 Q122 Q126	D119-S121 VanDerWaalsContact CG-OG 3.24Å; D119-S121 PolarHBondContact O-N 2.99Å; D119-S121 WeakPolarHBondContact OD1-CB 3.35Å; D119-S121 PolarHBondContact OD1-N 3.12Å; D119-S121 PolarHBondContact OD1-OG 3.38Å; D119-S121 PolarHBondContact OD2-OG 3.47Å; D119-Q122 HydrophobicContact CB-CG 4.2Å; D119-Q122 PolarHBondContact O-N 3.2Å; D119-Q122 VanDerWaalsContact O-N 3.14Å; D119-Q122 WeakPolarHBondContact OD2-CG 3.3Å; D119-Q126 PolarHBondContact O-NE2 3.01Å
120	L	96.2	Very high	95.6	Very high	37 Å²	37	24.8 Å²	24.8	19%	0.194	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-12.9	-176.2	-57.2	-175.8	0	0	0	114.2	V118 Q122 M151 E153 L154 H177	V118-L120 HydrophobicContact CG2-CD2 4.01Å; L120-Q122 PolarHBondContact O-N 2.85Å; L120-M151 HydrophobicContact CD1-CB 3.91Å; L120-M151 HydrophobicContact CD1-CE 3.65Å; L120-M151 HydrophobicContact CD1-CG 4.43Å; L120-M151 HydrophobicContact CD2-CE 4.13Å; L120-M151 HydrophobicContact CG-CE 3.99Å; L120-E153 HydrophobicContact CB-CB 3.96Å; L120-E153 HydrophobicContact CD1-CB 4.23Å; L120-L154 HydrophobicContact CD2-CB 4.11Å; L120-L154 HydrophobicContact CD2-CD1 3.94Å; L120-H177 PolarHBondContact O-NE2 3.43Å
121	S	96.4	Very high	95.6	Very high	79 Å²	79	24.8 Å²	24.8	55%	0.552	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.5	174.8	72.4	0	0	0	0	112.4	D119	D119-S121 VanDerWaalsContact CG-OG 3.24Å; D119-S121 PolarHBondContact O-N 2.99Å; D119-S121 WeakPolarHBondContact OD1-CB 3.35Å; D119-S121 PolarHBondContact OD1-N 3.12Å; D119-S121 PolarHBondContact OD1-OG 3.38Å; D119-S121 PolarHBondContact OD2-OG 3.47Å
122	Q	95.7	Very high	95.3	Very high	65 Å²	65	25.5 Å²	25.5	30%	0.304	13%	0.128	S	C	.	.	S	Bend	trans	-106.5	102.7	-171.2	-55.3	-57.7	-16.5	0	0	111.8	D119 L120 W124 Q126 H177	D119-Q122 HydrophobicContact CB-CG 4.2Å; D119-Q122 PolarHBondContact O-N 3.2Å; D119-Q122 VanDerWaalsContact O-N 3.14Å; D119-Q122 WeakPolarHBondContact OD2-CG 3.3Å; L120-Q122 PolarHBondContact O-N 2.85Å; Q122-W124 VanDerWaalsContact C-N 3.26Å; Q122-W124 HydrophobicContact CB-CD2 4.03Å; Q122-W124 HydrophobicContact CB-CE3 4.26Å; Q122-W124 HydrophobicContact CB-CH2 3.9Å; Q122-W124 HydrophobicContact CB-CZ2 3.56Å; Q122-W124 HydrophobicContact CB-CZ3 4.19Å; Q122-W124 HydrophobicContact CG-CH2 4.09Å; Q122-W124 HydrophobicContact CG-CZ2 3.82Å; Q122-W124 PolarHBondContact O-N 3.25Å; Q122-W124 VanDerWaalsContact OE1-CZ3 3.28Å; Q122-Q126 PolarHBondContact O-NE2 3.32Å; Q122-Q126 VanDerWaalsContact O-NE2 3.14Å; Q122-H177 PolarHBondContact O-CD2 3.45Å; Q122-H177 PolarHBondContact O-NE2 3.21Å
123	K	94.4	Very high	95	Very high	108 Å²	108	26.3 Å²	26.3	47%	0.47	13%	0.133	S	C	.	.			trans	-80.9	63.7	-172.6	-59.1	-175.4	179.5	-178	0	113.2	S175	K123-S175 CarbonylContact C-O 3.49Å; K123-S175 WeakPolarHBondContact CA-O 3.29Å
124	W	94.8	Very high	94.6	Very high	73 Å²	73	27.5 Å²	27.5	28%	0.277	14%	0.138	S	C	.	.	S	Bend	trans	-154.3	162.7	172.6	53.4	78.1	0	0	0	111.3	Q122 Q126 S175 D176 R200	Q122-W124 VanDerWaalsContact C-N 3.26Å; Q122-W124 HydrophobicContact CB-CD2 4.03Å; Q122-W124 HydrophobicContact CB-CE3 4.26Å; Q122-W124 HydrophobicContact CB-CH2 3.9Å; Q122-W124 HydrophobicContact CB-CZ2 3.56Å; Q122-W124 HydrophobicContact CB-CZ3 4.19Å; Q122-W124 HydrophobicContact CG-CH2 4.09Å; Q122-W124 HydrophobicContact CG-CZ2 3.82Å; Q122-W124 PolarHBondContact O-N 3.25Å; Q122-W124 VanDerWaalsContact OE1-CZ3 3.28Å; W124-Q126 PolarHBondContact O-N 3.01Å; W124-S175 PolarHBondContact N-O 2.89Å; W124-D176 CarbonylContact C-O 3.56Å; W124-R200 VanDerWaalsContact CD2-NH1 3.32Å; W124-R200 VanDerWaalsContact CH2-NH1 3.31Å
125	P	96.6	Very high	94	Very high	5 Å²	5	28.2 Å²	28.2	3%	0.032	14%	0.141	C	C	.	.			trans	-59	121	176.1	-29	37.4	0	0	0	112.3	I174 D176 I179 V196	P125-I174 VanDerWaalsContact CD-O 3.27Å; P125-I174 WeakPolarHBondContact CD-O 3.45Å; P125-I174 HydrophobicContact CG-CB 4.35Å; P125-I174 HydrophobicContact CG-CG2 3.92Å; P125-D176 WeakPolarHBondContact CA-O 3.45Å; P125-D176 WeakPolarHBondContact CD-O 3.2Å; P125-D176 WeakPolarHBondContact CG-O 3.39Å; P125-I179 HydrophobicContact CB-CD1 3.76Å; P125-I179 HydrophobicContact CB-CG1 4.21Å; P125-I179 HydrophobicContact CG-CD1 3.65Å; P125-I179 HydrophobicContact CG-CG1 4.22Å; P125-V196 HydrophobicContact CB-CG1 4.24Å; P125-V196 HydrophobicContact CG-CG1 4.16Å
126	Q	97.2	Very high	93.6	Very high	4 Å²	4	28.4 Å²	28.4	2%	0.019	14%	0.142	C	C	.	.			trans	-114.1	-25.4	176.4	-69.7	174.6	66.4	0	0	111.7	V118 D119 Q122 W124 H177 K202 L203	V118-Q126 HydrophobicContact CG1-CB 4.4Å; D119-Q126 PolarHBondContact O-NE2 3.01Å; Q122-Q126 PolarHBondContact O-NE2 3.32Å; Q122-Q126 VanDerWaalsContact O-NE2 3.14Å; W124-Q126 PolarHBondContact O-N 3.01Å; Q126-H177 PolarHBondContact N-O 3.3Å; Q126-K202 PolarHBondContact O-N 3.22Å; Q126-L203 PolarHBondContact O-N 3.03Å
127	C	97.6	Very high	93.5	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.6	175	-179.9	0	0	0	0	111.2	I114 V118 H177 V178 I179 L203	I114-C127 HydrophobicContact CG2-CB 4.17Å; V118-C127 HydrophobicContact CG1-CB 4.47Å; C127-H177 PolarHBondContact N-O 2.97Å; C127-H177 VanDerWaalsContact N-O 3.13Å; C127-V178 HydrophobicContact CB-CG1 4.29Å; C127-V178 HydrophobicContact CB-CG2 4.39Å; C127-I179 PolarHBondContact O-N 3.34Å; C127-L203 VanDerWaalsContact CA-O 3.28Å; C127-L203 WeakPolarHBondContact CA-O 3.29Å; C127-L203 HydrophobicContact CB-CB 4.27Å
128	V	97.9	Very high	93.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.6	169.5	177.9	0	0	0	0	108.7	V130 I186 F198 V201 L203 F204 I205	V128-V130 HydrophobicContact CG1-CG2 4.07Å; V128-I186 HydrophobicContact CG1-CD1 3.99Å; V128-I186 HydrophobicContact CG1-CG2 4.13Å; V128-F198 HydrophobicContact CG2-CD1 4.3Å; V128-F198 HydrophobicContact CG2-CE1 3.93Å; V128-V201 HydrophobicContact CB-CG1 4.41Å; V128-V201 HydrophobicContact CG2-CG1 4.03Å; V128-V201 HydrophobicContact CG2-CG2 3.77Å; V128-L203 PolarHBondContact N-O 3Å; V128-F204 HydrophobicContact CB-CD2 4.15Å; V128-F204 HydrophobicContact CG1-CD2 4.23Å; V128-F204 HydrophobicContact CG1-CE2 4.24Å; V128-F204 WeakPolarHBondContact O-CA 3.38Å; V128-F204 WeakPolarHBondContact O-CD2 3.41Å; V128-I205 PolarHBondContact O-N 3.35Å
129	C	98	Very high	93.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.5	174.3	-177.1	0	0	0	0	109.5	I179 V180 G181 I205	C129-I179 PolarHBondContact N-O 3.27Å; C129-V180 HydrophobicContact CB-CG1 4.43Å; C129-V180 HydrophobicContact CB-CG2 4.18Å; C129-V180 WeakPolarHBondContact O-CA 3.19Å; C129-G181 PolarHBondContact O-N 2.98Å; C129-I205 CarbonylContact C-O 3.57Å; C129-I205 WeakPolarHBondContact CA-O 3.42Å; C129-I205 HydrophobicContact CB-CB 4.27Å
130	V	97.2	Very high	93	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.6	-177.3	-164.2	0	0	0	0	109.2	V128 G181 P183 I186 F204 I205 V206 D207 M212 I225	V128-V130 HydrophobicContact CG1-CG2 4.07Å; V130-G181 WeakPolarHBondContact CA-O 3.42Å; V130-P183 HydrophobicContact CG1-CB 4.07Å; V130-P183 HydrophobicContact CG1-CG 3.5Å; V130-P183 VanDerWaalsContact CG1-CG 3.5Å; V130-I186 HydrophobicContact CB-CD1 4.43Å; V130-I186 HydrophobicContact CG1-CD1 4.3Å; V130-I186 HydrophobicContact CG2-CD1 3.9Å; V130-F204 HydrophobicContact CB-CZ 4.48Å; V130-F204 HydrophobicContact CG2-CD2 4.32Å; V130-F204 HydrophobicContact CG2-CE2 3.29Å; V130-F204 HydrophobicContact CG2-CZ 3.61Å; V130-I205 PolarHBondContact N-O 3.26Å; V130-V206 WeakPolarHBondContact O-CA 3.44Å; V130-D207 PolarHBondContact O-N 3.35Å; V130-D207 VanDerWaalsContact O-N 3.09Å; V130-M212 HydrophobicContact CB-CE 4.04Å; V130-M212 HydrophobicContact CG1-CE 3.36Å; V130-I225 HydrophobicContact CG1-CD1 4.38Å; V130-I225 HydrophobicContact CG2-CD1 4.28Å
131	V	94.6	Very high	92.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.123	C	C	.	.			trans	-133.4	150.4	-178.9	-58.1	0	0	0	0	110.5	T133 L136 A137 V140 G181 T182 P183 D207	V131-T133 WeakPolarHBondContact CG2-O 3.03Å; V131-T133 PolarHBondContact O-N 3.5Å; V131-L136 HydrophobicContact CB-CB 4.31Å; V131-L136 HydrophobicContact CB-CD2 4Å; V131-L136 HydrophobicContact CB-CG 3.99Å; V131-L136 HydrophobicContact CG1-CD2 4.31Å; V131-L136 HydrophobicContact CG1-CG 4.13Å; V131-L136 HydrophobicContact CG2-CB 4.42Å; V131-A137 HydrophobicContact CG2-CB 3.56Å; V131-V140 HydrophobicContact CG1-CG2 4.21Å; V131-G181 PolarHBondContact N-O 3Å; V131-T182 WeakPolarHBondContact O-CA 3.3Å; V131-P183 WeakPolarHBondContact O-CD 3.37Å; V131-D207 HydrophobicContact CG1-CB 4Å
132	P	90.3	Very high	92.7	Very high	16 Å²	16	24.8 Å²	24.8	10%	0.104	12%	0.119	C	C	.	.	S	Bend	trans	-68.6	-30.3	-175	24.2	-36.8	0	0	0	114.5	L136 D207 E208 E211 M212 L218	P132-L136 HydrophobicContact CG-CD2 4.14Å; P132-D207 WeakPolarHBondContact CD-O 3.28Å; P132-E208 HydrophobicContact CG-CB 3.86Å; P132-E208 WeakPolarHBondContact CG-OE2 3.33Å; P132-E211 HydrophobicContact CB-CB 4.35Å; P132-E211 HydrophobicContact CB-CG 3.71Å; P132-E211 HydrophobicContact CG-CB 4.36Å; P132-E211 HydrophobicContact CG-CG 4.13Å; P132-M212 HydrophobicContact CB-SD 4.26Å; P132-L218 HydrophobicContact CB-CD1 4.01Å
133	T	86.1	Confident	92.6	Very high	19 Å²	19	23 Å²	23	12%	0.117	11%	0.113	C	C	.	.	S	Bend	trans	-126.9	158.6	-170.1	71	0	0	0	0	113.2	V131 L136 A137	V131-T133 WeakPolarHBondContact CG2-O 3.03Å; V131-T133 PolarHBondContact O-N 3.5Å; T133-L136 VanDerWaalsContact OG1-CB 3.32Å; T133-L136 WeakPolarHBondContact OG1-CB 3.33Å; T133-L136 PolarHBondContact OG1-N 3.12Å; T133-A137 PolarHBondContact O-N 3.07Å
134	Y	86	Confident	92.7	Very high	28 Å²	28	17.9 Å²	17.9	11%	0.11	9%	0.091	C	C	.	.	H	α-helix	trans	-61.7	-45	175.3	171.3	-102.8	0	0	0	111.9	L136 A137 L138 V160 E162 V334	Y134-L136 VanDerWaalsContact C-N 3.33Å; Y134-L136 PolarHBondContact O-N 3.37Å; Y134-A137 WeakPolarHBondContact O-CB 3.42Å; Y134-A137 PolarHBondContact O-N 3.06Å; Y134-A137 VanDerWaalsContact O-N 3.12Å; Y134-L138 HydrophobicContact CD1-CD1 4.09Å; Y134-L138 HydrophobicContact CE1-CD1 3.37Å; Y134-L138 HydrophobicContact CE1-CG 4.12Å; Y134-L138 HydrophobicContact CE2-CD1 4.43Å; Y134-L138 HydrophobicContact CE2-CG 4.4Å; Y134-L138 PolarHBondContact O-N 3Å; Y134-L138 VanDerWaalsContact O-N 3.12Å; Y134-V160 HydrophobicContact CD2-CB 3.64Å; Y134-V160 HydrophobicContact CD2-CG1 3.69Å; Y134-V160 HydrophobicContact CD2-CG2 4.12Å; Y134-V160 HydrophobicContact CE2-CB 3.79Å; Y134-V160 HydrophobicContact CE2-CG1 4.11Å; Y134-V160 HydrophobicContact CE2-CG2 3.73Å; Y134-E162 HydrophobicContact CE2-CG 4.38Å; Y134-E162 PolarHBondContact OH-OE1 3.22Å; Y134-E162 PolarHBondContact OH-OE2 3.12Å; Y134-V334 HydrophobicContact CD1-CG1 3.3Å; Y134-V334 HydrophobicContact CD2-CG1 4Å; Y134-V334 HydrophobicContact CE1-CG1 3.16Å; Y134-V334 HydrophobicContact CE2-CG1 3.9Å; Y134-V334 HydrophobicContact CG-CG1 3.72Å; Y134-V334 VanDerWaalsContact CZ-CG1 3.48Å
135	E	82.8	Confident	92.7	Very high	15 Å²	15	18.8 Å²	18.8	7%	0.07	10%	0.098	C	C	.	.	H	α-helix	trans	-63.2	-41.8	-176.7	-64.2	71.3	-161.6	0	0	111.1	A137 L138 Q139 R337 L341	E135-A137 VanDerWaalsContact C-N 3.32Å; E135-A137 PolarHBondContact O-N 3.44Å; E135-L138 PolarHBondContact O-N 2.69Å; E135-Q139 PolarHBondContact O-N 2.95Å; E135-R337 IonicContact OE1-CZ 3.28Å; E135-R337 IonicContact OE1-NE 2.85Å; E135-R337 PolarHBondContact OE1-NE 3.41Å; E135-R337 VanDerWaalsContact OE1-NE 3.16Å; E135-R337 IonicContact OE1-NH1 2.79Å; E135-R337 PolarHBondContact OE1-NH1 3Å; E135-R337 IonicContact OE1-NH2 3.12Å; E135-R337 PolarHBondContact OE1-NH2 2.92Å; E135-R337 IonicContact OE2-CZ 3.44Å; E135-R337 VanDerWaalsContact OE2-CZ 3.26Å; E135-R337 IonicContact OE2-NH1 2.78Å; E135-R337 PolarHBondContact OE2-NH1 3.49Å; E135-R337 IonicContact OE2-NH2 2.98Å; E135-R337 PolarHBondContact OE2-NH2 2.62Å; E135-L341 HydrophobicContact CB-CD1 4.29Å; E135-L341 HydrophobicContact CG-CD1 3.54Å
136	L	87.8	Confident	92.6	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.021	12%	0.121	C	C	.	.	H	α-helix	trans	-67	-35.7	176.1	-173.1	54	0	0	0	111.4	V131 P132 T133 Y134 L138 Q139 V140 E208	V131-L136 HydrophobicContact CB-CB 4.31Å; V131-L136 HydrophobicContact CB-CD2 4Å; V131-L136 HydrophobicContact CB-CG 3.99Å; V131-L136 HydrophobicContact CG1-CD2 4.31Å; V131-L136 HydrophobicContact CG1-CG 4.13Å; V131-L136 HydrophobicContact CG2-CB 4.42Å; P132-L136 HydrophobicContact CG-CD2 4.14Å; T133-L136 VanDerWaalsContact OG1-CB 3.32Å; T133-L136 WeakPolarHBondContact OG1-CB 3.33Å; T133-L136 PolarHBondContact OG1-N 3.12Å; Y134-L136 VanDerWaalsContact C-N 3.33Å; Y134-L136 PolarHBondContact O-N 3.37Å; L136-L138 VanDerWaalsContact C-N 3.35Å; L136-L138 PolarHBondContact O-N 2.85Å; L136-Q139 PolarHBondContact O-N 3.25Å; L136-V140 HydrophobicContact CD1-CG2 3.96Å; L136-V140 HydrophobicContact CG-CG2 4.2Å; L136-V140 WeakPolarHBondContact O-CB 3.48Å; L136-V140 VanDerWaalsContact O-CG2 3.3Å; L136-V140 WeakPolarHBondContact O-CG2 3.2Å; L136-V140 PolarHBondContact O-N 3.38Å; L136-E208 HydrophobicContact CD2-CB 4.46Å; L136-E208 HydrophobicContact CD2-CG 3.82Å
137	A	91.7	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.9	-44.1	176.5	0	0	0	0	0	111.5	V131 T133 Y134 E135 G141 L158 V160 V180	V131-A137 HydrophobicContact CG2-CB 3.56Å; T133-A137 PolarHBondContact O-N 3.07Å; Y134-A137 WeakPolarHBondContact O-CB 3.42Å; Y134-A137 PolarHBondContact O-N 3.06Å; Y134-A137 VanDerWaalsContact O-N 3.12Å; E135-A137 VanDerWaalsContact C-N 3.32Å; E135-A137 PolarHBondContact O-N 3.44Å; A137-G141 PolarHBondContact O-N 2.94Å; A137-L158 WeakPolarHBondContact O-CD2 3.17Å; A137-V160 HydrophobicContact CB-CG1 3.78Å; A137-V180 HydrophobicContact CB-CG1 4.27Å
138	L	89.5	Confident	92.3	Very high	51 Å²	51	24.2 Å²	24.2	27%	0.267	12%	0.121	S	C	.	.	H	α-helix	trans	-61.1	-45.6	174	-69.4	177.5	0	0	0	111.7	Y134 E135 L136 N142 L158	Y134-L138 HydrophobicContact CD1-CD1 4.09Å; Y134-L138 HydrophobicContact CE1-CD1 3.37Å; Y134-L138 HydrophobicContact CE1-CG 4.12Å; Y134-L138 HydrophobicContact CE2-CD1 4.43Å; Y134-L138 HydrophobicContact CE2-CG 4.4Å; Y134-L138 PolarHBondContact O-N 3Å; Y134-L138 VanDerWaalsContact O-N 3.12Å; E135-L138 PolarHBondContact O-N 2.69Å; L136-L138 VanDerWaalsContact C-N 3.35Å; L136-L138 PolarHBondContact O-N 2.85Å; L138-N142 WeakPolarHBondContact O-CB 3.33Å; L138-N142 PolarHBondContact O-N 3.38Å; L138-N142 PolarHBondContact O-ND2 2.72Å; L138-L158 HydrophobicContact CD2-CD1 3.57Å
139	Q	88.2	Confident	92.2	Very high	38 Å²	38	27 Å²	27	18%	0.178	14%	0.144	C	C	.	.	H	α-helix	trans	-61.2	-50.6	179.3	179.7	-179.8	-33.2	0	0	111.7	E135 L136 N142 V143 G361 D363	E135-Q139 PolarHBondContact O-N 2.95Å; L136-Q139 PolarHBondContact O-N 3.25Å; Q139-N142 WeakPolarHBondContact O-CB 3.47Å; Q139-N142 PolarHBondContact O-N 3.48Å; Q139-V143 WeakPolarHBondContact O-CG2 3.29Å; Q139-V143 PolarHBondContact O-N 2.71Å; Q139-G361 PolarHBondContact OE1-O 2.92Å; Q139-G361 VanDerWaalsContact OE1-O 3.12Å; Q139-D363 VanDerWaalsContact CD-CB 3.48Å
140	V	93.3	Very high	92.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-61.7	-46.6	179.3	171.1	0	0	0	0	110.7	T107 F110 V131 L136 N142 V143 I144 V180	T107-V140 HydrophobicContact CG2-CG2 3.98Å; F110-V140 HydrophobicContact CE2-CG1 3.61Å; F110-V140 HydrophobicContact CZ-CG1 3.76Å; F110-V140 HydrophobicContact CZ-CG2 3.96Å; V131-V140 HydrophobicContact CG1-CG2 4.21Å; L136-V140 HydrophobicContact CD1-CG2 3.96Å; L136-V140 HydrophobicContact CG-CG2 4.2Å; L136-V140 WeakPolarHBondContact O-CB 3.48Å; L136-V140 VanDerWaalsContact O-CG2 3.3Å; L136-V140 WeakPolarHBondContact O-CG2 3.2Å; L136-V140 PolarHBondContact O-N 3.38Å; V140-N142 VanDerWaalsContact C-N 3.31Å; V140-N142 PolarHBondContact O-N 3.14Å; V140-V143 PolarHBondContact O-N 3.04Å; V140-V143 VanDerWaalsContact O-N 3.17Å; V140-I144 HydrophobicContact CG1-CD1 3.81Å; V140-I144 HydrophobicContact CG1-CG1 4.44Å; V140-I144 WeakPolarHBondContact O-CG1 3.23Å; V140-I144 PolarHBondContact O-N 3.19Å; V140-V180 HydrophobicContact CB-CG1 3.91Å; V140-V180 HydrophobicContact CG1-CG1 3.74Å; V140-V180 HydrophobicContact CG1-CG2 4.24Å
141	G	94.9	Very high	92.1	Very high	6 Å²	6	30.4 Å²	30.4	6%	0.062	16%	0.159	C	C	.	.	H	α-helix	trans	-56.9	-43.8	175.8	0	0	0	0	0	112.5	A137 V143 I144 Q145	A137-G141 PolarHBondContact O-N 2.94Å; G141-V143 PolarHBondContact O-N 2.84Å; G141-I144 PolarHBondContact O-N 3.4Å; G141-Q145 WeakPolarHBondContact O-CB 3.46Å; G141-Q145 PolarHBondContact O-N 3.28Å
142	N	92.5	Very high	92	Very high	88 Å²	88	36.3 Å²	36.3	47%	0.471	20%	0.198	S	C	.	.	H	α-helix	trans	-63.7	-39.6	176.4	-76.6	-33.7	0	0	0	113	L138 Q139 V140 Q145 K146	L138-N142 WeakPolarHBondContact O-CB 3.33Å; L138-N142 PolarHBondContact O-N 3.38Å; L138-N142 PolarHBondContact O-ND2 2.72Å; Q139-N142 WeakPolarHBondContact O-CB 3.47Å; Q139-N142 PolarHBondContact O-N 3.48Å; V140-N142 VanDerWaalsContact C-N 3.31Å; V140-N142 PolarHBondContact O-N 3.14Å; N142-Q145 PolarHBondContact O-N 2.96Å; N142-K146 WeakPolarHBondContact O-CB 3.39Å; N142-K146 VanDerWaalsContact O-CG 3.23Å; N142-K146 WeakPolarHBondContact O-CG 3.48Å; N142-K146 PolarHBondContact O-N 3.48Å
143	V	93.1	Very high	92.3	Very high	29 Å²	29	39.8 Å²	39.8	18%	0.176	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-47.3	177	171.9	0	0	0	0	110.6	T107 A111 Q139 V140 G141 Q145 K146 L147	T107-V143 HydrophobicContact CG2-CB 4.06Å; T107-V143 HydrophobicContact CG2-CG1 4.06Å; T107-V143 HydrophobicContact CG2-CG2 4.07Å; A111-V143 HydrophobicContact CB-CG1 4.03Å; Q139-V143 WeakPolarHBondContact O-CG2 3.29Å; Q139-V143 PolarHBondContact O-N 2.71Å; V140-V143 PolarHBondContact O-N 3.04Å; V140-V143 VanDerWaalsContact O-N 3.17Å; G141-V143 PolarHBondContact O-N 2.84Å; V143-Q145 VanDerWaalsContact C-N 3.32Å; V143-Q145 PolarHBondContact O-N 3.33Å; V143-K146 PolarHBondContact O-N 2.99Å; V143-L147 HydrophobicContact CG1-CD1 3.86Å; V143-L147 HydrophobicContact CG1-CG 4.42Å; V143-L147 WeakPolarHBondContact O-CG 3.4Å; V143-L147 PolarHBondContact O-N 3.39Å
144	I	96.7	Very high	92.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-44	178	-60.2	165.4	0	0	0	110.1	A111 I114 L115 V140 G141 K146 G148 I156 V178 V180	A111-I144 HydrophobicContact CB-CG1 3.74Å; I114-I144 HydrophobicContact CD1-CD1 3.67Å; I114-I144 HydrophobicContact CD1-CG1 4.29Å; L115-I144 HydrophobicContact CD2-CG2 4.1Å; V140-I144 HydrophobicContact CG1-CD1 3.81Å; V140-I144 HydrophobicContact CG1-CG1 4.44Å; V140-I144 WeakPolarHBondContact O-CG1 3.23Å; V140-I144 PolarHBondContact O-N 3.19Å; G141-I144 PolarHBondContact O-N 3.4Å; I144-K146 PolarHBondContact O-N 3.19Å; I144-G148 PolarHBondContact O-N 3.47Å; I144-I156 HydrophobicContact CB-CD1 3.9Å; I144-I156 HydrophobicContact CG2-CD1 3.52Å; I144-I156 HydrophobicContact CG2-CG1 4.17Å; I144-V178 HydrophobicContact CD1-CG1 4.22Å; I144-V180 HydrophobicContact CD1-CG2 3.77Å
145	Q	95	Very high	93.3	Very high	92 Å²	92	42.7 Å²	42.7	43%	0.43	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-39.4	179.2	-175.3	60.1	76.2	0	0	112.8	G141 N142 V143 G148 A149 I156	G141-Q145 WeakPolarHBondContact O-CB 3.46Å; G141-Q145 PolarHBondContact O-N 3.28Å; N142-Q145 PolarHBondContact O-N 2.96Å; V143-Q145 VanDerWaalsContact C-N 3.32Å; V143-Q145 PolarHBondContact O-N 3.33Å; Q145-G148 CarbonylContact O-C 3.6Å; Q145-A149 PolarHBondContact O-N 3.45Å; Q145-I156 HydrophobicContact CB-CD1 3.89Å
146	K	93.1	Very high	94	Very high	118 Å²	118	43.4 Å²	43.4	51%	0.513	23%	0.226	S	C	.	.	H	α-helix	trans	-69.1	-48.2	178.4	-76.2	174.3	-179.3	-178.5	0	111.9	Y72 N142 V143 I144 G148 A149	Y72-K146 HydrophobicContact CE2-CD 4.47Å; N142-K146 WeakPolarHBondContact O-CB 3.39Å; N142-K146 VanDerWaalsContact O-CG 3.23Å; N142-K146 WeakPolarHBondContact O-CG 3.48Å; N142-K146 PolarHBondContact O-N 3.48Å; V143-K146 PolarHBondContact O-N 2.99Å; I144-K146 PolarHBondContact O-N 3.19Å; K146-G148 VanDerWaalsContact C-N 3.25Å; K146-G148 PolarHBondContact O-N 3.12Å; K146-A149 WeakPolarHBondContact O-CB 3.41Å; K146-A149 PolarHBondContact O-N 2.82Å
147	L	94.4	Very high	94.3	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-31	177.7	-69.9	177	0	0	0	112.1	I69 Y74 A108 A111 V112 L115 V143	I69-L147 HydrophobicContact CB-CD2 4.49Å; I69-L147 HydrophobicContact CG1-CD2 3.82Å; Y74-L147 HydrophobicContact CD2-CD2 4.44Å; Y74-L147 HydrophobicContact CE2-CD2 3.99Å; A108-L147 HydrophobicContact CB-CD1 4.25Å; A111-L147 HydrophobicContact CB-CD1 3.75Å; V112-L147 HydrophobicContact CG2-CD1 4.21Å; L115-L147 HydrophobicContact CD1-CB 3.6Å; V143-L147 HydrophobicContact CG1-CD1 3.86Å; V143-L147 HydrophobicContact CG1-CG 4.42Å; V143-L147 WeakPolarHBondContact O-CG 3.4Å; V143-L147 PolarHBondContact O-N 3.39Å
148	G	95.9	Very high	94.4	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	14.2	175	0	0	0	0	0	114.8	I144 Q145 K146 F150 M151	I144-G148 PolarHBondContact O-N 3.47Å; Q145-G148 CarbonylContact O-C 3.6Å; K146-G148 VanDerWaalsContact C-N 3.25Å; K146-G148 PolarHBondContact O-N 3.12Å; G148-F150 PolarHBondContact O-N 3.2Å; G148-M151 WeakPolarHBondContact O-CB 3.39Å; G148-M151 PolarHBondContact O-N 2.96Å
149	A	95.3	Very high	94.7	Very high	60 Å²	60	44 Å²	44	50%	0.496	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.3	-173.3	0	0	0	0	0	114.2	Q145 K146	Q145-A149 PolarHBondContact O-N 3.45Å; K146-A149 WeakPolarHBondContact O-CB 3.41Å; K146-A149 PolarHBondContact O-N 2.82Å
150	F	95.7	Very high	94.8	Very high	60 Å²	60	42.3 Å²	42.3	26%	0.263	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	12.4	178	-61.3	-80.3	0	0	0	113.5	E64 Q67 N71 G148 P152	E64-F150 HydrophobicContact CB-CB 4.04Å; Q67-F150 HydrophobicContact CB-CD2 3.69Å; Q67-F150 HydrophobicContact CB-CE2 3.93Å; Q67-F150 HydrophobicContact CB-CG 4.06Å; Q67-F150 HydrophobicContact CB-CZ 4.49Å; Q67-F150 HydrophobicContact CG-CD1 4.13Å; Q67-F150 HydrophobicContact CG-CD2 3.71Å; Q67-F150 HydrophobicContact CG-CE1 3.96Å; Q67-F150 HydrophobicContact CG-CE2 3.49Å; Q67-F150 VanDerWaalsContact CG-CE2 3.49Å; Q67-F150 HydrophobicContact CG-CG 4Å; Q67-F150 HydrophobicContact CG-CZ 3.6Å; Q67-F150 WeakPolarHBondContact O-CE2 3.34Å; N71-F150 HydrophobicContact CB-CE2 4.21Å; N71-F150 VanDerWaalsContact ND2-CE2 3.34Å; N71-F150 WeakPolarHBondContact ND2-CE2 3.43Å; N71-F150 WeakPolarHBondContact ND2-CZ 3.41Å; G148-F150 PolarHBondContact O-N 3.2Å; F150-P152 VanDerWaalsContact O-CD 3.29Å; F150-P152 WeakPolarHBondContact O-CD 3.45Å
151	M	96.4	Very high	94.3	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.049	25%	0.251	C	S	.	.			trans	-111.5	82.2	176.9	-64.9	178.2	78.1	0	0	109.2	E64 I65 L115 L120 G148 E153 L154	E64-M151 HydrophobicContact CB-CG 3.86Å; I65-M151 HydrophobicContact CG1-SD 4.03Å; L115-M151 HydrophobicContact CB-SD 4.07Å; L115-M151 HydrophobicContact CD2-SD 3.9Å; L115-M151 HydrophobicContact CG-SD 4.43Å; L120-M151 HydrophobicContact CD1-CB 3.91Å; L120-M151 HydrophobicContact CD1-CE 3.65Å; L120-M151 HydrophobicContact CD1-CG 4.43Å; L120-M151 HydrophobicContact CD2-CE 4.13Å; L120-M151 HydrophobicContact CG-CE 3.99Å; G148-M151 WeakPolarHBondContact O-CB 3.39Å; G148-M151 PolarHBondContact O-N 2.96Å; M151-E153 PolarHBondContact O-N 2.96Å; M151-E153 VanDerWaalsContact O-N 3.12Å; M151-L154 HydrophobicContact CB-CB 3.95Å; M151-L154 WeakPolarHBondContact O-CB 3.47Å; M151-L154 PolarHBondContact O-N 3.4Å
152	P	94.1	Very high	93.5	Very high	124 Å²	124	52.5 Å²	52.5	81%	0.805	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25	-166.2	24.1	-35.3	0	0	0	114.8	F150	F150-P152 VanDerWaalsContact O-CD 3.29Å; F150-P152 WeakPolarHBondContact O-CD 3.45Å
153	E	95.7	Very high	92.8	Very high	90 Å²	90	50.2 Å²	50.2	42%	0.421	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.5	176.5	-66.5	-61.6	144.7	0	0	112.9	L120 M151 R155 H177	L120-E153 HydrophobicContact CB-CB 3.96Å; L120-E153 HydrophobicContact CD1-CB 4.23Å; M151-E153 PolarHBondContact O-N 2.96Å; M151-E153 VanDerWaalsContact O-N 3.12Å; E153-R155 PolarHBondContact O-N 2.96Å; E153-H177 PolarHBondContact O-CE1 3.26Å; E153-H177 PolarHBondContact O-ND1 3.27Å
154	L	97.3	Very high	92.1	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.068	24%	0.244	C	C	.	.			trans	-61	135.5	178.1	-177.7	68.4	0	0	0	110.4	L115 V118 L120 M151 I156 V178	L115-L154 HydrophobicContact CD2-CD1 4.11Å; L115-L154 HydrophobicContact CD2-CD2 3.41Å; L115-L154 VanDerWaalsContact CD2-CD2 3.41Å; L115-L154 HydrophobicContact CD2-CG 4.41Å; V118-L154 HydrophobicContact CG2-CD1 4.3Å; L120-L154 HydrophobicContact CD2-CB 4.11Å; L120-L154 HydrophobicContact CD2-CD1 3.94Å; M151-L154 HydrophobicContact CB-CB 3.95Å; M151-L154 WeakPolarHBondContact O-CB 3.47Å; M151-L154 PolarHBondContact O-N 3.4Å; L154-I156 HydrophobicContact CD2-CD1 4.12Å; L154-I156 HydrophobicContact CD2-CG1 4.42Å; L154-I156 HydrophobicContact CG-CD1 4.45Å; L154-I156 HydrophobicContact CG-CG1 4.24Å; L154-V178 HydrophobicContact CD1-CG2 4.34Å
155	R	96.5	Very high	91.1	Very high	94 Å²	94	54.2 Å²	54.2	36%	0.355	27%	0.269	S	S	.	.			trans	-137.6	129.7	179.9	-68	-178.7	-169.2	-169.2	-4.2	108.8	E153 D176 H177 V178	E153-R155 PolarHBondContact O-N 2.96Å; R155-D176 HydrophobicContact CB-CB 3.99Å; R155-H177 PolarHBondContact N-ND1 3.22Å; R155-H177 PolarHBondContact O-N 3.11Å; R155-V178 PolarHBondContact O-N 3.04Å
156	I	96.2	Very high	89.9	Confident	30 Å²	30	57.7 Å²	57.7	15%	0.154	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123	-174.9	-54.3	162.7	0	0	0	107.1	I144 Q145 L154 V178 V180	I144-I156 HydrophobicContact CB-CD1 3.9Å; I144-I156 HydrophobicContact CG2-CD1 3.52Å; I144-I156 HydrophobicContact CG2-CG1 4.17Å; Q145-I156 HydrophobicContact CB-CD1 3.89Å; L154-I156 HydrophobicContact CD2-CD1 4.12Å; L154-I156 HydrophobicContact CD2-CG1 4.42Å; L154-I156 HydrophobicContact CG-CD1 4.45Å; L154-I156 HydrophobicContact CG-CG1 4.24Å; I156-V178 WeakPolarHBondContact CA-O 3.36Å; I156-V178 HydrophobicContact CG1-CB 4.29Å; I156-V178 HydrophobicContact CG2-CB 4.38Å; I156-V180 HydrophobicContact CG2-CG2 4.18Å
157	C	94.3	Very high	88.5	Confident	24 Å²	24	53 Å²	53	16%	0.162	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	136.1	175.9	-168.5	0	0	0	0	110.4	I174 D176 V178 I179 V180 W189	C157-I174 HydrophobicContact CB-CG2 4.21Å; C157-D176 HydrophobicContact CB-CB 3.78Å; C157-V178 PolarHBondContact N-O 3.29Å; C157-I179 WeakPolarHBondContact O-CA 3.41Å; C157-V180 PolarHBondContact O-N 3.43Å; C157-W189 WeakPolarHBondContact SG-CH2 3.21Å; C157-W189 VanDerWaalsContact SG-CZ3 3.53Å
158	L	95.4	Very high	86.8	Confident	43 Å²	43	55.4 Å²	55.4	23%	0.225	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	114.3	173.8	-66	173.1	0	0	0	109.9	A137 L138 V160 T163 V180 W189	A137-L158 WeakPolarHBondContact O-CD2 3.17Å; L138-L158 HydrophobicContact CD2-CD1 3.57Å; L158-V160 HydrophobicContact CB-CG2 3.98Å; L158-V160 PolarHBondContact O-N 2.87Å; L158-T163 HydrophobicContact CB-CG2 4.33Å; L158-T163 WeakPolarHBondContact O-CB 3.49Å; L158-T163 WeakPolarHBondContact O-CG2 3.48Å; L158-T163 PolarHBondContact O-OG1 2.93Å; L158-V180 CarbonylContact C-O 3.59Å; L158-V180 VanDerWaalsContact CA-O 3.26Å; L158-V180 WeakPolarHBondContact CA-O 3.46Å; L158-V180 HydrophobicContact CD2-CB 4.11Å; L158-W189 VanDerWaalsContact O-CH2 3.22Å; L158-W189 WeakPolarHBondContact O-CH2 3.38Å
159	A	94.3	Very high	84.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	75.8	173.7	0	0	0	0	0	109.9	I179 V180 G181 T182 T185 I186 W189	A159-I179 HydrophobicContact CB-CG2 3.62Å; A159-V180 PolarHBondContact N-O 2.89Å; A159-G181 VanDerWaalsContact O-CA 3.23Å; A159-G181 WeakPolarHBondContact O-CA 3.27Å; A159-T182 PolarHBondContact O-N 2.87Å; A159-T182 VanDerWaalsContact O-N 3.1Å; A159-T185 HydrophobicContact CB-CG2 3.95Å; A159-T185 VanDerWaalsContact O-CB 3.29Å; A159-T185 WeakPolarHBondContact O-CB 3.46Å; A159-T185 WeakPolarHBondContact O-CG2 3.3Å; A159-I186 HydrophobicContact CB-CD1 4.46Å; A159-I186 HydrophobicContact CB-CG1 3.56Å; A159-W189 HydrophobicContact CB-CD2 4.19Å; A159-W189 HydrophobicContact CB-CE3 3.57Å; A159-W189 HydrophobicContact CB-CH2 4.05Å; A159-W189 HydrophobicContact CB-CZ3 3.5Å; A159-W189 VanDerWaalsContact CB-CZ3 3.5Å
160	V	90.5	Very high	83.5	Confident	3 Å²	3	62.3 Å²	62.3	2%	0.018	32%	0.322	C	S	.	.	S	Bend	trans	-128.8	168.5	-176.4	-69.6	0	0	0	0	110.6	Y134 A137 L158 E162 T163 D164	Y134-V160 HydrophobicContact CD2-CB 3.64Å; Y134-V160 HydrophobicContact CD2-CG1 3.69Å; Y134-V160 HydrophobicContact CD2-CG2 4.12Å; Y134-V160 HydrophobicContact CE2-CB 3.79Å; Y134-V160 HydrophobicContact CE2-CG1 4.11Å; Y134-V160 HydrophobicContact CE2-CG2 3.73Å; A137-V160 HydrophobicContact CB-CG1 3.78Å; L158-V160 HydrophobicContact CB-CG2 3.98Å; L158-V160 PolarHBondContact O-N 2.87Å; V160-E162 VanDerWaalsContact C-N 3.32Å; V160-E162 PolarHBondContact O-N 2.91Å; V160-T163 HydrophobicContact CG2-CG2 3.92Å; V160-T163 WeakPolarHBondContact CG2-OG1 3.5Å; V160-T163 PolarHBondContact N-OG1 3.32Å; V160-T163 PolarHBondContact O-N 2.78Å; V160-T163 PolarHBondContact O-OG1 3.3Å; V160-D164 WeakPolarHBondContact O-CB 3.42Å; V160-D164 PolarHBondContact O-N 3.35Å; V160-D164 VanDerWaalsContact O-N 3.17Å
161	R	84.1	Confident	82.2	Confident	155 Å²	155	66.2 Å²	66.2	59%	0.585	35%	0.346	S	S	*	.	H	α-helix	trans	-58.3	-43	-174.4	-176.6	175.7	170.6	175.9	-3.4	112.8	D164 E165	R161-D164 PolarHBondContact O-N 3.12Å; R161-E165 HydrophobicContact CG-CG 4.49Å; R161-E165 WeakPolarHBondContact CG-OE1 3.42Å; R161-E165 IonicContact CZ-OE1 3.14Å; R161-E165 IonicContact NE-OE1 2.64Å; R161-E165 PolarHBondContact NE-OE1 2.83Å; R161-E165 IonicContact NH2-OE1 3.55Å; R161-E165 PolarHBondContact NH2-OE1 2.8Å; R161-E165 WeakPolarHBondContact O-CG 3.49Å; R161-E165 PolarHBondContact O-N 3.11Å
162	E	78.2	Confident	81.5	Confident	66 Å²	66	71.5 Å²	71.5	31%	0.308	38%	0.375	S	S	.	.	H	α-helix	trans	-63.1	-46.4	-177.7	-64.5	-178.1	-177	0	0	112.8	Y134 V160 D164 E165 Q166 V334	Y134-E162 HydrophobicContact CE2-CG 4.38Å; Y134-E162 PolarHBondContact OH-OE1 3.22Å; Y134-E162 PolarHBondContact OH-OE2 3.12Å; V160-E162 VanDerWaalsContact C-N 3.32Å; V160-E162 PolarHBondContact O-N 2.91Å; E162-D164 VanDerWaalsContact C-N 3.29Å; E162-D164 PolarHBondContact O-N 3.14Å; E162-E165 PolarHBondContact O-N 3.23Å; E162-Q166 WeakPolarHBondContact O-CG 3.33Å; E162-Q166 PolarHBondContact O-N 2.97Å; E162-V334 HydrophobicContact CG-CG1 4.38Å; E162-V334 WeakPolarHBondContact OE1-CG1 3.11Å
163	T	77.7	Confident	81.3	Confident	40 Å²	40	75.3 Å²	75.3	25%	0.245	37%	0.373	C	S	.	.	H	α-helix	trans	-67.7	-32.9	179.5	51.4	0	0	0	0	111.9	L158 V160 G167	L158-T163 HydrophobicContact CB-CG2 4.33Å; L158-T163 WeakPolarHBondContact O-CB 3.49Å; L158-T163 WeakPolarHBondContact O-CG2 3.48Å; L158-T163 PolarHBondContact O-OG1 2.93Å; V160-T163 HydrophobicContact CG2-CG2 3.92Å; V160-T163 WeakPolarHBondContact CG2-OG1 3.5Å; V160-T163 PolarHBondContact N-OG1 3.32Å; V160-T163 PolarHBondContact O-N 2.78Å; V160-T163 PolarHBondContact O-OG1 3.3Å; T163-G167 PolarHBondContact O-N 2.64Å
164	D	77.9	Confident	81.1	Confident	1 Å²	1	72 Å²	72	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-70.6	-37.7	176	-150.9	-18.8	0	0	0	112.6	V160 R161 E162 G167 A168 T185 R188 W189 Q193	V160-D164 WeakPolarHBondContact O-CB 3.42Å; V160-D164 PolarHBondContact O-N 3.35Å; V160-D164 VanDerWaalsContact O-N 3.17Å; R161-D164 PolarHBondContact O-N 3.12Å; E162-D164 VanDerWaalsContact C-N 3.29Å; E162-D164 PolarHBondContact O-N 3.14Å; D164-G167 CarbonylContact O-C 3.53Å; D164-G167 PolarHBondContact O-N 3.44Å; D164-A168 WeakPolarHBondContact O-CA 3.37Å; D164-A168 WeakPolarHBondContact O-CB 3.27Å; D164-A168 PolarHBondContact O-N 2.97Å; D164-T185 HydrophobicContact CB-CG2 4.14Å; D164-T185 WeakPolarHBondContact OD2-CG2 3.46Å; D164-R188 VanDerWaalsContact CG-NE 3.35Å; D164-R188 IonicContact OD1-CZ 3.16Å; D164-R188 IonicContact OD1-NE 3.04Å; D164-R188 IonicContact OD1-NH2 3.51Å; D164-R188 IonicContact OD2-CZ 2.78Å; D164-R188 IonicContact OD2-NE 3.13Å; D164-R188 PolarHBondContact OD2-NE 3.1Å; D164-R188 IonicContact OD2-NH2 3.16Å; D164-R188 PolarHBondContact OD2-NH2 3.3Å; D164-W189 PolarHBondContact OD1-NE1 2.74Å; D164-W189 VanDerWaalsContact OD1-NE1 3.14Å; D164-W189 PolarHBondContact OD2-NE1 2.88Å; D164-Q193 PolarHBondContact OD1-NE2 2.83Å; D164-Q193 PolarHBondContact OD1-OE1 2.8Å
165	E	76.2	Confident	80.9	Confident	112 Å²	112	73.4 Å²	73.4	52%	0.523	37%	0.369	S	S	.	.	H	α-helix	trans	-66.2	-41.5	174.7	-74.1	174.9	-174.3	0	0	111.2	R161 E162	R161-E165 HydrophobicContact CG-CG 4.49Å; R161-E165 WeakPolarHBondContact CG-OE1 3.42Å; R161-E165 IonicContact CZ-OE1 3.14Å; R161-E165 IonicContact NE-OE1 2.64Å; R161-E165 PolarHBondContact NE-OE1 2.83Å; R161-E165 IonicContact NH2-OE1 3.55Å; R161-E165 PolarHBondContact NH2-OE1 2.8Å; R161-E165 WeakPolarHBondContact O-CG 3.49Å; R161-E165 PolarHBondContact O-N 3.11Å; E162-E165 PolarHBondContact O-N 3.23Å
166	Q	69.6	Low	80.8	Confident	164 Å²	164	70.7 Å²	70.7	77%	0.766	36%	0.362	S	S	*	.	H	α-helix	trans	-66.8	-36.3	175.6	-69.6	174.5	8.6	0	0	112.7	E162	E162-Q166 WeakPolarHBondContact O-CG 3.33Å; E162-Q166 PolarHBondContact O-N 2.97Å
167	G	62.8	Low	80.9	Confident	21 Å²	21	69.3 Å²	69.3	22%	0.216	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	6.5	-178.5	0	0	0	0	0	114.9	T163 D164 N169 S170 K195	T163-G167 PolarHBondContact O-N 2.64Å; D164-G167 CarbonylContact O-C 3.53Å; D164-G167 PolarHBondContact O-N 3.44Å; G167-N169 PolarHBondContact O-N 3.5Å; G167-S170 PolarHBondContact O-N 2.8Å; G167-S170 VanDerWaalsContact O-N 3.08Å; G167-K195 PolarHBondContact O-NZ 3.44Å
168	A	58	Low	81.1	Confident	53 Å²	53	68.1 Å²	68.1	44%	0.438	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.7	-169.1	0	0	0	0	0	113.7	D164	D164-A168 WeakPolarHBondContact O-CA 3.37Å; D164-A168 WeakPolarHBondContact O-CB 3.27Å; D164-A168 PolarHBondContact O-N 2.97Å
169	N	55.3	Low	81.2	Confident	164 Å²	164	66.2 Å²	66.2	88%	0.877	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-8.2	-178.1	-65.1	-28.9	0	0	0	114.4	G167	G167-N169 PolarHBondContact O-N 3.5Å
170	S	67.5	Low	81.4	Confident	41 Å²	41	66.2 Å²	66.2	29%	0.287	34%	0.336	S	S	.	.			trans	-89.5	125.4	175.2	167	0	0	0	0	109.4	G167 D172 K195	G167-S170 PolarHBondContact O-N 2.8Å; G167-S170 VanDerWaalsContact O-N 3.08Å; S170-D172 WeakPolarHBondContact OG-CB 3.4Å; S170-D172 PolarHBondContact OG-N 3.09Å; S170-D172 PolarHBondContact OG-OD2 2.99Å; S170-K195 WeakPolarHBondContact O-CE 3.33Å; S170-K195 PolarHBondContact O-NZ 3.3Å
171	N	68.6	Low	81.6	Confident	143 Å²	143	66 Å²	66	77%	0.765	34%	0.335	S	S	*	.			trans	-87.4	12.8	168.8	-78.3	-17.9	0	0	0	111.9	R173	N171-R173 PolarHBondContact O-N 3.08Å
172	D	81.9	Confident	82.1	Confident	121 Å²	121	60 Å²	60	65%	0.647	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-66.6	134.3	-177.7	-61	-39.5	0	0	0	109.9	S170	S170-D172 WeakPolarHBondContact OG-CB 3.4Å; S170-D172 PolarHBondContact OG-N 3.09Å; S170-D172 PolarHBondContact OG-OD2 2.99Å
173	R	88.9	Confident	82.9	Confident	203 Å²	203	56.9 Å²	56.9	77%	0.766	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-68.8	136.9	172.5	-73.8	-176.3	168.6	153.4	-2	109.1	N171 S175 K195	N171-R173 PolarHBondContact O-N 3.08Å; R173-S175 PolarHBondContact O-N 3.39Å; R173-K195 WeakPolarHBondContact CA-O 3.13Å
174	I	91.3	Very high	83.6	Confident	22 Å²	22	56.3 Å²	56.3	11%	0.113	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-65.6	127.4	173.6	-69.6	165.5	0	0	0	107.7	P125 C157 D176 I179 W189 K195 V196	P125-I174 VanDerWaalsContact CD-O 3.27Å; P125-I174 WeakPolarHBondContact CD-O 3.45Å; P125-I174 HydrophobicContact CG-CB 4.35Å; P125-I174 HydrophobicContact CG-CG2 3.92Å; C157-I174 HydrophobicContact CB-CG2 4.21Å; I174-D176 HydrophobicContact CG2-CB 3.86Å; I174-I179 HydrophobicContact CG2-CD1 4.3Å; I174-I179 HydrophobicContact CG2-CG1 4.42Å; I174-W189 HydrophobicContact CD1-CD2 3.8Å; I174-W189 HydrophobicContact CD1-CE3 3.11Å; I174-W189 HydrophobicContact CD1-CH2 4.02Å; I174-W189 HydrophobicContact CD1-CZ3 3.24Å; I174-K195 HydrophobicContact CD1-CB 4.12Å; I174-K195 HydrophobicContact CG1-CB 4.32Å; I174-K195 PolarHBondContact N-O 2.78Å; I174-V196 HydrophobicContact CB-CG2 4.36Å; I174-V196 HydrophobicContact CD1-CG2 3.57Å; I174-V196 HydrophobicContact CG1-CG2 4.44Å
175	S	93.3	Very high	84.4	Confident	42 Å²	42	56.7 Å²	56.7	29%	0.294	31%	0.306	S	S	.	.			trans	-106.4	-1.5	-179.3	67.2	0	0	0	0	112.7	K123 W124 R173	K123-S175 CarbonylContact C-O 3.49Å; K123-S175 WeakPolarHBondContact CA-O 3.29Å; W124-S175 PolarHBondContact N-O 2.89Å; R173-S175 PolarHBondContact O-N 3.39Å
176	D	95.8	Very high	85.3	Confident	37 Å²	37	51.5 Å²	51.5	20%	0.198	28%	0.282	C	S	.	.			trans	-68.1	145.1	179	-58.6	-112.8	0	0	0	111.6	W124 P125 R155 C157 I174	W124-D176 CarbonylContact C-O 3.56Å; P125-D176 WeakPolarHBondContact CA-O 3.45Å; P125-D176 WeakPolarHBondContact CD-O 3.2Å; P125-D176 WeakPolarHBondContact CG-O 3.39Å; R155-D176 HydrophobicContact CB-CB 3.99Å; C157-D176 HydrophobicContact CB-CB 3.78Å; I174-D176 HydrophobicContact CG2-CB 3.86Å
177	H	97.8	Very high	86.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	C	.	.	S	Bend	trans	-74.6	-34.3	-176.6	-58.1	98.3	0	0	0	112.1	L120 Q122 Q126 C127 E153 R155	L120-H177 PolarHBondContact O-NE2 3.43Å; Q122-H177 PolarHBondContact O-CD2 3.45Å; Q122-H177 PolarHBondContact O-NE2 3.21Å; Q126-H177 PolarHBondContact N-O 3.3Å; C127-H177 PolarHBondContact N-O 2.97Å; C127-H177 VanDerWaalsContact N-O 3.13Å; E153-H177 PolarHBondContact O-CE1 3.26Å; E153-H177 PolarHBondContact O-ND1 3.27Å; R155-H177 PolarHBondContact N-ND1 3.22Å; R155-H177 PolarHBondContact O-N 3.11Å
178	V	98	Very high	87.9	Confident	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131	-174.4	-173	0	0	0	0	109.4	I114 V118 C127 I144 L154 R155 I156 C157 V180	I114-V178 HydrophobicContact CD1-CG1 4.47Å; I114-V178 HydrophobicContact CG2-CB 4.45Å; I114-V178 HydrophobicContact CG2-CG1 4.1Å; I114-V178 HydrophobicContact CG2-CG2 3.45Å; I114-V178 VanDerWaalsContact CG2-CG2 3.45Å; V118-V178 HydrophobicContact CG1-CG2 4.1Å; C127-V178 HydrophobicContact CB-CG1 4.29Å; C127-V178 HydrophobicContact CB-CG2 4.39Å; I144-V178 HydrophobicContact CD1-CG1 4.22Å; L154-V178 HydrophobicContact CD1-CG2 4.34Å; R155-V178 PolarHBondContact O-N 3.04Å; I156-V178 WeakPolarHBondContact CA-O 3.36Å; I156-V178 HydrophobicContact CG1-CB 4.29Å; I156-V178 HydrophobicContact CG2-CB 4.38Å; C157-V178 PolarHBondContact N-O 3.29Å; V178-V180 HydrophobicContact CG1-CG2 4.08Å
179	I	97.7	Very high	89.5	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129	169.1	-62.2	175.4	0	0	0	108.1	P125 C127 C129 C157 A159 I174 I186 V196	P125-I179 HydrophobicContact CB-CD1 3.76Å; P125-I179 HydrophobicContact CB-CG1 4.21Å; P125-I179 HydrophobicContact CG-CD1 3.65Å; P125-I179 HydrophobicContact CG-CG1 4.22Å; C127-I179 PolarHBondContact O-N 3.34Å; C129-I179 PolarHBondContact N-O 3.27Å; C157-I179 WeakPolarHBondContact O-CA 3.41Å; A159-I179 HydrophobicContact CB-CG2 3.62Å; I174-I179 HydrophobicContact CG2-CD1 4.3Å; I174-I179 HydrophobicContact CG2-CG1 4.42Å; I179-I186 HydrophobicContact CG2-CG1 4.33Å; I179-V196 HydrophobicContact CD1-CB 4.23Å; I179-V196 HydrophobicContact CD1-CG1 3.65Å; I179-V196 HydrophobicContact CD1-CG2 3.46Å; I179-V196 VanDerWaalsContact CD1-CG2 3.46Å
180	V	97.8	Very high	91.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	128.5	171.8	-175	0	0	0	0	108.3	C129 A137 V140 I144 I156 C157 L158 A159 V178	C129-V180 HydrophobicContact CB-CG1 4.43Å; C129-V180 HydrophobicContact CB-CG2 4.18Å; C129-V180 WeakPolarHBondContact O-CA 3.19Å; A137-V180 HydrophobicContact CB-CG1 4.27Å; V140-V180 HydrophobicContact CB-CG1 3.91Å; V140-V180 HydrophobicContact CG1-CG1 3.74Å; V140-V180 HydrophobicContact CG1-CG2 4.24Å; I144-V180 HydrophobicContact CD1-CG2 3.77Å; I156-V180 HydrophobicContact CG2-CG2 4.18Å; C157-V180 PolarHBondContact O-N 3.43Å; L158-V180 CarbonylContact C-O 3.59Å; L158-V180 VanDerWaalsContact CA-O 3.26Å; L158-V180 WeakPolarHBondContact CA-O 3.46Å; L158-V180 HydrophobicContact CD2-CB 4.11Å; A159-V180 PolarHBondContact N-O 2.89Å; V178-V180 HydrophobicContact CG1-CG2 4.08Å
181	G	95.8	Very high	92.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-173.9	179.1	0	0	0	0	0	116.2	C129 V130 V131 A159	C129-G181 PolarHBondContact O-N 2.98Å; V130-G181 WeakPolarHBondContact CA-O 3.42Å; V131-G181 PolarHBondContact N-O 3Å; A159-G181 VanDerWaalsContact O-CA 3.23Å; A159-G181 WeakPolarHBondContact O-CA 3.27Å
182	T	94.1	Very high	93.1	Very high	28 Å²	28	38.1 Å²	38.1	17%	0.172	20%	0.195	C	C	.	.			trans	-85.7	148.6	-179.4	64.7	0	0	0	0	111	V131 A159 G184 T185 I186	V131-T182 WeakPolarHBondContact O-CA 3.3Å; A159-T182 PolarHBondContact O-N 2.87Å; A159-T182 VanDerWaalsContact O-N 3.1Å; T182-G184 VanDerWaalsContact C-N 3.26Å; T182-G184 PolarHBondContact O-N 3.41Å; T182-T185 PolarHBondContact O-N 3.17Å; T182-I186 WeakPolarHBondContact O-CG1 3.38Å; T182-I186 PolarHBondContact O-N 2.91Å; T182-I186 VanDerWaalsContact O-N 3.09Å
183	P	94.7	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-56.2	-39.4	-174.7	-22.2	26.6	0	0	0	113.5	V130 V131 T185 I186 I187 M212 L218 Q221 I225	V130-P183 HydrophobicContact CG1-CB 4.07Å; V130-P183 HydrophobicContact CG1-CG 3.5Å; V130-P183 VanDerWaalsContact CG1-CG 3.5Å; V131-P183 WeakPolarHBondContact O-CD 3.37Å; P183-T185 PolarHBondContact O-N 3.44Å; P183-I186 PolarHBondContact O-N 3.04Å; P183-I187 WeakPolarHBondContact O-CB 3.15Å; P183-I187 VanDerWaalsContact O-CG1 3.28Å; P183-I187 WeakPolarHBondContact O-CG1 3.46Å; P183-I187 PolarHBondContact O-N 2.93Å; P183-M212 HydrophobicContact CG-CE 3.59Å; P183-M212 HydrophobicContact CG-SD 4Å; P183-L218 HydrophobicContact CG-CD2 3.93Å; P183-Q221 HydrophobicContact CB-CB 3.57Å; P183-Q221 HydrophobicContact CB-CG 4.47Å; P183-I225 HydrophobicContact CB-CD1 4.07Å
184	G	93.4	Very high	93.4	Very high	29 Å²	29	29.2 Å²	29.2	30%	0.299	17%	0.165	S	C	.	.	H	α-helix	trans	-60.5	-45.8	-179.5	0	0	0	0	0	113.3	T182 R188	T182-G184 VanDerWaalsContact C-N 3.26Å; T182-G184 PolarHBondContact O-N 3.41Å; G184-R188 PolarHBondContact O-N 3.3Å
185	T	93.4	Very high	93.3	Very high	8 Å²	8	28.8 Å²	28.8	5%	0.049	16%	0.162	C	C	.	.	H	α-helix	trans	-71.3	-41.8	178.4	-62	0	0	0	0	111.5	A159 D164 T182 P183 I187 R188 W189	A159-T185 HydrophobicContact CB-CG2 3.95Å; A159-T185 VanDerWaalsContact O-CB 3.29Å; A159-T185 WeakPolarHBondContact O-CB 3.46Å; A159-T185 WeakPolarHBondContact O-CG2 3.3Å; D164-T185 HydrophobicContact CB-CG2 4.14Å; D164-T185 WeakPolarHBondContact OD2-CG2 3.46Å; T182-T185 PolarHBondContact O-N 3.17Å; P183-T185 PolarHBondContact O-N 3.44Å; T185-I187 VanDerWaalsContact C-N 3.3Å; T185-I187 PolarHBondContact O-N 3.49Å; T185-R188 PolarHBondContact O-N 2.73Å; T185-R188 VanDerWaalsContact O-N 3.1Å; T185-W189 HydrophobicContact CG2-CD2 4.16Å; T185-W189 HydrophobicContact CG2-CG 4.34Å; T185-W189 HydrophobicContact CG2-CZ2 4.27Å; T185-W189 PolarHBondContact O-N 2.99Å
186	I	95.3	Very high	93.2	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-59.2	-42.5	177.1	-70.1	173.1	0	0	0	111	V128 V130 A159 I179 T182 P183 W189 S190 F198 I225	V128-I186 HydrophobicContact CG1-CD1 3.99Å; V128-I186 HydrophobicContact CG1-CG2 4.13Å; V130-I186 HydrophobicContact CB-CD1 4.43Å; V130-I186 HydrophobicContact CG1-CD1 4.3Å; V130-I186 HydrophobicContact CG2-CD1 3.9Å; A159-I186 HydrophobicContact CB-CD1 4.46Å; A159-I186 HydrophobicContact CB-CG1 3.56Å; I179-I186 HydrophobicContact CG2-CG1 4.33Å; T182-I186 WeakPolarHBondContact O-CG1 3.38Å; T182-I186 PolarHBondContact O-N 2.91Å; T182-I186 VanDerWaalsContact O-N 3.09Å; P183-I186 PolarHBondContact O-N 3.04Å; I186-W189 PolarHBondContact O-N 3.42Å; I186-S190 WeakPolarHBondContact O-CB 3.07Å; I186-S190 PolarHBondContact O-N 3.41Å; I186-S190 PolarHBondContact O-OG 3.48Å; I186-F198 HydrophobicContact CG2-CE1 4.36Å; I186-F198 HydrophobicContact CG2-CZ 3.73Å; I186-I225 HydrophobicContact CB-CD1 4.21Å; I186-I225 HydrophobicContact CG2-CD1 3.83Å; I186-I225 HydrophobicContact CG2-CG1 4.2Å
187	I	94.3	Very high	93	Very high	19 Å²	19	29.2 Å²	29.2	10%	0.097	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-46.4	173.8	-72.8	167.2	0	0	0	110.8	P183 T185 W189 S190 F191 Q221 Q224 I225	P183-I187 WeakPolarHBondContact O-CB 3.15Å; P183-I187 VanDerWaalsContact O-CG1 3.28Å; P183-I187 WeakPolarHBondContact O-CG1 3.46Å; P183-I187 PolarHBondContact O-N 2.93Å; T185-I187 VanDerWaalsContact C-N 3.3Å; T185-I187 PolarHBondContact O-N 3.49Å; I187-W189 VanDerWaalsContact C-N 3.32Å; I187-W189 PolarHBondContact O-N 3.2Å; I187-S190 PolarHBondContact O-N 3.05Å; I187-S190 PolarHBondContact O-OG 2.74Å; I187-F191 HydrophobicContact CB-CD2 4.14Å; I187-F191 HydrophobicContact CB-CE2 4.5Å; I187-F191 HydrophobicContact CG1-CD2 4.29Å; I187-F191 HydrophobicContact CG1-CE2 4.15Å; I187-F191 HydrophobicContact CG2-CB 4.28Å; I187-F191 HydrophobicContact CG2-CD2 3.79Å; I187-F191 HydrophobicContact CG2-CE2 4.4Å; I187-F191 HydrophobicContact CG2-CG 4.16Å; I187-F191 WeakPolarHBondContact O-CB 3.14Å; I187-F191 VanDerWaalsContact O-CD2 3.31Å; I187-F191 WeakPolarHBondContact O-CD2 3.34Å; I187-F191 PolarHBondContact O-N 3.34Å; I187-Q221 HydrophobicContact CD1-CB 3.45Å; I187-Q221 VanDerWaalsContact CD1-CB 3.45Å; I187-Q221 HydrophobicContact CD1-CG 3.62Å; I187-Q224 HydrophobicContact CD1-CB 4.32Å; I187-Q224 HydrophobicContact CD1-CG 4.43Å; I187-I225 HydrophobicContact CD1-CD1 4.45Å; I187-I225 HydrophobicContact CD1-CG1 4.19Å; I187-I225 HydrophobicContact CG1-CD1 4.06Å; I187-I225 HydrophobicContact CG1-CG1 3.63Å
188	R	92.2	Very high	92.9	Very high	93 Å²	93	29.8 Å²	29.8	35%	0.351	16%	0.164	S	C	.	.	I	π-helix	trans	-59.4	-44.1	178.9	-178.6	163.4	59.5	172.4	-3.1	111.6	D164 G184 T185 S190 T192 Q193	D164-R188 VanDerWaalsContact CG-NE 3.35Å; D164-R188 IonicContact OD1-CZ 3.16Å; D164-R188 IonicContact OD1-NE 3.04Å; D164-R188 IonicContact OD1-NH2 3.51Å; D164-R188 IonicContact OD2-CZ 2.78Å; D164-R188 IonicContact OD2-NE 3.13Å; D164-R188 PolarHBondContact OD2-NE 3.1Å; D164-R188 IonicContact OD2-NH2 3.16Å; D164-R188 PolarHBondContact OD2-NH2 3.3Å; G184-R188 PolarHBondContact O-N 3.3Å; T185-R188 PolarHBondContact O-N 2.73Å; T185-R188 VanDerWaalsContact O-N 3.1Å; R188-S190 PolarHBondContact O-N 3.37Å; R188-T192 WeakPolarHBondContact O-CB 3.45Å; R188-T192 PolarHBondContact O-N 2.87Å; R188-T192 VanDerWaalsContact O-N 3.14Å; R188-Q193 HydrophobicContact CG-CG 4.17Å; R188-Q193 PolarHBondContact O-N 2.91Å
189	W	92.5	Very high	92.7	Very high	9 Å²	9	33.3 Å²	33.3	3%	0.034	19%	0.189	C	C	.	.	I	π-helix	trans	-65	-36.3	179.1	-76.2	8.7	0	0	0	113.5	C157 L158 A159 D164 I174 T185 I186 I187 Q193 T194 K195 V196	C157-W189 WeakPolarHBondContact SG-CH2 3.21Å; C157-W189 VanDerWaalsContact SG-CZ3 3.53Å; L158-W189 VanDerWaalsContact O-CH2 3.22Å; L158-W189 WeakPolarHBondContact O-CH2 3.38Å; A159-W189 HydrophobicContact CB-CD2 4.19Å; A159-W189 HydrophobicContact CB-CE3 3.57Å; A159-W189 HydrophobicContact CB-CH2 4.05Å; A159-W189 HydrophobicContact CB-CZ3 3.5Å; A159-W189 VanDerWaalsContact CB-CZ3 3.5Å; D164-W189 PolarHBondContact OD1-NE1 2.74Å; D164-W189 VanDerWaalsContact OD1-NE1 3.14Å; D164-W189 PolarHBondContact OD2-NE1 2.88Å; I174-W189 HydrophobicContact CD1-CD2 3.8Å; I174-W189 HydrophobicContact CD1-CE3 3.11Å; I174-W189 HydrophobicContact CD1-CH2 4.02Å; I174-W189 HydrophobicContact CD1-CZ3 3.24Å; T185-W189 HydrophobicContact CG2-CD2 4.16Å; T185-W189 HydrophobicContact CG2-CG 4.34Å; T185-W189 HydrophobicContact CG2-CZ2 4.27Å; T185-W189 PolarHBondContact O-N 2.99Å; I186-W189 PolarHBondContact O-N 3.42Å; I187-W189 VanDerWaalsContact C-N 3.32Å; I187-W189 PolarHBondContact O-N 3.2Å; W189-Q193 VanDerWaalsContact CD1-OE1 3.24Å; W189-T194 CarbonylContact O-C 3.57Å; W189-T194 PolarHBondContact O-N 3.28Å; W189-T194 VanDerWaalsContact O-N 3.14Å; W189-K195 PolarHBondContact O-N 3.11Å; W189-V196 HydrophobicContact CB-CG2 4.03Å; W189-V196 HydrophobicContact CE3-CG2 4.29Å; W189-V196 PolarHBondContact O-N 3.38Å
190	S	91.2	Very high	92.5	Very high	18 Å²	18	38.6 Å²	38.6	13%	0.126	21%	0.209	C	C	.	.	I	π-helix	trans	-92	-41.3	-176.6	50.9	0	0	0	0	113.8	I186 I187 R188 F198	I186-S190 WeakPolarHBondContact O-CB 3.07Å; I186-S190 PolarHBondContact O-N 3.41Å; I186-S190 PolarHBondContact O-OG 3.48Å; I187-S190 PolarHBondContact O-N 3.05Å; I187-S190 PolarHBondContact O-OG 2.74Å; R188-S190 PolarHBondContact O-N 3.37Å; S190-F198 WeakPolarHBondContact OG-CE2 2.85Å; S190-F198 WeakPolarHBondContact OG-CZ 3.45Å
191	F	89.4	Confident	92.4	Very high	58 Å²	58	38.7 Å²	38.7	25%	0.254	21%	0.209	S	C	.	.	I	π-helix	trans	-94.1	-34.8	-173.3	-65.6	-107.9	0	0	0	113.3	I187 F198 Q224 R228	I187-F191 HydrophobicContact CB-CD2 4.14Å; I187-F191 HydrophobicContact CB-CE2 4.5Å; I187-F191 HydrophobicContact CG1-CD2 4.29Å; I187-F191 HydrophobicContact CG1-CE2 4.15Å; I187-F191 HydrophobicContact CG2-CB 4.28Å; I187-F191 HydrophobicContact CG2-CD2 3.79Å; I187-F191 HydrophobicContact CG2-CE2 4.4Å; I187-F191 HydrophobicContact CG2-CG 4.16Å; I187-F191 WeakPolarHBondContact O-CB 3.14Å; I187-F191 VanDerWaalsContact O-CD2 3.31Å; I187-F191 WeakPolarHBondContact O-CD2 3.34Å; I187-F191 PolarHBondContact O-N 3.34Å; F191-F198 HydrophobicContact CE2-CE2 4.14Å; F191-Q224 HydrophobicContact CE1-CG 3.75Å; F191-Q224 HydrophobicContact CE2-CG 4.27Å; F191-Q224 HydrophobicContact CZ-CG 3.6Å; F191-Q224 WeakPolarHBondContact CZ-O 3.47Å; F191-R228 HydrophobicContact CD1-CG 4.47Å; F191-R228 HydrophobicContact CE1-CG 3.4Å; F191-R228 VanDerWaalsContact CE1-CG 3.4Å; F191-R228 HydrophobicContact CE2-CG 4.31Å; F191-R228 HydrophobicContact CZ-CB 3.96Å; F191-R228 HydrophobicContact CZ-CG 3.29Å
192	T	87	Confident	92.4	Very high	108 Å²	108	42.4 Å²	42.4	66%	0.663	23%	0.225	S	C	*	.	I	π-helix	trans	-102.3	-49.1	-173.5	-49.4	0	0	0	0	112	R188	R188-T192 WeakPolarHBondContact O-CB 3.45Å; R188-T192 PolarHBondContact O-N 2.87Å; R188-T192 VanDerWaalsContact O-N 3.14Å
193	Q	87.2	Confident	92.5	Very high	40 Å²	40	41.2 Å²	41.2	19%	0.187	22%	0.218	C	C	.	.	S	Bend	trans	-93.1	-13.6	-175.4	-63.4	176.2	-4.5	0	0	113	D164 R188 W189 K195	D164-Q193 PolarHBondContact OD1-NE2 2.83Å; D164-Q193 PolarHBondContact OD1-OE1 2.8Å; R188-Q193 HydrophobicContact CG-CG 4.17Å; R188-Q193 PolarHBondContact O-N 2.91Å; W189-Q193 VanDerWaalsContact CD1-OE1 3.24Å; Q193-K195 HydrophobicContact CB-CD 4.19Å; Q193-K195 HydrophobicContact CB-CG 3.95Å; Q193-K195 PolarHBondContact O-N 3.4Å; Q193-K195 VanDerWaalsContact O-N 3.12Å; Q193-K195 VanDerWaalsContact OE1-CD 3.23Å
194	T	88.5	Confident	92.6	Very high	97 Å²	97	41.2 Å²	41.2	60%	0.595	22%	0.218	S	C	*	.			trans	55.2	26.9	179.5	64.4	0	0	0	0	115.1	W189 V196	W189-T194 CarbonylContact O-C 3.57Å; W189-T194 PolarHBondContact O-N 3.28Å; W189-T194 VanDerWaalsContact O-N 3.14Å; T194-V196 VanDerWaalsContact C-N 3.32Å
195	K	90	Very high	92.8	Very high	14 Å²	14	39.8 Å²	39.8	6%	0.061	20%	0.203	C	C	.	.			trans	-73.2	-25.2	177.2	-67.8	-179	175.4	171.1	0	112.8	G167 S170 R173 I174 W189 Q193	G167-K195 PolarHBondContact O-NZ 3.44Å; S170-K195 WeakPolarHBondContact O-CE 3.33Å; S170-K195 PolarHBondContact O-NZ 3.3Å; R173-K195 WeakPolarHBondContact CA-O 3.13Å; I174-K195 HydrophobicContact CD1-CB 4.12Å; I174-K195 HydrophobicContact CG1-CB 4.32Å; I174-K195 PolarHBondContact N-O 2.78Å; W189-K195 PolarHBondContact O-N 3.11Å; Q193-K195 HydrophobicContact CB-CD 4.19Å; Q193-K195 HydrophobicContact CB-CG 3.95Å; Q193-K195 PolarHBondContact O-N 3.4Å; Q193-K195 VanDerWaalsContact O-N 3.12Å; Q193-K195 VanDerWaalsContact OE1-CD 3.23Å
196	V	92.1	Very high	93	Very high	9 Å²	9	39.4 Å²	39.4	6%	0.055	20%	0.201	C	C	.	.			trans	-122.6	125.5	-177.1	-177.1	0	0	0	0	109.6	P125 I174 I179 W189 T194 F198	P125-V196 HydrophobicContact CB-CG1 4.24Å; P125-V196 HydrophobicContact CG-CG1 4.16Å; I174-V196 HydrophobicContact CB-CG2 4.36Å; I174-V196 HydrophobicContact CD1-CG2 3.57Å; I174-V196 HydrophobicContact CG1-CG2 4.44Å; I179-V196 HydrophobicContact CD1-CB 4.23Å; I179-V196 HydrophobicContact CD1-CG1 3.65Å; I179-V196 HydrophobicContact CD1-CG2 3.46Å; I179-V196 VanDerWaalsContact CD1-CG2 3.46Å; W189-V196 HydrophobicContact CB-CG2 4.03Å; W189-V196 HydrophobicContact CE3-CG2 4.29Å; W189-V196 PolarHBondContact O-N 3.38Å; T194-V196 VanDerWaalsContact C-N 3.32Å; V196-F198 HydrophobicContact CB-CE1 4.45Å; V196-F198 HydrophobicContact CG1-CD1 3.67Å; V196-F198 HydrophobicContact CG1-CE1 3.61Å
197	D	91.7	Very high	92.9	Very high	79 Å²	79	39.6 Å²	39.6	42%	0.422	20%	0.202	S	C	.	.			trans	-99.8	110	172.1	178.5	6.4	0	0	0	109.9	S199	D197-S199 PolarHBondContact O-N 2.86Å; D197-S199 WeakPolarHBondContact OD1-CB 3.18Å; D197-S199 PolarHBondContact OD1-N 3.14Å; D197-S199 PolarHBondContact OD1-OG 3.12Å; D197-S199 PolarHBondContact OD2-OG 2.6Å
198	F	94.9	Very high	92.7	Very high	11 Å²	11	39.3 Å²	39.3	5%	0.048	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-71.3	-13.7	178.9	-71.1	-17.1	0	0	0	114.2	V128 I186 S190 F191 V196 R200 V201 I225 R228 L229 P230	V128-F198 HydrophobicContact CG2-CD1 4.3Å; V128-F198 HydrophobicContact CG2-CE1 3.93Å; I186-F198 HydrophobicContact CG2-CE1 4.36Å; I186-F198 HydrophobicContact CG2-CZ 3.73Å; S190-F198 WeakPolarHBondContact OG-CE2 2.85Å; S190-F198 WeakPolarHBondContact OG-CZ 3.45Å; F191-F198 HydrophobicContact CE2-CE2 4.14Å; V196-F198 HydrophobicContact CB-CE1 4.45Å; V196-F198 HydrophobicContact CG1-CD1 3.67Å; V196-F198 HydrophobicContact CG1-CE1 3.61Å; F198-R200 PolarHBondContact O-N 3.03Å; F198-V201 HydrophobicContact CB-CG2 4.42Å; F198-V201 HydrophobicContact CD1-CG2 3.94Å; F198-V201 WeakPolarHBondContact O-CB 3.21Å; F198-V201 PolarHBondContact O-N 3.14Å; F198-I225 HydrophobicContact CE2-CG2 3.87Å; F198-I225 HydrophobicContact CZ-CG2 4.06Å; F198-R228 HydrophobicContact CD2-CB 3.75Å; F198-R228 HydrophobicContact CE2-CB 4.41Å; F198-L229 HydrophobicContact CB-CD2 4.45Å; F198-L229 HydrophobicContact CD2-CD2 4.41Å; F198-L229 HydrophobicContact CG-CD2 4.33Å; F198-P230 VanDerWaalsContact O-CD 3.24Å; F198-P230 WeakPolarHBondContact O-CD 3.3Å
199	S	94	Very high	92.7	Very high	75 Å²	75	35 Å²	35	52%	0.524	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-59	-19.3	-177.9	71.2	0	0	0	0	113.9	D197	D197-S199 PolarHBondContact O-N 2.86Å; D197-S199 WeakPolarHBondContact OD1-CB 3.18Å; D197-S199 PolarHBondContact OD1-N 3.14Å; D197-S199 PolarHBondContact OD1-OG 3.12Å; D197-S199 PolarHBondContact OD2-OG 2.6Å
200	R	93.6	Very high	92.5	Very high	113 Å²	113	34.7 Å²	34.7	43%	0.426	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-106.3	-0.7	-179.5	-54.4	-173.4	-175.4	-161.4	-2.6	114.1	W124 F198 K202	W124-R200 VanDerWaalsContact CD2-NH1 3.32Å; W124-R200 VanDerWaalsContact CH2-NH1 3.31Å; F198-R200 PolarHBondContact O-N 3.03Å; R200-K202 PolarHBondContact O-N 3.34Å
201	V	96	Very high	92.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.006	18%	0.182	C	C	.	.			trans	-73.6	120.2	178	176.3	0	0	0	0	108.6	V128 F198 L203 L229 P230	V128-V201 HydrophobicContact CB-CG1 4.41Å; V128-V201 HydrophobicContact CG2-CG1 4.03Å; V128-V201 HydrophobicContact CG2-CG2 3.77Å; F198-V201 HydrophobicContact CB-CG2 4.42Å; F198-V201 HydrophobicContact CD1-CG2 3.94Å; F198-V201 WeakPolarHBondContact O-CB 3.21Å; F198-V201 PolarHBondContact O-N 3.14Å; V201-L203 VanDerWaalsContact CG1-O 3.28Å; V201-L203 WeakPolarHBondContact CG1-O 3.1Å; V201-L229 HydrophobicContact CB-CD2 4.19Å; V201-L229 HydrophobicContact CG1-CD2 3.9Å; V201-P230 WeakPolarHBondContact O-CG 3.34Å
202	K	94.9	Very high	92.1	Very high	78 Å²	78	32.2 Å²	32.2	34%	0.339	17%	0.171	S	C	.	.			trans	-101.2	-24.5	-179.4	-56.8	177.2	-174.8	167.3	0	111.8	W93 Q126 R200 C233 Q234	W93-K202 HydrophobicContact CH2-CB 3.8Å; W93-K202 HydrophobicContact CH2-CD 4.13Å; W93-K202 HydrophobicContact CZ3-CB 3.62Å; W93-K202 WeakPolarHBondContact CZ3-O 3.4Å; Q126-K202 PolarHBondContact O-N 3.22Å; R200-K202 PolarHBondContact O-N 3.34Å; K202-C233 WeakPolarHBondContact O-CA 3.39Å; K202-Q234 PolarHBondContact O-N 2.97Å
203	L	96.3	Very high	92.1	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	129.8	-177	-176.7	61.7	0	0	0	110.7	T113 I114 Q126 C127 V128 V201 I205 Q234 L236	T113-L203 HydrophobicContact CG2-CD2 4.07Å; I114-L203 HydrophobicContact CB-CD2 4.48Å; I114-L203 HydrophobicContact CG1-CD2 3.89Å; Q126-L203 PolarHBondContact O-N 3.03Å; C127-L203 VanDerWaalsContact CA-O 3.28Å; C127-L203 WeakPolarHBondContact CA-O 3.29Å; C127-L203 HydrophobicContact CB-CB 4.27Å; V128-L203 PolarHBondContact N-O 3Å; V201-L203 VanDerWaalsContact CG1-O 3.28Å; V201-L203 WeakPolarHBondContact CG1-O 3.1Å; L203-I205 HydrophobicContact CD1-CG1 4.33Å; L203-I205 HydrophobicContact CD2-CD1 3.89Å; L203-I205 HydrophobicContact CG-CD1 4.05Å; L203-I205 HydrophobicContact CG-CG1 4.16Å; L203-Q234 CarbonylContact C-O 3.51Å; L203-Q234 WeakPolarHBondContact CA-O 3.24Å; L203-Q234 HydrophobicContact CD1-CB 4.27Å; L203-Q234 HydrophobicContact CD1-CG 4.21Å; L203-L236 HydrophobicContact CD1-CD1 3.87Å; L203-L236 HydrophobicContact CD1-CG 4.02Å
204	F	97.4	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126	175.1	179.7	-106.8	0	0	0	109.5	V128 V130 V206 I225 V226 L229 Q234 K235 L236 F237	V128-F204 HydrophobicContact CB-CD2 4.15Å; V128-F204 HydrophobicContact CG1-CD2 4.23Å; V128-F204 HydrophobicContact CG1-CE2 4.24Å; V128-F204 WeakPolarHBondContact O-CA 3.38Å; V128-F204 WeakPolarHBondContact O-CD2 3.41Å; V130-F204 HydrophobicContact CB-CZ 4.48Å; V130-F204 HydrophobicContact CG2-CD2 4.32Å; V130-F204 HydrophobicContact CG2-CE2 3.29Å; V130-F204 HydrophobicContact CG2-CZ 3.61Å; F204-V206 HydrophobicContact CD1-CG2 4.17Å; F204-V206 HydrophobicContact CE1-CG2 3.35Å; F204-V206 HydrophobicContact CZ-CG2 3.69Å; F204-I225 HydrophobicContact CD2-CG2 4.33Å; F204-I225 HydrophobicContact CE2-CB 4.49Å; F204-I225 HydrophobicContact CE2-CG2 3.5Å; F204-I225 VanDerWaalsContact CE2-CG2 3.5Å; F204-I225 HydrophobicContact CZ-CG2 4Å; F204-V226 HydrophobicContact CD1-CG2 4.19Å; F204-V226 HydrophobicContact CE1-CG2 3.54Å; F204-V226 HydrophobicContact CZ-CG2 3.99Å; F204-L229 HydrophobicContact CB-CD1 3.57Å; F204-L229 HydrophobicContact CD1-CD1 3.85Å; F204-L229 HydrophobicContact CD2-CD1 3.68Å; F204-L229 HydrophobicContact CD2-CD2 4.35Å; F204-L229 HydrophobicContact CE1-CD1 4.44Å; F204-L229 HydrophobicContact CE2-CD1 4.29Å; F204-L229 HydrophobicContact CG-CD1 3.41Å; F204-L229 VanDerWaalsContact CG-CD1 3.41Å; F204-Q234 PolarHBondContact N-O 3.1Å; F204-K235 HydrophobicContact CB-CG 4.22Å; F204-K235 HydrophobicContact CD1-CB 4.44Å; F204-K235 HydrophobicContact CD1-CG 4.1Å; F204-K235 CarbonylContact O-C 3.55Å; F204-K235 VanDerWaalsContact O-CA 3.29Å; F204-K235 WeakPolarHBondContact O-CA 3.16Å; F204-L236 PolarHBondContact O-N 3.45Å; F204-F237 HydrophobicContact CE1-CZ 4.36Å
205	I	97.6	Very high	91.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.2	-177.9	-67.4	162	0	0	0	109	F110 I114 V128 C129 V130 L203 L236 F238	F110-I205 HydrophobicContact CB-CD1 4.07Å; F110-I205 HydrophobicContact CB-CG2 4.45Å; F110-I205 HydrophobicContact CD1-CG2 4.32Å; F110-I205 HydrophobicContact CD2-CD1 4.12Å; F110-I205 HydrophobicContact CD2-CG2 4.19Å; F110-I205 HydrophobicContact CG-CD1 4.39Å; F110-I205 HydrophobicContact CG-CG2 4.11Å; I114-I205 HydrophobicContact CD1-CD1 3.56Å; I114-I205 HydrophobicContact CG1-CD1 3.39Å; V128-I205 PolarHBondContact O-N 3.35Å; C129-I205 CarbonylContact C-O 3.57Å; C129-I205 WeakPolarHBondContact CA-O 3.42Å; C129-I205 HydrophobicContact CB-CB 4.27Å; V130-I205 PolarHBondContact N-O 3.26Å; L203-I205 HydrophobicContact CD1-CG1 4.33Å; L203-I205 HydrophobicContact CD2-CD1 3.89Å; L203-I205 HydrophobicContact CG-CD1 4.05Å; L203-I205 HydrophobicContact CG-CG1 4.16Å; I205-L236 CarbonylContact C-O 3.52Å; I205-L236 VanDerWaalsContact CA-O 3.31Å; I205-L236 WeakPolarHBondContact CA-O 3.49Å; I205-L236 HydrophobicContact CG1-CB 4.13Å; I205-L236 HydrophobicContact CG1-CD1 4.2Å; I205-L236 HydrophobicContact CG1-CG 4.41Å; I205-F238 HydrophobicContact CG2-CD2 4.01Å; I205-F238 HydrophobicContact CG2-CE2 4.1Å
206	V	96.8	Very high	91.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	118.2	168	-176	0	0	0	0	108.3	V130 F204 A209 M212 T222 L236 F237 F238	V130-V206 WeakPolarHBondContact O-CA 3.44Å; F204-V206 HydrophobicContact CD1-CG2 4.17Å; F204-V206 HydrophobicContact CE1-CG2 3.35Å; F204-V206 HydrophobicContact CZ-CG2 3.69Å; V206-A209 HydrophobicContact CB-CB 4.48Å; V206-A209 HydrophobicContact CG1-CB 3.96Å; V206-M212 HydrophobicContact CG1-CB 4.44Å; V206-M212 HydrophobicContact CG1-CE 4.17Å; V206-M212 HydrophobicContact CG1-CG 3.67Å; V206-T222 HydrophobicContact CG2-CG2 4.28Å; V206-L236 PolarHBondContact N-O 2.95Å; V206-F237 HydrophobicContact CB-CD1 3.63Å; V206-F237 HydrophobicContact CB-CE1 3.95Å; V206-F237 HydrophobicContact CB-CG 4.44Å; V206-F237 HydrophobicContact CG1-CD1 4.25Å; V206-F237 HydrophobicContact CG2-CD1 3.76Å; V206-F237 HydrophobicContact CG2-CE1 3.53Å; V206-F237 HydrophobicContact CG2-CZ 4.29Å; V206-F238 PolarHBondContact O-N 2.78Å
207	D	94.1	Very high	91.1	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.032	18%	0.18	C	C	.	.	S	Bend	trans	-96.4	149.9	170.1	-158.3	4.4	0	0	0	110.1	F110 V130 V131 P132 A209	F110-D207 HydrophobicContact CE1-CB 4.12Å; F110-D207 WeakPolarHBondContact CE1-OD2 3.29Å; F110-D207 HydrophobicContact CZ-CB 4.38Å; V130-D207 PolarHBondContact O-N 3.35Å; V130-D207 VanDerWaalsContact O-N 3.09Å; V131-D207 HydrophobicContact CG1-CB 4Å; P132-D207 WeakPolarHBondContact CD-O 3.28Å; D207-A209 VanDerWaalsContact C-N 3.33Å; D207-A209 PolarHBondContact O-N 3.37Å
208	E	89.6	Confident	91	Very high	13 Å²	13	28.1 Å²	28.1	6%	0.061	17%	0.166	C	C	.	.	S	Bend	trans	48.7	52.1	-169.4	-61.6	-167.4	174.4	0	0	112.3	P132 L136 D210 E211 M212 F238 G361	P132-E208 HydrophobicContact CG-CB 3.86Å; P132-E208 WeakPolarHBondContact CG-OE2 3.33Å; L136-E208 HydrophobicContact CD2-CB 4.46Å; L136-E208 HydrophobicContact CD2-CG 3.82Å; E208-D210 VanDerWaalsContact C-N 3.26Å; E208-D210 VanDerWaalsContact C-OD1 3.25Å; E208-D210 PolarHBondContact O-N 3.06Å; E208-E211 HydrophobicContact CB-CB 4.35Å; E208-E211 WeakPolarHBondContact O-CB 3.42Å; E208-E211 PolarHBondContact O-N 3.42Å; E208-M212 PolarHBondContact O-N 2.84Å; E208-F238 PolarHBondContact N-O 3.12Å; E208-F238 VanDerWaalsContact N-O 3.11Å; E208-G361 VanDerWaalsContact OE1-CA 3.31Å; E208-G361 WeakPolarHBondContact OE1-CA 3.31Å; E208-G361 PolarHBondContact OE1-N 2.91Å
209	A	92.2	Very high	90.8	Very high	2 Å²	2	32.6 Å²	32.6	2%	0.017	18%	0.183	C	C	.	.	H	α-helix	trans	-61.8	-29.3	-173.7	0	0	0	0	0	114.2	V206 D207 E211 M212 V213 F237 F238 I250	V206-A209 HydrophobicContact CB-CB 4.48Å; V206-A209 HydrophobicContact CG1-CB 3.96Å; D207-A209 VanDerWaalsContact C-N 3.33Å; D207-A209 PolarHBondContact O-N 3.37Å; A209-E211 VanDerWaalsContact C-N 3.35Å; A209-M212 WeakPolarHBondContact O-CB 3.25Å; A209-M212 PolarHBondContact O-N 2.67Å; A209-V213 VanDerWaalsContact O-CG2 3.26Å; A209-V213 WeakPolarHBondContact O-CG2 3.33Å; A209-V213 PolarHBondContact O-N 2.73Å; A209-F237 HydrophobicContact CB-CB 4.18Å; A209-F237 HydrophobicContact CB-CD1 4.05Å; A209-F238 WeakPolarHBondContact CB-O 3.4Å; A209-F238 PolarHBondContact N-O 3.28Å; A209-I250 HydrophobicContact CB-CD1 3.69Å; A209-I250 HydrophobicContact CB-CG1 4.4Å
210	D	87.4	Confident	90.8	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	19%	0.192	C	C	.	.	H	α-helix	trans	-57	-45.9	170.2	49.5	-35.5	0	0	0	111.8	E208 M212 V213 I214 S239 T241 H390	E208-D210 VanDerWaalsContact C-N 3.26Å; E208-D210 VanDerWaalsContact C-OD1 3.25Å; E208-D210 PolarHBondContact O-N 3.06Å; D210-M212 VanDerWaalsContact C-N 3.27Å; D210-M212 PolarHBondContact O-N 3.45Å; D210-V213 PolarHBondContact O-N 2.98Å; D210-I214 WeakPolarHBondContact O-CG1 2.99Å; D210-I214 PolarHBondContact O-N 2.87Å; D210-S239 VanDerWaalsContact CB-OG 3.26Å; D210-S239 WeakPolarHBondContact CB-OG 3.31Å; D210-S239 PolarHBondContact OD1-OG 3.49Å; D210-T241 WeakPolarHBondContact CB-OG1 3.47Å; D210-T241 PolarHBondContact OD2-OG1 2.59Å; D210-H390 IonicContact OD2-CE1 3.56Å; D210-H390 PolarHBondContact OD2-CE1 2.81Å; D210-H390 IonicContact OD2-NE2 3.41Å
211	E	85	Confident	90.9	Very high	22 Å²	22	34.4 Å²	34.4	10%	0.103	19%	0.185	C	C	.	.	H	α-helix	trans	-64.6	-35.4	178.2	179.2	59.8	178.7	0	0	112	P132 E208 A209 V213 I214 S215 R360	P132-E211 HydrophobicContact CB-CB 4.35Å; P132-E211 HydrophobicContact CB-CG 3.71Å; P132-E211 HydrophobicContact CG-CB 4.36Å; P132-E211 HydrophobicContact CG-CG 4.13Å; E208-E211 HydrophobicContact CB-CB 4.35Å; E208-E211 WeakPolarHBondContact O-CB 3.42Å; E208-E211 PolarHBondContact O-N 3.42Å; A209-E211 VanDerWaalsContact C-N 3.35Å; E211-V213 PolarHBondContact O-N 3.14Å; E211-I214 PolarHBondContact O-N 3.25Å; E211-S215 PolarHBondContact O-N 3.09Å; E211-S215 VanDerWaalsContact O-N 3.12Å; E211-R360 VanDerWaalsContact CD-CD 3.48Å; E211-R360 VanDerWaalsContact CD-CZ 3.43Å; E211-R360 IonicContact OE1-CZ 3.78Å; E211-R360 IonicContact OE1-NH1 3.79Å; E211-R360 PolarHBondContact OE1-NH1 2.93Å; E211-R360 WeakPolarHBondContact OE2-CD 3.26Å; E211-R360 IonicContact OE2-CZ 2.8Å; E211-R360 IonicContact OE2-NE 3.3Å; E211-R360 PolarHBondContact OE2-NE 3.34Å; E211-R360 VanDerWaalsContact OE2-NE 3.12Å; E211-R360 IonicContact OE2-NH1 3.01Å; E211-R360 PolarHBondContact OE2-NH1 3.29Å; E211-R360 IonicContact OE2-NH2 3Å; E211-R360 PolarHBondContact OE2-NH2 3.4Å
212	M	87.9	Confident	90.8	Very high	3 Å²	3	34.4 Å²	34.4	2%	0.015	19%	0.185	C	C	.	.	H	α-helix	trans	-62.4	-31.2	174.2	-62	-62.3	-143.4	0	0	112.3	V130 P132 P183 V206 E208 A209 D210 L218 R219	V130-M212 HydrophobicContact CB-CE 4.04Å; V130-M212 HydrophobicContact CG1-CE 3.36Å; P132-M212 HydrophobicContact CB-SD 4.26Å; P183-M212 HydrophobicContact CG-CE 3.59Å; P183-M212 HydrophobicContact CG-SD 4Å; V206-M212 HydrophobicContact CG1-CB 4.44Å; V206-M212 HydrophobicContact CG1-CE 4.17Å; V206-M212 HydrophobicContact CG1-CG 3.67Å; E208-M212 PolarHBondContact O-N 2.84Å; A209-M212 WeakPolarHBondContact O-CB 3.25Å; A209-M212 PolarHBondContact O-N 2.67Å; D210-M212 VanDerWaalsContact C-N 3.27Å; D210-M212 PolarHBondContact O-N 3.45Å; M212-L218 CarbonylContact O-C 3.53Å; M212-L218 HydrophobicContact SD-CB 3.83Å; M212-L218 HydrophobicContact SD-CD1 3.92Å; M212-L218 HydrophobicContact SD-CG 4.32Å; M212-R219 WeakPolarHBondContact O-CA 3.45Å; M212-R219 VanDerWaalsContact O-CB 3.29Å; M212-R219 WeakPolarHBondContact O-CB 3.47Å; M212-R219 PolarHBondContact O-N 2.99Å
213	V	87.6	Confident	90.7	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-79.1	-46.6	177.8	-170.1	0	0	0	0	111.4	A209 D210 E211 S215 F249 I250	A209-V213 VanDerWaalsContact O-CG2 3.26Å; A209-V213 WeakPolarHBondContact O-CG2 3.33Å; A209-V213 PolarHBondContact O-N 2.73Å; D210-V213 PolarHBondContact O-N 2.98Å; E211-V213 PolarHBondContact O-N 3.14Å; V213-S215 VanDerWaalsContact C-N 3.32Å; V213-S215 PolarHBondContact O-N 2.64Å; V213-F249 HydrophobicContact CB-CD1 4.25Å; V213-F249 HydrophobicContact CG1-CB 4.01Å; V213-F249 HydrophobicContact CG1-CD1 4.05Å; V213-F249 HydrophobicContact CG1-CG 4.12Å; V213-F249 HydrophobicContact CG2-CB 4.37Å; V213-F249 HydrophobicContact CG2-CD1 3.45Å; V213-F249 VanDerWaalsContact CG2-CD1 3.45Å; V213-F249 HydrophobicContact CG2-CE1 4.13Å; V213-F249 HydrophobicContact CG2-CG 4.26Å; V213-I250 HydrophobicContact CG2-CD1 4.29Å; V213-I250 HydrophobicContact CG2-CG1 4.09Å
214	I	83.3	Confident	90.7	Very high	94 Å²	94	38 Å²	38	48%	0.482	21%	0.206	S	C	.	.	H	α-helix	trans	-60.4	-43.6	-175.8	-67.1	164.7	0	0	0	110.5	D210 E211 G216	D210-I214 WeakPolarHBondContact O-CG1 2.99Å; D210-I214 PolarHBondContact O-N 2.87Å; E211-I214 PolarHBondContact O-N 3.25Å; I214-G216 PolarHBondContact O-N 3.46Å
215	S	82	Confident	90.6	Very high	44 Å²	44	38 Å²	38	31%	0.308	21%	0.206	S	C	.	.	S	Bend	trans	-79	102	176.8	-177.4	0	0	0	0	110.8	E211 V213 G217 L218 R219	E211-S215 PolarHBondContact O-N 3.09Å; E211-S215 VanDerWaalsContact O-N 3.12Å; V213-S215 VanDerWaalsContact C-N 3.32Å; V213-S215 PolarHBondContact O-N 2.64Å; S215-G217 PolarHBondContact O-N 3.02Å; S215-L218 PolarHBondContact O-N 3.01Å; S215-L218 WeakPolarHBondContact OG-CG 3.37Å; S215-R219 PolarHBondContact O-N 3.14Å
216	G	82.5	Confident	90.5	Very high	46 Å²	46	38.9 Å²	38.9	47%	0.474	21%	0.211	S	C	.	.	H	α-helix	trans	-54.7	-25.3	-177.9	0	0	0	0	0	115.2	I214 K220	I214-G216 PolarHBondContact O-N 3.46Å; G216-K220 WeakPolarHBondContact O-CG 3.44Å; G216-K220 PolarHBondContact O-N 2.97Å
217	G	88.2	Confident	90.4	Very high	43 Å²	43	42.9 Å²	42.9	44%	0.443	24%	0.239	S	C	.	.	H	α-helix	trans	-71.4	-51.4	171.2	0	0	0	0	0	112.6	S215 R219 K220 Q221	S215-G217 PolarHBondContact O-N 3.02Å; G217-R219 VanDerWaalsContact C-N 3.28Å; G217-R219 PolarHBondContact O-N 2.96Å; G217-K220 PolarHBondContact O-N 2.78Å; G217-Q221 VanDerWaalsContact O-CG 3.31Å; G217-Q221 WeakPolarHBondContact O-CG 3.35Å; G217-Q221 PolarHBondContact O-N 3.35Å; G217-Q221 VanDerWaalsContact O-N 3.11Å
218	L	89.2	Confident	90.4	Very high	27 Å²	27	50.4 Å²	50.4	14%	0.141	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-35.9	177.7	-58.5	179.7	0	0	0	111.4	P132 P183 M212 S215 K220 Q221 T222	P132-L218 HydrophobicContact CB-CD1 4.01Å; P183-L218 HydrophobicContact CG-CD2 3.93Å; M212-L218 CarbonylContact O-C 3.53Å; M212-L218 HydrophobicContact SD-CB 3.83Å; M212-L218 HydrophobicContact SD-CD1 3.92Å; M212-L218 HydrophobicContact SD-CG 4.32Å; S215-L218 PolarHBondContact O-N 3.01Å; S215-L218 WeakPolarHBondContact OG-CG 3.37Å; L218-K220 PolarHBondContact O-N 2.81Å; L218-Q221 PolarHBondContact O-N 2.7Å; L218-T222 WeakPolarHBondContact O-CB 3.3Å; L218-T222 PolarHBondContact O-N 3.23Å; L218-T222 PolarHBondContact O-OG1 3.11Å
219	R	91.8	Very high	90.7	Very high	104 Å²	104	50.7 Å²	50.7	39%	0.392	27%	0.269	S	S	.	.	H	α-helix	trans	-58.6	-49.2	176.8	-171.8	180	169.6	176.9	-3.1	111.8	M212 S215 G217 N223 F249	M212-R219 WeakPolarHBondContact O-CA 3.45Å; M212-R219 VanDerWaalsContact O-CB 3.29Å; M212-R219 WeakPolarHBondContact O-CB 3.47Å; M212-R219 PolarHBondContact O-N 2.99Å; S215-R219 PolarHBondContact O-N 3.14Å; G217-R219 VanDerWaalsContact C-N 3.28Å; G217-R219 PolarHBondContact O-N 2.96Å; R219-N223 PolarHBondContact O-N 3.14Å; R219-N223 VanDerWaalsContact O-N 3.12Å; R219-F249 HydrophobicContact CB-CZ 4.47Å; R219-F249 HydrophobicContact CG-CD1 4.37Å; R219-F249 HydrophobicContact CG-CD2 4.14Å; R219-F249 HydrophobicContact CG-CE1 3.8Å; R219-F249 HydrophobicContact CG-CE2 3.55Å; R219-F249 HydrophobicContact CG-CZ 3.34Å; R219-F249 VanDerWaalsContact NE-CE2 3.32Å
220	K	93.7	Very high	90.8	Very high	163 Å²	163	51.9 Å²	51.9	71%	0.709	28%	0.276	S	S	*	.	H	α-helix	trans	-63.7	-43.4	177.5	-73	178.9	-177	-177.3	0	111.4	G216 G217 L218 N223 Q224	G216-K220 WeakPolarHBondContact O-CG 3.44Å; G216-K220 PolarHBondContact O-N 2.97Å; G217-K220 PolarHBondContact O-N 2.78Å; L218-K220 PolarHBondContact O-N 2.81Å; K220-N223 PolarHBondContact O-N 2.99Å; K220-Q224 WeakPolarHBondContact O-CB 3.26Å; K220-Q224 PolarHBondContact O-N 3.37Å
221	Q	94.9	Very high	91	Very high	63 Å²	63	63.8 Å²	63.8	29%	0.294	32%	0.321	S	S	.	.	H	α-helix	trans	-65	-43.7	179.8	-71.1	175.5	-25.4	0	0	111.9	P183 I187 G217 L218 N223 Q224 I225	P183-Q221 HydrophobicContact CB-CB 3.57Å; P183-Q221 HydrophobicContact CB-CG 4.47Å; I187-Q221 HydrophobicContact CD1-CB 3.45Å; I187-Q221 VanDerWaalsContact CD1-CB 3.45Å; I187-Q221 HydrophobicContact CD1-CG 3.62Å; G217-Q221 VanDerWaalsContact O-CG 3.31Å; G217-Q221 WeakPolarHBondContact O-CG 3.35Å; G217-Q221 PolarHBondContact O-N 3.35Å; G217-Q221 VanDerWaalsContact O-N 3.11Å; L218-Q221 PolarHBondContact O-N 2.7Å; Q221-N223 PolarHBondContact O-N 3.17Å; Q221-Q224 WeakPolarHBondContact O-CB 3.43Å; Q221-Q224 PolarHBondContact O-N 2.98Å; Q221-I225 WeakPolarHBondContact O-CG1 3.42Å; Q221-I225 PolarHBondContact O-N 2.94Å
222	T	94.3	Very high	91.3	Very high	1 Å²	1	68.4 Å²	68.4	1%	0.006	35%	0.347	C	S	.	.	H	α-helix	trans	-61.1	-46.7	177.1	-56.7	0	0	0	0	110.9	V206 L218 Q224 I225 V226 L253	V206-T222 HydrophobicContact CG2-CG2 4.28Å; L218-T222 WeakPolarHBondContact O-CB 3.3Å; L218-T222 PolarHBondContact O-N 3.23Å; L218-T222 PolarHBondContact O-OG1 3.11Å; T222-Q224 VanDerWaalsContact C-N 3.31Å; T222-Q224 PolarHBondContact O-N 3.26Å; T222-I225 PolarHBondContact O-N 2.64Å; T222-V226 WeakPolarHBondContact O-CG2 3.18Å; T222-V226 PolarHBondContact O-N 2.93Å; T222-L253 HydrophobicContact CG2-CD1 4.32Å
223	N	93.9	Very high	91.6	Very high	81 Å²	81	68.4 Å²	68.4	43%	0.433	35%	0.347	S	S	.	.	H	α-helix	trans	-60.4	-41.1	175.5	-169.8	11.1	0	0	0	111.9	R219 K220 Q221 I225 V226 S227 F249 L253	R219-N223 PolarHBondContact O-N 3.14Å; R219-N223 VanDerWaalsContact O-N 3.12Å; K220-N223 PolarHBondContact O-N 2.99Å; Q221-N223 PolarHBondContact O-N 3.17Å; N223-I225 PolarHBondContact O-N 3.01Å; N223-V226 PolarHBondContact O-N 3.41Å; N223-S227 WeakPolarHBondContact O-CB 3.5Å; N223-S227 PolarHBondContact O-N 3.5Å; N223-F249 HydrophobicContact CB-CZ 4.46Å; N223-L253 HydrophobicContact CB-CD2 4.46Å
224	Q	95	Very high	92	Very high	76 Å²	76	68.1 Å²	68.1	36%	0.355	35%	0.345	S	S	.	.	H	α-helix	trans	-60.2	-44.4	175.8	-178.5	178.5	-11.3	0	0	111.9	I187 F191 K220 Q221 T222 S227	I187-Q224 HydrophobicContact CD1-CB 4.32Å; I187-Q224 HydrophobicContact CD1-CG 4.43Å; F191-Q224 HydrophobicContact CE1-CG 3.75Å; F191-Q224 HydrophobicContact CE2-CG 4.27Å; F191-Q224 HydrophobicContact CZ-CG 3.6Å; F191-Q224 WeakPolarHBondContact CZ-O 3.47Å; K220-Q224 WeakPolarHBondContact O-CB 3.26Å; K220-Q224 PolarHBondContact O-N 3.37Å; Q221-Q224 WeakPolarHBondContact O-CB 3.43Å; Q221-Q224 PolarHBondContact O-N 2.98Å; T222-Q224 VanDerWaalsContact C-N 3.31Å; T222-Q224 PolarHBondContact O-N 3.26Å; Q224-S227 PolarHBondContact O-N 2.98Å; Q224-S227 PolarHBondContact O-OG 3.41Å
225	I	96.1	Very high	92.6	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.1	-50.6	176.2	-65.2	163.9	0	0	0	110.3	V130 P183 I186 I187 F198 F204 Q221 T222 N223 S227 R228 L229	V130-I225 HydrophobicContact CG1-CD1 4.38Å; V130-I225 HydrophobicContact CG2-CD1 4.28Å; P183-I225 HydrophobicContact CB-CD1 4.07Å; I186-I225 HydrophobicContact CB-CD1 4.21Å; I186-I225 HydrophobicContact CG2-CD1 3.83Å; I186-I225 HydrophobicContact CG2-CG1 4.2Å; I187-I225 HydrophobicContact CD1-CD1 4.45Å; I187-I225 HydrophobicContact CD1-CG1 4.19Å; I187-I225 HydrophobicContact CG1-CD1 4.06Å; I187-I225 HydrophobicContact CG1-CG1 3.63Å; F198-I225 HydrophobicContact CE2-CG2 3.87Å; F198-I225 HydrophobicContact CZ-CG2 4.06Å; F204-I225 HydrophobicContact CD2-CG2 4.33Å; F204-I225 HydrophobicContact CE2-CB 4.49Å; F204-I225 HydrophobicContact CE2-CG2 3.5Å; F204-I225 VanDerWaalsContact CE2-CG2 3.5Å; F204-I225 HydrophobicContact CZ-CG2 4Å; Q221-I225 WeakPolarHBondContact O-CG1 3.42Å; Q221-I225 PolarHBondContact O-N 2.94Å; T222-I225 PolarHBondContact O-N 2.64Å; N223-I225 PolarHBondContact O-N 3.01Å; I225-S227 VanDerWaalsContact C-N 3.26Å; I225-S227 PolarHBondContact O-N 3.48Å; I225-R228 PolarHBondContact O-N 3.33Å; I225-L229 PolarHBondContact O-N 3.24Å
226	V	95.6	Very high	93.2	Very high	19 Å²	19	62.5 Å²	62.5	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-57.2	-39.5	-179.6	173.6	0	0	0	0	111.8	F204 T222 N223 R228 L229 K235 L253	F204-V226 HydrophobicContact CD1-CG2 4.19Å; F204-V226 HydrophobicContact CE1-CG2 3.54Å; F204-V226 HydrophobicContact CZ-CG2 3.99Å; T222-V226 WeakPolarHBondContact O-CG2 3.18Å; T222-V226 PolarHBondContact O-N 2.93Å; N223-V226 PolarHBondContact O-N 3.41Å; V226-R228 PolarHBondContact O-N 3.08Å; V226-R228 VanDerWaalsContact O-N 3.09Å; V226-L229 HydrophobicContact CG2-CD1 4.41Å; V226-L229 WeakPolarHBondContact O-CB 3.26Å; V226-L229 PolarHBondContact O-N 3.43Å; V226-L229 VanDerWaalsContact O-N 3.1Å; V226-K235 HydrophobicContact CG1-CD 4.23Å; V226-L253 HydrophobicContact CB-CD2 4.41Å; V226-L253 HydrophobicContact CG1-CB 4.47Å; V226-L253 HydrophobicContact CG1-CD2 4.29Å; V226-L253 HydrophobicContact CG2-CD1 4.46Å
227	S	94.2	Very high	93.9	Very high	83 Å²	83	60.4 Å²	60.4	58%	0.58	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.5	179.3	77.5	0	0	0	0	114.9	N223 Q224 I225	N223-S227 WeakPolarHBondContact O-CB 3.5Å; N223-S227 PolarHBondContact O-N 3.5Å; Q224-S227 PolarHBondContact O-N 2.98Å; Q224-S227 PolarHBondContact O-OG 3.41Å; I225-S227 VanDerWaalsContact C-N 3.26Å; I225-S227 PolarHBondContact O-N 3.48Å
228	R	94.1	Very high	94.2	Very high	165 Å²	165	58.4 Å²	58.4	62%	0.623	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-6.8	177.8	-77	-60.7	-169.4	121	-0.4	114.2	F191 F198 I225 V226	F191-R228 HydrophobicContact CD1-CG 4.47Å; F191-R228 HydrophobicContact CE1-CG 3.4Å; F191-R228 VanDerWaalsContact CE1-CG 3.4Å; F191-R228 HydrophobicContact CE2-CG 4.31Å; F191-R228 HydrophobicContact CZ-CB 3.96Å; F191-R228 HydrophobicContact CZ-CG 3.29Å; F198-R228 HydrophobicContact CD2-CB 3.75Å; F198-R228 HydrophobicContact CE2-CB 4.41Å; I225-R228 PolarHBondContact O-N 3.33Å; V226-R228 PolarHBondContact O-N 3.08Å; V226-R228 VanDerWaalsContact O-N 3.09Å
229	L	95.6	Very high	94.2	Very high	18 Å²	18	57.1 Å²	57.1	9%	0.094	26%	0.262	C	S	.	.	S	Bend	trans	-70.2	149.6	175.3	-63.9	173.2	0	0	0	110.4	F198 V201 F204 I225 V226 C233	F198-L229 HydrophobicContact CB-CD2 4.45Å; F198-L229 HydrophobicContact CD2-CD2 4.41Å; F198-L229 HydrophobicContact CG-CD2 4.33Å; V201-L229 HydrophobicContact CB-CD2 4.19Å; V201-L229 HydrophobicContact CG1-CD2 3.9Å; F204-L229 HydrophobicContact CB-CD1 3.57Å; F204-L229 HydrophobicContact CD1-CD1 3.85Å; F204-L229 HydrophobicContact CD2-CD1 3.68Å; F204-L229 HydrophobicContact CD2-CD2 4.35Å; F204-L229 HydrophobicContact CE1-CD1 4.44Å; F204-L229 HydrophobicContact CE2-CD1 4.29Å; F204-L229 HydrophobicContact CG-CD1 3.41Å; F204-L229 VanDerWaalsContact CG-CD1 3.41Å; I225-L229 PolarHBondContact O-N 3.24Å; V226-L229 HydrophobicContact CG2-CD1 4.41Å; V226-L229 WeakPolarHBondContact O-CB 3.26Å; V226-L229 PolarHBondContact O-N 3.43Å; V226-L229 VanDerWaalsContact O-N 3.1Å; L229-C233 HydrophobicContact CB-CB 4.09Å
230	P	94.8	Very high	93.7	Very high	27 Å²	27	52.3 Å²	52.3	18%	0.175	24%	0.244	C	C	.	.			trans	-68.5	152.8	174.6	30.3	-33.8	0	0	0	109.9	F198 V201 N232 C233	F198-P230 VanDerWaalsContact O-CD 3.24Å; F198-P230 WeakPolarHBondContact O-CD 3.3Å; V201-P230 WeakPolarHBondContact O-CG 3.34Å; P230-N232 WeakPolarHBondContact CB-OD1 3.26Å; P230-N232 PolarHBondContact O-N 3.12Å; P230-N232 VanDerWaalsContact O-N 3.15Å; P230-C233 HydrophobicContact CG-CB 4Å; P230-C233 WeakPolarHBondContact O-CB 2.84Å; P230-C233 PolarHBondContact O-N 2.94Å
231	R	91.7	Very high	93.1	Very high	253 Å²	253	44.6 Å²	44.6	96%	0.955	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.7	-174.1	-69.7	-175.8	177	-176.8	-1.3	113.9	C233	R231-C233 VanDerWaalsContact C-N 3.31Å
232	N	91	Very high	92.5	Very high	120 Å²	120	41.8 Å²	41.8	64%	0.642	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	8.3	178.1	65.9	-44.5	0	0	0	113.3	P230 Q234	P230-N232 WeakPolarHBondContact CB-OD1 3.26Å; P230-N232 PolarHBondContact O-N 3.12Å; P230-N232 VanDerWaalsContact O-N 3.15Å; N232-Q234 PolarHBondContact O-N 3.18Å
233	C	94.5	Very high	92	Very high	2 Å²	2	44 Å²	44	1%	0.014	21%	0.21	C	C	.	.			trans	-72.1	119.4	172.4	-175.2	0	0	0	0	109.9	K202 L229 P230 R231 K235	K202-C233 WeakPolarHBondContact O-CA 3.39Å; L229-C233 HydrophobicContact CB-CB 4.09Å; P230-C233 HydrophobicContact CG-CB 4Å; P230-C233 WeakPolarHBondContact O-CB 2.84Å; P230-C233 PolarHBondContact O-N 2.94Å; R231-C233 VanDerWaalsContact C-N 3.31Å; C233-K235 PolarHBondContact O-NZ 3.48Å
234	Q	95.2	Very high	91.6	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.9	171.4	178	-179.9	31.2	0	0	109.2	W93 K94 D95 K202 L203 F204 N232 L236	W93-Q234 HydrophobicContact CE3-CB 3.83Å; W93-Q234 HydrophobicContact CZ3-CB 4.48Å; K94-Q234 WeakPolarHBondContact O-CG 3.28Å; K94-Q234 PolarHBondContact O-NE2 3.28Å; D95-Q234 WeakPolarHBondContact OD1-CA 3.44Å; K202-Q234 PolarHBondContact O-N 2.97Å; L203-Q234 CarbonylContact C-O 3.51Å; L203-Q234 WeakPolarHBondContact CA-O 3.24Å; L203-Q234 HydrophobicContact CD1-CB 4.27Å; L203-Q234 HydrophobicContact CD1-CG 4.21Å; F204-Q234 PolarHBondContact N-O 3.1Å; N232-Q234 PolarHBondContact O-N 3.18Å; Q234-L236 HydrophobicContact CG-CD2 3.92Å; Q234-L236 HydrophobicContact CG-CG 4.45Å
235	K	96.1	Very high	91.1	Very high	20 Å²	20	47.6 Å²	47.6	9%	0.087	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.1	-178.6	-62.4	166.4	-131.6	58.3	0	110.2	D95 M96 F204 V226 C233 F237 L253	D95-K235 CarbonylContact C-O 3.4Å; D95-K235 WeakPolarHBondContact CA-O 3.41Å; D95-K235 HydrophobicContact CB-CB 4.49Å; D95-K235 WeakPolarHBondContact CB-O 3.19Å; D95-K235 PolarHBondContact OD1-N 3.43Å; D95-K235 IonicContact OD1-NZ 2.85Å; D95-K235 PolarHBondContact OD1-NZ 3.06Å; D95-K235 IonicContact OD2-NZ 2.8Å; D95-K235 PolarHBondContact OD2-NZ 2.98Å; M96-K235 PolarHBondContact N-O 2.94Å; F204-K235 HydrophobicContact CB-CG 4.22Å; F204-K235 HydrophobicContact CD1-CB 4.44Å; F204-K235 HydrophobicContact CD1-CG 4.1Å; F204-K235 CarbonylContact O-C 3.55Å; F204-K235 VanDerWaalsContact O-CA 3.29Å; F204-K235 WeakPolarHBondContact O-CA 3.16Å; V226-K235 HydrophobicContact CG1-CD 4.23Å; C233-K235 PolarHBondContact O-NZ 3.48Å; K235-F237 HydrophobicContact CB-CD2 4.43Å; K235-F237 HydrophobicContact CB-CE2 3.8Å; K235-L253 WeakPolarHBondContact CD-O 3.48Å; K235-L253 WeakPolarHBondContact CE-O 3.47Å
236	L	96.1	Very high	90.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.5	176.8	-47	179	0	0	0	109.2	V88 M96 T113 L203 F204 I205 V206 Q234 F238	V88-L236 HydrophobicContact CG2-CD1 4.48Å; M96-L236 HydrophobicContact CB-CD2 3.63Å; M96-L236 HydrophobicContact CG-CD2 3.62Å; M96-L236 WeakPolarHBondContact O-CA 3.42Å; M96-L236 HydrophobicContact SD-CD2 3.94Å; T113-L236 HydrophobicContact CG2-CD1 3.77Å; L203-L236 HydrophobicContact CD1-CD1 3.87Å; L203-L236 HydrophobicContact CD1-CG 4.02Å; F204-L236 PolarHBondContact O-N 3.45Å; I205-L236 CarbonylContact C-O 3.52Å; I205-L236 VanDerWaalsContact CA-O 3.31Å; I205-L236 WeakPolarHBondContact CA-O 3.49Å; I205-L236 HydrophobicContact CG1-CB 4.13Å; I205-L236 HydrophobicContact CG1-CD1 4.2Å; I205-L236 HydrophobicContact CG1-CG 4.41Å; V206-L236 PolarHBondContact N-O 2.95Å; Q234-L236 HydrophobicContact CG-CD2 3.92Å; Q234-L236 HydrophobicContact CG-CG 4.45Å; L236-F238 HydrophobicContact CB-CD2 4.4Å; L236-F238 HydrophobicContact CB-CE2 3.59Å; L236-F238 HydrophobicContact CB-CZ 4.25Å; L236-F238 HydrophobicContact CD1-CE2 4.36Å; L236-F238 HydrophobicContact CD1-CZ 4.5Å
237	F	95.9	Very high	90.4	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123.8	178	-68.1	-96.7	0	0	0	109.3	M96 I97 V98 F204 V206 A209 K235 I250 L253 C254	M96-F237 PolarHBondContact O-N 3.28Å; I97-F237 CarbonylContact C-O 3.56Å; I97-F237 WeakPolarHBondContact CA-O 3.35Å; V98-F237 PolarHBondContact N-O 3.47Å; F204-F237 HydrophobicContact CE1-CZ 4.36Å; V206-F237 HydrophobicContact CB-CD1 3.63Å; V206-F237 HydrophobicContact CB-CE1 3.95Å; V206-F237 HydrophobicContact CB-CG 4.44Å; V206-F237 HydrophobicContact CG1-CD1 4.25Å; V206-F237 HydrophobicContact CG2-CD1 3.76Å; V206-F237 HydrophobicContact CG2-CE1 3.53Å; V206-F237 HydrophobicContact CG2-CZ 4.29Å; A209-F237 HydrophobicContact CB-CB 4.18Å; A209-F237 HydrophobicContact CB-CD1 4.05Å; K235-F237 HydrophobicContact CB-CD2 4.43Å; K235-F237 HydrophobicContact CB-CE2 3.8Å; F237-I250 HydrophobicContact CB-CG2 3.61Å; F237-I250 HydrophobicContact CD1-CG1 4.38Å; F237-I250 HydrophobicContact CD1-CG2 3.81Å; F237-I250 HydrophobicContact CD2-CG2 3.87Å; F237-I250 HydrophobicContact CE1-CG2 4.42Å; F237-I250 HydrophobicContact CE2-CG2 4.47Å; F237-I250 HydrophobicContact CG-CG2 3.49Å; F237-I250 VanDerWaalsContact CG-CG2 3.49Å; F237-L253 HydrophobicContact CE1-CD1 3.86Å; F237-L253 HydrophobicContact CE2-CB 4.27Å; F237-L253 HydrophobicContact CZ-CB 3.76Å; F237-L253 HydrophobicContact CZ-CD1 3.77Å; F237-L253 HydrophobicContact CZ-CG 4.43Å; F237-C254 WeakPolarHBondContact CD2-SG 3.5Å; F237-C254 WeakPolarHBondContact CE2-SG 3.22Å
238	F	94	Very high	90.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	130.6	178.5	-66	-92.8	0	0	0	109.2	V84 V98 K106 F110 I205 V206 E208 A209 L236	V84-F238 HydrophobicContact CG1-CE1 4.19Å; V84-F238 HydrophobicContact CG1-CZ 4.04Å; V84-F238 HydrophobicContact CG2-CE1 4.25Å; V98-F238 HydrophobicContact CB-CD1 3.6Å; V98-F238 HydrophobicContact CB-CE1 3.76Å; V98-F238 HydrophobicContact CB-CG 4.35Å; V98-F238 HydrophobicContact CG1-CD1 3.84Å; V98-F238 HydrophobicContact CG1-CE1 3.93Å; V98-F238 HydrophobicContact CG2-CD1 4.02Å; V98-F238 HydrophobicContact CG2-CE1 3.65Å; V98-F238 HydrophobicContact CG2-CZ 4.13Å; V98-F238 WeakPolarHBondContact O-CA 3.23Å; K106-F238 HydrophobicContact CB-CD1 4.12Å; K106-F238 HydrophobicContact CD-CB 4.41Å; K106-F238 HydrophobicContact CD-CD1 4.41Å; K106-F238 HydrophobicContact CG-CD1 4.25Å; F110-F238 HydrophobicContact CB-CD2 4.33Å; F110-F238 HydrophobicContact CB-CE1 4.35Å; F110-F238 HydrophobicContact CB-CE2 3.54Å; F110-F238 HydrophobicContact CB-CZ 3.57Å; F110-F238 HydrophobicContact CD1-CD1 4.42Å; F110-F238 AromaticContact CD1-CD2 3.87Å; F110-F238 HydrophobicContact CD1-CD2 3.87Å; F110-F238 HydrophobicContact CD1-CE1 4.47Å; F110-F238 AromaticContact CD1-CE2 3.93Å; F110-F238 HydrophobicContact CD1-CE2 3.93Å; F110-F238 HydrophobicContact CD1-CG 4.13Å; F110-F238 HydrophobicContact CD1-CZ 4.27Å; F110-F238 HydrophobicContact CG-CD2 4.45Å; F110-F238 HydrophobicContact CG-CE2 4.12Å; F110-F238 HydrophobicContact CG-CZ 4.42Å; I205-F238 HydrophobicContact CG2-CD2 4.01Å; I205-F238 HydrophobicContact CG2-CE2 4.1Å; V206-F238 PolarHBondContact O-N 2.78Å; E208-F238 PolarHBondContact N-O 3.12Å; E208-F238 VanDerWaalsContact N-O 3.11Å; A209-F238 WeakPolarHBondContact CB-O 3.4Å; A209-F238 PolarHBondContact N-O 3.28Å; L236-F238 HydrophobicContact CB-CD2 4.4Å; L236-F238 HydrophobicContact CB-CE2 3.59Å; L236-F238 HydrophobicContact CB-CZ 4.25Å; L236-F238 HydrophobicContact CD1-CE2 4.36Å; L236-F238 HydrophobicContact CD1-CZ 4.5Å
239	S	89.7	Confident	90.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.9	174.5	-175.4	0	0	0	0	111.1	V98 Q99 S100 K106 D210 T241	V98-S239 PolarHBondContact O-N 3.43Å; Q99-S239 WeakPolarHBondContact CA-O 3.5Å; S100-S239 PolarHBondContact N-O 3.42Å; S100-S239 VanDerWaalsContact N-O 3.1Å; K106-S239 PolarHBondContact NZ-O 3.09Å; D210-S239 VanDerWaalsContact CB-OG 3.26Å; D210-S239 WeakPolarHBondContact CB-OG 3.31Å; D210-S239 PolarHBondContact OD1-OG 3.49Å; S239-T241 VanDerWaalsContact C-N 3.35Å; S239-T241 WeakPolarHBondContact CB-O 3.49Å; S239-T241 PolarHBondContact OG-N 3.22Å; S239-T241 PolarHBondContact OG-O 3.18Å
240	A	82.2	Confident	90.1	Very high	2 Å²	2	42.3 Å²	42.3	2%	0.017	21%	0.209	C	C	.	.	S	Bend	trans	-79.8	-23.7	164.6	0	0	0	0	0	112.2	S100 H390	S100-A240 VanDerWaalsContact O-CA 3.27Å; S100-A240 WeakPolarHBondContact O-CA 3.42Å; A240-H390 VanDerWaalsContact CB-NE2 3.26Å; A240-H390 WeakPolarHBondContact CB-NE2 3.41Å
241	T	80.2	Confident	90	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.012	22%	0.221	C	C	.	.			trans	-141.9	140.7	-168.4	73.1	0	0	0	0	111.2	D210 S239 Y386 L389 H390	D210-T241 WeakPolarHBondContact CB-OG1 3.47Å; D210-T241 PolarHBondContact OD2-OG1 2.59Å; S239-T241 VanDerWaalsContact C-N 3.35Å; S239-T241 WeakPolarHBondContact CB-O 3.49Å; S239-T241 PolarHBondContact OG-N 3.22Å; S239-T241 PolarHBondContact OG-O 3.18Å; T241-Y386 HydrophobicContact CG2-CD1 3.19Å; T241-Y386 HydrophobicContact CG2-CE1 3.92Å; T241-Y386 HydrophobicContact CG2-CG 3.84Å; T241-L389 HydrophobicContact CG2-CD2 4.28Å; T241-H390 WeakPolarHBondContact CG2-NE2 3.39Å
242	L	83.5	Confident	90.1	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.021	21%	0.207	C	C	.	.			trans	-136.4	84.1	177.5	-72.1	178	0	0	0	108.6	I97 Q99 E247 I250	I97-L242 HydrophobicContact CG2-CD1 3.56Å; I97-L242 HydrophobicContact CG2-CD2 4.3Å; Q99-L242 HydrophobicContact CB-CD1 3.7Å; Q99-L242 HydrophobicContact CB-CG 4.1Å; Q99-L242 HydrophobicContact CG-CD1 4.39Å; Q99-L242 HydrophobicContact CG-CG 4.31Å; L242-E247 HydrophobicContact CB-CB 4.48Å; L242-I250 HydrophobicContact CD2-CD1 3.62Å
243	D	82.6	Confident	90.2	Very high	48 Å²	48	31.5 Å²	31.5	26%	0.257	18%	0.181	S	C	.	.			trans	-67.7	163.5	165.9	75.9	-6.7	0	0	0	110.6	S245 S246 E247 Y386	D243-S245 PolarHBondContact O-N 2.59Å; D243-S246 PolarHBondContact O-N 2.81Å; D243-S246 VanDerWaalsContact O-N 3.14Å; D243-S246 WeakPolarHBondContact OD1-CA 3.29Å; D243-S246 WeakPolarHBondContact OD1-CB 3.4Å; D243-S246 PolarHBondContact OD1-N 3.49Å; D243-S246 PolarHBondContact OD1-OG 3.35Å; D243-E247 WeakPolarHBondContact O-CB 3Å; D243-E247 PolarHBondContact O-N 2.9Å; D243-Y386 WeakPolarHBondContact CA-OH 3.41Å; D243-Y386 HydrophobicContact CB-CE2 3.59Å; D243-Y386 VanDerWaalsContact CB-OH 3.25Å; D243-Y386 WeakPolarHBondContact CB-OH 3.39Å
244	E	85.5	Confident	90.1	Very high	166 Å²	166	32.3 Å²	32.3	78%	0.776	19%	0.186	S	C	*	.	H	α-helix	trans	-57.3	-37.4	-175.5	-172.5	179.7	-176.8	0	0	112.3	T248	E244-T248 VanDerWaalsContact O-CB 3.23Å; E244-T248 WeakPolarHBondContact O-CB 3.4Å; E244-T248 PolarHBondContact O-N 3.05Å; E244-T248 PolarHBondContact O-OG1 2.88Å
245	S	85.2	Confident	89.9	Confident	66 Å²	66	37.9 Å²	37.9	46%	0.462	22%	0.216	S	C	.	.	H	α-helix	trans	-67.1	-44.6	178.1	170.9	0	0	0	0	112.2	D243 F249	D243-S245 PolarHBondContact O-N 2.59Å; S245-F249 WeakPolarHBondContact O-CB 3.48Å; S245-F249 PolarHBondContact O-N 3.07Å
246	S	87.2	Confident	89.5	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-70.1	-44.4	178.8	-57.6	0	0	0	0	111.1	D243 T248 F249 I250	D243-S246 PolarHBondContact O-N 2.81Å; D243-S246 VanDerWaalsContact O-N 3.14Å; D243-S246 WeakPolarHBondContact OD1-CA 3.29Å; D243-S246 WeakPolarHBondContact OD1-CB 3.4Å; D243-S246 PolarHBondContact OD1-N 3.49Å; D243-S246 PolarHBondContact OD1-OG 3.35Å; S246-T248 PolarHBondContact O-N 3.2Å; S246-F249 PolarHBondContact O-N 3.12Å; S246-I250 VanDerWaalsContact O-CB 3.3Å; S246-I250 WeakPolarHBondContact O-CB 3.44Å; S246-I250 WeakPolarHBondContact O-CD1 3.41Å; S246-I250 WeakPolarHBondContact O-CG1 3.43Å; S246-I250 PolarHBondContact O-N 3.32Å
247	E	89.3	Confident	89.3	Confident	49 Å²	49	45.1 Å²	45.1	23%	0.229	24%	0.244	C	C	.	.	H	α-helix	trans	-59.1	-48.2	175.3	-172.2	171.7	166.3	0	0	110.7	L242 D243 F249 I250 H251 R261	L242-E247 HydrophobicContact CB-CB 4.48Å; D243-E247 WeakPolarHBondContact O-CB 3Å; D243-E247 PolarHBondContact O-N 2.9Å; E247-F249 VanDerWaalsContact C-N 3.34Å; E247-F249 PolarHBondContact O-N 3.35Å; E247-I250 PolarHBondContact O-N 3.31Å; E247-H251 WeakPolarHBondContact O-CB 3.35Å; E247-H251 PolarHBondContact O-N 3.14Å; E247-R261 IonicContact OE2-NH1 2.72Å; E247-R261 PolarHBondContact OE2-NH1 3.3Å
248	T	91.1	Very high	89	Confident	95 Å²	95	45.2 Å²	45.2	58%	0.583	25%	0.245	S	C	*	.	H	α-helix	trans	-58.9	-44.7	177.6	-62.1	0	0	0	0	111.8	E244 S246 G252	E244-T248 VanDerWaalsContact O-CB 3.23Å; E244-T248 WeakPolarHBondContact O-CB 3.4Å; E244-T248 PolarHBondContact O-N 3.05Å; E244-T248 PolarHBondContact O-OG1 2.88Å; S246-T248 PolarHBondContact O-N 3.2Å; T248-G252 PolarHBondContact O-N 2.9Å; T248-G252 VanDerWaalsContact O-N 3.13Å
249	F	92	Very high	88.8	Confident	25 Å²	25	46.2 Å²	46.2	11%	0.11	25%	0.25	C	C	.	.	H	α-helix	trans	-66.9	-49.4	179.7	176	-101.2	0	0	0	112.2	V213 R219 N223 S245 S246 E247 G252 L253	V213-F249 HydrophobicContact CB-CD1 4.25Å; V213-F249 HydrophobicContact CG1-CB 4.01Å; V213-F249 HydrophobicContact CG1-CD1 4.05Å; V213-F249 HydrophobicContact CG1-CG 4.12Å; V213-F249 HydrophobicContact CG2-CB 4.37Å; V213-F249 HydrophobicContact CG2-CD1 3.45Å; V213-F249 VanDerWaalsContact CG2-CD1 3.45Å; V213-F249 HydrophobicContact CG2-CE1 4.13Å; V213-F249 HydrophobicContact CG2-CG 4.26Å; R219-F249 HydrophobicContact CB-CZ 4.47Å; R219-F249 HydrophobicContact CG-CD1 4.37Å; R219-F249 HydrophobicContact CG-CD2 4.14Å; R219-F249 HydrophobicContact CG-CE1 3.8Å; R219-F249 HydrophobicContact CG-CE2 3.55Å; R219-F249 HydrophobicContact CG-CZ 3.34Å; R219-F249 VanDerWaalsContact NE-CE2 3.32Å; N223-F249 HydrophobicContact CB-CZ 4.46Å; S245-F249 WeakPolarHBondContact O-CB 3.48Å; S245-F249 PolarHBondContact O-N 3.07Å; S246-F249 PolarHBondContact O-N 3.12Å; E247-F249 VanDerWaalsContact C-N 3.34Å; E247-F249 PolarHBondContact O-N 3.35Å; F249-G252 PolarHBondContact O-N 3.44Å; F249-L253 HydrophobicContact CD1-CD1 4.29Å; F249-L253 HydrophobicContact CE1-CD1 3.66Å; F249-L253 HydrophobicContact CE1-CG 4.47Å; F249-L253 HydrophobicContact CZ-CD1 3.9Å; F249-L253 HydrophobicContact CZ-CG 4.45Å; F249-L253 PolarHBondContact O-N 3.45Å
250	I	93.6	Very high	88.7	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-62.7	-45.7	-179.2	-68.2	167.8	0	0	0	109.9	I97 A209 V213 F237 L242 S246 E247 G252 L253 C254	I97-I250 HydrophobicContact CD1-CB 4.46Å; I97-I250 HydrophobicContact CD1-CG2 3.61Å; I97-I250 HydrophobicContact CG1-CG2 3.72Å; I97-I250 HydrophobicContact CG2-CG2 4.24Å; A209-I250 HydrophobicContact CB-CD1 3.69Å; A209-I250 HydrophobicContact CB-CG1 4.4Å; V213-I250 HydrophobicContact CG2-CD1 4.29Å; V213-I250 HydrophobicContact CG2-CG1 4.09Å; F237-I250 HydrophobicContact CB-CG2 3.61Å; F237-I250 HydrophobicContact CD1-CG1 4.38Å; F237-I250 HydrophobicContact CD1-CG2 3.81Å; F237-I250 HydrophobicContact CD2-CG2 3.87Å; F237-I250 HydrophobicContact CE1-CG2 4.42Å; F237-I250 HydrophobicContact CE2-CG2 4.47Å; F237-I250 HydrophobicContact CG-CG2 3.49Å; F237-I250 VanDerWaalsContact CG-CG2 3.49Å; L242-I250 HydrophobicContact CD2-CD1 3.62Å; S246-I250 VanDerWaalsContact O-CB 3.3Å; S246-I250 WeakPolarHBondContact O-CB 3.44Å; S246-I250 WeakPolarHBondContact O-CD1 3.41Å; S246-I250 WeakPolarHBondContact O-CG1 3.43Å; S246-I250 PolarHBondContact O-N 3.32Å; E247-I250 PolarHBondContact O-N 3.31Å; I250-G252 PolarHBondContact O-N 3.35Å; I250-L253 WeakPolarHBondContact O-CB 3.41Å; I250-L253 PolarHBondContact O-N 3.1Å; I250-C254 PolarHBondContact O-N 3.25Å
251	H	93.1	Very high	88.7	Confident	90 Å²	90	49 Å²	49	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-58.8	-36.9	176.9	-171.8	-78.6	0	0	0	111.8	I97 E247 L253 C254	I97-H251 HydrophobicContact CD1-CB 4.33Å; E247-H251 WeakPolarHBondContact O-CB 3.35Å; E247-H251 PolarHBondContact O-N 3.14Å; H251-L253 PolarHBondContact O-N 2.96Å; H251-C254 PolarHBondContact O-N 3.14Å
252	G	93.4	Very high	88.3	Confident	65 Å²	65	49 Å²	49	67%	0.67	26%	0.26	S	S	*	.	H	α-helix	trans	-66	-16.6	175	0	0	0	0	0	115.3	T248 F249 I250	T248-G252 PolarHBondContact O-N 2.9Å; T248-G252 VanDerWaalsContact O-N 3.13Å; F249-G252 PolarHBondContact O-N 3.44Å; I250-G252 PolarHBondContact O-N 3.35Å
253	L	93.9	Very high	87.5	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-91	-17.6	174.9	-60.3	177.2	0	0	0	112.9	T222 N223 V226 K235 F237 F249 I250 H251	T222-L253 HydrophobicContact CG2-CD1 4.32Å; N223-L253 HydrophobicContact CB-CD2 4.46Å; V226-L253 HydrophobicContact CB-CD2 4.41Å; V226-L253 HydrophobicContact CG1-CB 4.47Å; V226-L253 HydrophobicContact CG1-CD2 4.29Å; V226-L253 HydrophobicContact CG2-CD1 4.46Å; K235-L253 WeakPolarHBondContact CD-O 3.48Å; K235-L253 WeakPolarHBondContact CE-O 3.47Å; F237-L253 HydrophobicContact CE1-CD1 3.86Å; F237-L253 HydrophobicContact CE2-CB 4.27Å; F237-L253 HydrophobicContact CZ-CB 3.76Å; F237-L253 HydrophobicContact CZ-CD1 3.77Å; F237-L253 HydrophobicContact CZ-CG 4.43Å; F249-L253 HydrophobicContact CD1-CD1 4.29Å; F249-L253 HydrophobicContact CE1-CD1 3.66Å; F249-L253 HydrophobicContact CE1-CG 4.47Å; F249-L253 HydrophobicContact CZ-CD1 3.9Å; F249-L253 HydrophobicContact CZ-CG 4.45Å; F249-L253 PolarHBondContact O-N 3.45Å; I250-L253 WeakPolarHBondContact O-CB 3.41Å; I250-L253 PolarHBondContact O-N 3.1Å; H251-L253 PolarHBondContact O-N 2.96Å
254	C	93	Very high	86.5	Confident	18 Å²	18	55.6 Å²	55.6	12%	0.122	28%	0.283	C	S	.	.	S	Bend	trans	-96.3	158.6	-176.7	-65.3	0	0	0	0	112.4	D95 F237 I250 H251 P257	D95-C254 HydrophobicContact CB-CB 3.99Å; D95-C254 WeakPolarHBondContact OD2-CA 3.23Å; F237-C254 WeakPolarHBondContact CD2-SG 3.5Å; F237-C254 WeakPolarHBondContact CE2-SG 3.22Å; I250-C254 PolarHBondContact O-N 3.25Å; H251-C254 PolarHBondContact O-N 3.14Å; C254-P257 HydrophobicContact CB-CB 3.83Å; C254-P257 HydrophobicContact CB-CG 3.67Å
255	N	89.9	Confident	85.2	Confident	118 Å²	118	53.5 Å²	53.5	63%	0.631	27%	0.274	S	S	*	.	S	Bend	trans	-106	100.2	167.4	-179.4	33.4	0	0	0	110.1	D95	D95-N255 PolarHBondContact OD2-N 2.97Å
256	R	88.5	Confident	83.9	Confident	165 Å²	165	52.5 Å²	52.5	62%	0.623	26%	0.262	S	S	*	.	S	Bend	trans	47.1	62.3	179.3	-58.9	-173.2	-176.7	-170.9	-0.1	113.2	E44	E44-R256 IonicContact OE1-CZ 3.59Å; E44-R256 IonicContact OE1-NE 3.87Å; E44-R256 IonicContact OE1-NH1 3.15Å; E44-R256 PolarHBondContact OE1-NH1 2.59Å; E44-R256 VanDerWaalsContact OE1-NH1 3.15Å; E44-R256 WeakPolarHBondContact OE2-CD 3.47Å; E44-R256 IonicContact OE2-CZ 3.69Å; E44-R256 IonicContact OE2-NE 3.93Å; E44-R256 IonicContact OE2-NH1 2.77Å; E44-R256 PolarHBondContact OE2-NH1 3.2Å
257	P	91.6	Very high	82.4	Confident	7 Å²	7	52.6 Å²	52.6	5%	0.045	26%	0.262	C	S	.	.			trans	-68.8	151.5	-173.2	29.7	-34.7	0	0	0	112.5	D95 I97 C254 I259	D95-P257 HydrophobicContact CB-CB 4.12Å; D95-P257 CarbonylContact O-C 3.51Å; D95-P257 WeakPolarHBondContact O-CA 3.47Å; I97-P257 HydrophobicContact CD1-CB 4.13Å; I97-P257 HydrophobicContact CD1-CG 3.68Å; I97-P257 HydrophobicContact CG1-CB 3.96Å; I97-P257 HydrophobicContact CG1-CG 4.1Å; C254-P257 HydrophobicContact CB-CB 3.83Å; C254-P257 HydrophobicContact CB-CG 3.67Å; P257-I259 HydrophobicContact CG-CG1 4.49Å
258	I	90.1	Very high	80.8	Confident	6 Å²	6	50.5 Å²	50.5	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127.4	160.3	-58.4	166.6	0	0	0	107.4	V41 K94 D95 M96 I97 F260	V41-I258 HydrophobicContact CG1-CG2 3.68Å; K94-I258 HydrophobicContact CB-CD1 4.19Å; K94-I258 HydrophobicContact CD-CD1 4.18Å; K94-I258 HydrophobicContact CD-CG1 4.37Å; D95-I258 PolarHBondContact O-N 2.8Å; M96-I258 CarbonylContact C-O 3.58Å; M96-I258 VanDerWaalsContact CA-O 3.26Å; M96-I258 WeakPolarHBondContact CA-O 3.44Å; M96-I258 HydrophobicContact CE-CD1 4.49Å; M96-I258 HydrophobicContact CG-CB 4.44Å; I97-I258 PolarHBondContact N-O 3.08Å; I258-F260 HydrophobicContact CB-CE2 4.3Å; I258-F260 HydrophobicContact CG2-CD2 4.17Å; I258-F260 HydrophobicContact CG2-CE1 4.32Å; I258-F260 HydrophobicContact CG2-CE2 3.61Å; I258-F260 HydrophobicContact CG2-CZ 3.69Å
259	I	89.1	Confident	79.6	Confident	21 Å²	21	46.8 Å²	46.8	11%	0.108	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	117.9	-179.7	-52.6	178.2	0	0	0	108.8	V41 R42 I97 P257	V41-I259 WeakPolarHBondContact CA-O 3.23Å; R42-I259 HydrophobicContact CB-CB 4.37Å; R42-I259 PolarHBondContact N-O 3.01Å; R42-I259 PolarHBondContact O-N 3.46Å; I97-I259 HydrophobicContact CB-CG1 4.31Å; I97-I259 HydrophobicContact CB-CG2 4.48Å; I97-I259 HydrophobicContact CD1-CG1 4.45Å; I97-I259 CarbonylContact O-C 3.54Å; I97-I259 WeakPolarHBondContact O-CA 3.24Å; P257-I259 HydrophobicContact CG-CG1 4.49Å
260	F	87.1	Confident	78.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	116.3	171.2	-67.9	-73.9	0	0	0	108.6	L39 V41 Y50 I80 A83 A87 M96 I97 V98 Q99 I258	L39-F260 HydrophobicContact CD1-CB 4.15Å; L39-F260 HydrophobicContact CD1-CD1 4.48Å; L39-F260 HydrophobicContact CD2-CD1 3.68Å; L39-F260 HydrophobicContact CD2-CE1 4.3Å; L39-F260 HydrophobicContact CG-CD1 4.15Å; V41-F260 HydrophobicContact CB-CD1 4.46Å; V41-F260 HydrophobicContact CB-CE1 4.39Å; V41-F260 HydrophobicContact CG1-CD1 4.11Å; V41-F260 HydrophobicContact CG1-CE1 3.78Å; V41-F260 HydrophobicContact CG1-CZ 4.35Å; V41-F260 HydrophobicContact CG2-CD1 3.7Å; V41-F260 HydrophobicContact CG2-CE1 3.69Å; Y50-F260 HydrophobicContact CD1-CE1 4.49Å; Y50-F260 HydrophobicContact CD1-CZ 4.36Å; Y50-F260 HydrophobicContact CD2-CE1 4.03Å; Y50-F260 HydrophobicContact CD2-CZ 4.41Å; Y50-F260 HydrophobicContact CE1-CZ 4.3Å; Y50-F260 HydrophobicContact CE2-CE1 4.3Å; Y50-F260 HydrophobicContact CE2-CZ 4.32Å; Y50-F260 HydrophobicContact CG-CE1 4.11Å; Y50-F260 HydrophobicContact CG-CZ 4.41Å; I80-F260 HydrophobicContact CD1-CB 4.29Å; A83-F260 HydrophobicContact CB-CD1 4.14Å; A83-F260 HydrophobicContact CB-CE1 3.95Å; A87-F260 HydrophobicContact CB-CE2 4.02Å; A87-F260 HydrophobicContact CB-CZ 3.69Å; M96-F260 HydrophobicContact CG-CE2 4.46Å; M96-F260 HydrophobicContact SD-CE2 3.97Å; I97-F260 PolarHBondContact O-N 3.26Å; V98-F260 HydrophobicContact CG1-CB 4.35Å; V98-F260 HydrophobicContact CG2-CB 4.47Å; V98-F260 HydrophobicContact CG2-CD2 4.1Å; Q99-F260 PolarHBondContact N-O 3.43Å; I258-F260 HydrophobicContact CB-CE2 4.3Å; I258-F260 HydrophobicContact CG2-CD2 4.17Å; I258-F260 HydrophobicContact CG2-CE1 4.32Å; I258-F260 HydrophobicContact CG2-CE2 3.61Å; I258-F260 HydrophobicContact CG2-CZ 3.69Å
261	R	82.2	Confident	77.5	Confident	60 Å²	60	55.6 Å²	55.6	23%	0.226	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	119.1	-179.1	173.3	161.8	-169.1	153.4	4.9	110.9	S40 E247 E264	S40-R261 PolarHBondContact N-O 3.43Å; S40-R261 PolarHBondContact O-N 3.36Å; S40-R261 WeakPolarHBondContact OG-CB 3.3Å; S40-R261 PolarHBondContact OG-O 3.02Å; E247-R261 IonicContact OE2-NH1 2.72Å; E247-R261 PolarHBondContact OE2-NH1 3.3Å; R261-E264 IonicContact NH2-OE1 2.75Å; R261-E264 PolarHBondContact NH2-OE1 3.21Å
262	L	72.3	Confident	76.9	Confident	4 Å²	4	51.8 Å²	51.8	2%	0.021	26%	0.26	C	S	.	.			trans	-69.9	147.1	161.4	-67.4	-179.5	0	0	0	109.4	L39 L79 Q99 T104 L267	L39-L262 HydrophobicContact CD1-CD2 3.95Å; L39-L262 HydrophobicContact CD1-CG 4.39Å; L79-L262 HydrophobicContact CD2-CD2 4.13Å; Q99-L262 PolarHBondContact O-N 2.81Å; T104-L262 HydrophobicContact CG2-CD1 4.45Å; L262-L267 HydrophobicContact CB-CD2 4.18Å
263	R	65.8	Low	76.7	Confident	124 Å²	124	52.4 Å²	52.4	47%	0.468	25%	0.245	S	C	.	.			trans	-64.5	151	175.2	-64	-175.5	175.8	-176.4	-0	110.3	I38 E265 E266 L267	I38-R263 VanDerWaalsContact CD1-CZ 3.49Å; R263-E265 WeakPolarHBondContact CB-OE2 3.47Å; R263-E265 PolarHBondContact O-N 3.12Å; R263-E266 HydrophobicContact CB-CB 4.46Å; R263-E266 HydrophobicContact CB-CG 4.16Å; R263-E266 CarbonylContact O-C 3.53Å; R263-E266 WeakPolarHBondContact O-CA 3.31Å; R263-E266 WeakPolarHBondContact O-CB 3.43Å; R263-E266 PolarHBondContact O-N 3.11Å; R263-L267 PolarHBondContact O-N 3.3Å; R263-L267 VanDerWaalsContact O-N 3.14Å
264	E	62.2	Low	76.6	Confident	65 Å²	65	52.2 Å²	52.2	30%	0.304	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-61.9	-34.8	-177.3	-77	171.9	-164.4	0	0	112	R261 E266 L267 H423	R261-E264 IonicContact NH2-OE1 2.75Å; R261-E264 PolarHBondContact NH2-OE1 3.21Å; E264-E266 PolarHBondContact O-N 3.32Å; E264-L267 HydrophobicContact CB-CD1 4.47Å; E264-L267 HydrophobicContact CG-CD1 4.14Å; E264-L267 WeakPolarHBondContact O-CB 3.31Å; E264-L267 PolarHBondContact O-N 2.95Å; E264-L267 VanDerWaalsContact O-N 3.12Å; E264-H423 IonicContact OE2-CE1 3.26Å
265	E	57.7	Low	76.7	Confident	122 Å²	122	51.7 Å²	51.7	57%	0.57	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-63	-33.2	174.3	-55.3	86.4	172	0	0	111.6	R263 L267 S268	R263-E265 WeakPolarHBondContact CB-OE2 3.47Å; R263-E265 PolarHBondContact O-N 3.12Å; E265-L267 VanDerWaalsContact C-N 3.35Å; E265-S268 PolarHBondContact O-N 3.5Å; E265-S268 PolarHBondContact O-OG 3.23Å
266	E	59	Low	77	Confident	45 Å²	45	47.4 Å²	47.4	21%	0.21	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-82.4	-11.2	177.7	-63.2	174.1	-175.9	0	0	113.2	G37 I38 Q101 R263 E264	G37-E266 WeakPolarHBondContact CA-OE2 3.32Å; I38-E266 PolarHBondContact N-OE1 3.46Å; I38-E266 PolarHBondContact N-OE2 3.44Å; Q101-E266 PolarHBondContact OE1-O 2.85Å; R263-E266 HydrophobicContact CB-CB 4.46Å; R263-E266 HydrophobicContact CB-CG 4.16Å; R263-E266 CarbonylContact O-C 3.53Å; R263-E266 WeakPolarHBondContact O-CA 3.31Å; R263-E266 WeakPolarHBondContact O-CB 3.43Å; R263-E266 PolarHBondContact O-N 3.11Å; E264-E266 PolarHBondContact O-N 3.32Å
267	L	56.1	Low	77.4	Confident	5 Å²	5	39.6 Å²	39.6	3%	0.026	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-74.2	-20.1	170.9	-61	172.4	0	0	0	111.9	Q99 Q101 L262 R263 E264 E265 L389	Q99-L267 VanDerWaalsContact NE2-CD1 3.31Å; Q101-L267 HydrophobicContact CB-CD2 4.31Å; Q101-L267 PolarHBondContact OE1-O 3.27Å; L262-L267 HydrophobicContact CB-CD2 4.18Å; R263-L267 PolarHBondContact O-N 3.3Å; R263-L267 VanDerWaalsContact O-N 3.14Å; E264-L267 HydrophobicContact CB-CD1 4.47Å; E264-L267 HydrophobicContact CG-CD1 4.14Å; E264-L267 WeakPolarHBondContact O-CB 3.31Å; E264-L267 PolarHBondContact O-N 2.95Å; E264-L267 VanDerWaalsContact O-N 3.12Å; E265-L267 VanDerWaalsContact C-N 3.35Å; L267-L389 HydrophobicContact CB-CD2 4.01Å; L267-L389 HydrophobicContact CD1-CD2 4.45Å; L267-L389 WeakPolarHBondContact O-CD1 3.48Å
268	S	56	Low	77.6	Confident	6 Å²	6	44.8 Å²	44.8	4%	0.042	21%	0.208	C	C	.	.	S	Bend	trans	-84.3	129.8	-174.5	74.5	0	0	0	0	109.8	E265 D270 K426	E265-S268 PolarHBondContact O-N 3.5Å; E265-S268 PolarHBondContact O-OG 3.23Å; S268-D270 PolarHBondContact O-N 3.12Å; S268-D270 VanDerWaalsContact O-N 3.14Å; S268-K426 PolarHBondContact O-NZ 3.03Å; S268-K426 WeakPolarHBondContact OG-CD 3Å; S268-K426 WeakPolarHBondContact OG-CE 3.33Å; S268-K426 PolarHBondContact OG-NZ 2.93Å
269	L	65.2	Low	77.9	Confident	17 Å²	17	44.6 Å²	44.6	9%	0.089	21%	0.208	C	C	.	.			trans	-71.9	109.8	-175.9	-65	175.7	0	0	0	110.7	N271 V272 G393 S395 K426	L269-N271 PolarHBondContact O-N 3.38Å; L269-V272 HydrophobicContact CB-CB 3.98Å; L269-V272 HydrophobicContact CB-CG2 3.62Å; L269-V272 HydrophobicContact CD1-CG2 3.53Å; L269-V272 HydrophobicContact CG-CG2 4.26Å; L269-V272 PolarHBondContact O-N 3.28Å; L269-G393 VanDerWaalsContact CD1-CA 3.49Å; L269-S395 WeakPolarHBondContact CD1-O 3.42Å; L269-K426 PolarHBondContact O-NZ 3.05Å
270	D	67.1	Low	78.1	Confident	139 Å²	139	49.2 Å²	49.2	74%	0.743	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-28.6	175.2	-75.2	-28.9	0	0	0	112.2	S268 V272 K426	S268-D270 PolarHBondContact O-N 3.12Å; S268-D270 VanDerWaalsContact O-N 3.14Å; D270-V272 VanDerWaalsContact C-N 3.29Å; D270-V272 PolarHBondContact O-N 2.91Å; D270-K426 VanDerWaalsContact N-NZ 3.15Å; D270-K426 VanDerWaalsContact OD1-CE 3.24Å; D270-K426 WeakPolarHBondContact OD1-CE 3.41Å; D270-K426 IonicContact OD1-NZ 3.43Å; D270-K426 PolarHBondContact OD1-NZ 3.27Å
271	N	74.4	Confident	78.4	Confident	73 Å²	73	52.3 Å²	52.3	39%	0.39	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	9.2	-178.6	-56.8	-28.6	0	0	0	113.5	L269 M400 S401 G402	L269-N271 PolarHBondContact O-N 3.38Å; N271-M400 WeakPolarHBondContact CB-O 3.14Å; N271-S401 CarbonylContact O-C 3.56Å; N271-S401 WeakPolarHBondContact O-CA 3.48Å; N271-G402 PolarHBondContact O-N 2.92Å
272	V	81	Confident	78.9	Confident	9 Å²	9	52.1 Å²	52.1	6%	0.055	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	111.5	177.5	-179.5	0	0	0	0	110.7	L269 D270 Q274 I392 G402 A404	L269-V272 HydrophobicContact CB-CB 3.98Å; L269-V272 HydrophobicContact CB-CG2 3.62Å; L269-V272 HydrophobicContact CD1-CG2 3.53Å; L269-V272 HydrophobicContact CG-CG2 4.26Å; L269-V272 PolarHBondContact O-N 3.28Å; D270-V272 VanDerWaalsContact C-N 3.29Å; D270-V272 PolarHBondContact O-N 2.91Å; V272-Q274 HydrophobicContact CG1-CG 4.23Å; V272-Q274 PolarHBondContact O-N 3.04Å; V272-I392 HydrophobicContact CG1-CB 4.46Å; V272-G402 CarbonylContact C-O 3.58Å; V272-G402 VanDerWaalsContact CA-O 3.31Å; V272-G402 WeakPolarHBondContact CA-O 3.46Å; V272-A404 HydrophobicContact CG1-CB 3.72Å
273	F	88	Confident	79.9	Confident	79 Å²	79	57 Å²	57	35%	0.346	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.7	171.1	-64.1	-86.9	0	0	0	109.7	F275 G402 V403 A404 V443	F273-F275 HydrophobicContact CB-CD2 4.48Å; F273-F275 HydrophobicContact CB-CE2 3.6Å; F273-F275 HydrophobicContact CB-CZ 3.99Å; F273-G402 PolarHBondContact N-O 3.33Å; F273-V403 WeakPolarHBondContact O-CA 3.39Å; F273-A404 PolarHBondContact O-N 2.88Å; F273-V443 HydrophobicContact CB-CG2 4.38Å; F273-V443 HydrophobicContact CD2-CB 4.48Å; F273-V443 HydrophobicContact CD2-CG1 3.67Å; F273-V443 HydrophobicContact CE2-CG1 3.9Å; F273-V443 HydrophobicContact CG-CG1 4.32Å; F273-V443 HydrophobicContact CG-CG2 4.41Å
274	Q	92.5	Very high	81.3	Confident	13 Å²	13	53 Å²	53	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	123.8	-173.4	-65.9	174	66.3	0	0	110.7	V272 Y388 I392 A404 I428 N429	V272-Q274 HydrophobicContact CG1-CG 4.23Å; V272-Q274 PolarHBondContact O-N 3.04Å; Q274-Y388 PolarHBondContact OE1-OH 2.9Å; Q274-I392 HydrophobicContact CG-CD1 4.39Å; Q274-A404 HydrophobicContact CG-CB 4.22Å; Q274-I428 HydrophobicContact CB-CB 4.44Å; Q274-I428 HydrophobicContact CB-CG1 4.07Å; Q274-I428 HydrophobicContact CB-CG2 4.25Å; Q274-I428 WeakPolarHBondContact O-CA 3.32Å; Q274-N429 PolarHBondContact O-N 3.03Å
275	F	95	Very high	83	Confident	7 Å²	7	50 Å²	50	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	156.1	178.4	-52.6	-79.3	0	0	0	111.9	F273 V403 A404 L405 T406 N429 L431 I439 I442 V443	F273-F275 HydrophobicContact CB-CD2 4.48Å; F273-F275 HydrophobicContact CB-CE2 3.6Å; F273-F275 HydrophobicContact CB-CZ 3.99Å; F275-V403 HydrophobicContact CD2-CG1 4.01Å; F275-V403 HydrophobicContact CE2-CG1 4.18Å; F275-A404 PolarHBondContact N-O 2.98Å; F275-L405 HydrophobicContact CB-CD2 3.78Å; F275-L405 HydrophobicContact CD2-CD2 3.99Å; F275-L405 HydrophobicContact CG-CD2 4.31Å; F275-T406 PolarHBondContact O-N 3.32Å; F275-N429 CarbonylContact C-O 3.59Å; F275-N429 WeakPolarHBondContact CA-O 3.21Å; F275-N429 HydrophobicContact CD1-CB 3.84Å; F275-N429 HydrophobicContact CE1-CB 4.17Å; F275-L431 HydrophobicContact CB-CD1 3.67Å; F275-L431 HydrophobicContact CB-CG 3.85Å; F275-L431 HydrophobicContact CD1-CD1 3.61Å; F275-L431 HydrophobicContact CD1-CD2 3.68Å; F275-L431 HydrophobicContact CD1-CG 3.51Å; F275-L431 HydrophobicContact CD2-CD1 3.95Å; F275-L431 HydrophobicContact CE1-CD1 4.22Å; F275-L431 HydrophobicContact CE1-CD2 3.96Å; F275-L431 HydrophobicContact CE1-CG 4.25Å; F275-L431 HydrophobicContact CE2-CD1 4.5Å; F275-L431 HydrophobicContact CG-CD1 3.46Å; F275-L431 VanDerWaalsContact CG-CD1 3.46Å; F275-L431 HydrophobicContact CG-CD2 4.41Å; F275-L431 HydrophobicContact CG-CG 3.79Å; F275-I439 HydrophobicContact CD2-CD1 4.35Å; F275-I439 HydrophobicContact CE2-CD1 4.43Å; F275-I442 HydrophobicContact CE1-CG2 3.9Å; F275-I442 HydrophobicContact CZ-CG2 3.64Å; F275-V443 HydrophobicContact CE2-CG2 3.84Å; F275-V443 HydrophobicContact CZ-CG2 4.19Å
276	Y	96.9	Very high	84.8	Confident	29 Å²	29	46 Å²	46	11%	0.114	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	147.3	164.6	77.2	-88.4	0	0	0	111.7	Q278 T406 V408 V414 V417 I428 N429 C430 L431	Y276-Q278 HydrophobicContact CD2-CG 4.48Å; Y276-Q278 HydrophobicContact CE2-CG 4.18Å; Y276-T406 CarbonylContact C-O 3.58Å; Y276-T406 WeakPolarHBondContact CA-O 3.47Å; Y276-T406 WeakPolarHBondContact CB-O 3.37Å; Y276-V408 HydrophobicContact CD2-CG2 3.76Å; Y276-V408 HydrophobicContact CE2-CG2 4.36Å; Y276-V414 HydrophobicContact CE2-CG1 4.39Å; Y276-V414 HydrophobicContact CE2-CG2 4.27Å; Y276-V417 HydrophobicContact CD1-CG1 3.8Å; Y276-V417 HydrophobicContact CE1-CG1 4.45Å; Y276-V417 HydrophobicContact CG-CG1 4.05Å; Y276-I428 HydrophobicContact CD1-CG2 4.03Å; Y276-I428 WeakPolarHBondContact CD1-O 3.42Å; Y276-I428 WeakPolarHBondContact CE1-O 3.35Å; Y276-N429 PolarHBondContact N-O 3.27Å; Y276-C430 HydrophobicContact CD1-CB 4.32Å; Y276-C430 HydrophobicContact CE1-CB 3.6Å; Y276-C430 HydrophobicContact CE2-CB 3.92Å; Y276-C430 VanDerWaalsContact CE2-SG 3.54Å; Y276-C430 WeakPolarHBondContact O-CA 3.4Å; Y276-C430 WeakPolarHBondContact OH-CB 3.32Å; Y276-L431 PolarHBondContact O-N 3.23Å
277	V	96.6	Very high	86.4	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.006	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	128.2	179.1	-173.1	0	0	0	0	108	T406 F407 V408 L431 L436	V277-T406 PolarHBondContact N-O 3.01Å; V277-F407 HydrophobicContact CB-CD1 3.99Å; V277-F407 HydrophobicContact CB-CE1 4.26Å; V277-F407 HydrophobicContact CG2-CD1 4.43Å; V277-F407 HydrophobicContact CG2-CE1 4.31Å; V277-F407 WeakPolarHBondContact O-CA 3.32Å; V277-V408 PolarHBondContact O-N 3.41Å; V277-L431 HydrophobicContact CG2-CB 4.31Å; V277-L436 HydrophobicContact CG1-CD2 4.37Å; V277-L436 HydrophobicContact CG2-CD1 4.02Å; V277-L436 HydrophobicContact CG2-CD2 4.22Å
278	Q	96.4	Very high	88.3	Confident	115 Å²	115	45.5 Å²	45.5	54%	0.537	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	121.1	173.3	-61.5	-174.5	29.8	0	0	109.1	Y276 V408 V414	Y276-Q278 HydrophobicContact CD2-CG 4.48Å; Y276-Q278 HydrophobicContact CE2-CG 4.18Å; Q278-V408 CarbonylContact C-O 3.5Å; Q278-V408 WeakPolarHBondContact CA-O 3.24Å; Q278-V408 HydrophobicContact CB-CG2 4.42Å; Q278-V408 HydrophobicContact CG-CG2 3.85Å; Q278-V414 HydrophobicContact CG-CG2 4.37Å
279	C	95.8	Very high	90.1	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.02	24%	0.237	C	C	.	.			trans	-124.5	130.5	-179.6	-66.2	0	0	0	0	110.6	N281 D284 K285 V408 Q409	C279-N281 PolarHBondContact O-N 2.73Å; C279-D284 WeakPolarHBondContact CA-OD2 3.31Å; C279-D284 HydrophobicContact CB-CB 4.23Å; C279-K285 HydrophobicContact CB-CB 4.42Å; C279-K285 HydrophobicContact CB-CG 3.57Å; C279-V408 PolarHBondContact N-O 2.93Å; C279-Q409 VanDerWaalsContact O-CA 3.25Å; C279-Q409 WeakPolarHBondContact O-CA 3.34Å; C279-Q409 WeakPolarHBondContact O-CG 3.35Å
280	V	93.7	Very high	91.4	Very high	117 Å²	117	46.5 Å²	46.5	71%	0.709	24%	0.244	S	C	*	.	S	Bend	trans	-73.2	-26	-173.2	-64.1	0	0	0	0	114	D284	V280-D284 HydrophobicContact CG2-CB 3.92Å; V280-D284 PolarHBondContact N-OD2 3.4Å
281	N	93.4	Very high	92.5	Very high	66 Å²	66	41.1 Å²	41.1	35%	0.353	22%	0.216	S	C	.	.	S	Bend	trans	-160.4	-177.2	-179.3	58.7	24.5	0	0	0	110.6	C279 E283 D284 K285	C279-N281 PolarHBondContact O-N 2.73Å; N281-E283 VanDerWaalsContact C-N 3.32Å; N281-E283 PolarHBondContact O-N 2.72Å; N281-E283 WeakPolarHBondContact OD1-CB 3.17Å; N281-E283 PolarHBondContact OD1-N 3.03Å; N281-D284 PolarHBondContact O-N 3.12Å; N281-D284 WeakPolarHBondContact OD1-CB 3.48Å; N281-D284 PolarHBondContact OD1-N 3.05Å; N281-K285 WeakPolarHBondContact O-CG 3.47Å; N281-K285 PolarHBondContact O-N 3.23Å
282	D	92.6	Very high	93.3	Very high	55 Å²	55	37.7 Å²	37.7	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-70.9	-26	-178.1	-76.3	-1.4	0	0	0	112.9	K285 F286 Y373 Q409	D282-K285 IonicContact OD1-NZ 2.59Å; D282-F286 PolarHBondContact O-N 3.28Å; D282-Y373 WeakPolarHBondContact CA-OH 3.31Å; D282-Y373 WeakPolarHBondContact CB-OH 3.31Å; D282-Y373 PolarHBondContact O-OH 2.95Å; D282-Q409 PolarHBondContact OD1-NE2 3.07Å; D282-Q409 VanDerWaalsContact OD1-NE2 3.17Å
283	E	93.5	Very high	93.6	Very high	107 Å²	107	39.3 Å²	39.3	50%	0.5	20%	0.203	S	C	.	.	H	α-helix	trans	-65.4	-43.9	170.9	-69.9	61.3	-132.2	0	0	111.5	N281 F286 A287 K317	N281-E283 VanDerWaalsContact C-N 3.32Å; N281-E283 PolarHBondContact O-N 2.72Å; N281-E283 WeakPolarHBondContact OD1-CB 3.17Å; N281-E283 PolarHBondContact OD1-N 3.03Å; E283-F286 WeakPolarHBondContact O-CB 3.34Å; E283-F286 PolarHBondContact O-N 2.8Å; E283-A287 PolarHBondContact O-N 2.96Å; E283-K317 IonicContact OE1-NZ 3.62Å; E283-K317 PolarHBondContact OE1-NZ 3.01Å
284	D	95.1	Very high	93.6	Very high	40 Å²	40	41.6 Å²	41.6	21%	0.214	22%	0.219	C	C	.	.	H	α-helix	trans	-69.5	-37.6	177.9	-173.4	21.5	0	0	0	111.7	C279 V280 N281 F286 A287 A288 R433	C279-D284 WeakPolarHBondContact CA-OD2 3.31Å; C279-D284 HydrophobicContact CB-CB 4.23Å; V280-D284 HydrophobicContact CG2-CB 3.92Å; V280-D284 PolarHBondContact N-OD2 3.4Å; N281-D284 PolarHBondContact O-N 3.12Å; N281-D284 WeakPolarHBondContact OD1-CB 3.48Å; N281-D284 PolarHBondContact OD1-N 3.05Å; D284-F286 VanDerWaalsContact C-N 3.33Å; D284-F286 PolarHBondContact O-N 3.3Å; D284-A287 PolarHBondContact O-N 3.46Å; D284-A288 PolarHBondContact O-N 3.44Å; D284-R433 PolarHBondContact O-NH1 3.49Å; D284-R433 IonicContact OD1-CZ 3.84Å; D284-R433 IonicContact OD1-NH1 3.73Å; D284-R433 PolarHBondContact OD1-NH1 3.15Å
285	K	96	Very high	93.2	Very high	1 Å²	1	42 Å²	42	0%	0.004	22%	0.223	C	C	.	.	H	α-helix	trans	-58	-44.6	169.1	-71.6	-178.2	178.5	171.8	0	111.6	C279 N281 D282 A288 I289 Y373 D374 F407 Q409	C279-K285 HydrophobicContact CB-CB 4.42Å; C279-K285 HydrophobicContact CB-CG 3.57Å; N281-K285 WeakPolarHBondContact O-CG 3.47Å; N281-K285 PolarHBondContact O-N 3.23Å; D282-K285 IonicContact OD1-NZ 2.59Å; K285-A288 VanDerWaalsContact O-CB 3.22Å; K285-A288 WeakPolarHBondContact O-CB 3.2Å; K285-A288 PolarHBondContact O-N 3.07Å; K285-I289 WeakPolarHBondContact O-CG1 3.2Å; K285-I289 PolarHBondContact O-N 3.46Å; K285-Y373 HydrophobicContact CB-CD2 4.16Å; K285-Y373 HydrophobicContact CB-CE2 3.44Å; K285-Y373 VanDerWaalsContact CB-CE2 3.44Å; K285-Y373 HydrophobicContact CD-CD1 4.13Å; K285-Y373 HydrophobicContact CD-CD2 4.2Å; K285-Y373 HydrophobicContact CD-CE1 3.76Å; K285-Y373 HydrophobicContact CD-CE2 3.86Å; K285-Y373 HydrophobicContact CD-CG 4.33Å; K285-Y373 VanDerWaalsContact CE-O 3.23Å; K285-Y373 WeakPolarHBondContact CE-O 3.12Å; K285-Y373 HydrophobicContact CG-CE2 4.31Å; K285-Y373 PolarHBondContact NZ-O 3.29Å; K285-D374 IonicContact NZ-OD1 3.44Å; K285-D374 PolarHBondContact NZ-OD1 2.93Å; K285-D374 VanDerWaalsContact NZ-OD1 3.13Å; K285-F407 HydrophobicContact CB-CD2 3.69Å; K285-F407 HydrophobicContact CB-CE2 4.08Å; K285-F407 HydrophobicContact CB-CG 4.45Å; K285-F407 HydrophobicContact CD-CB 4.07Å; K285-F407 HydrophobicContact CD-CD2 4.03Å; K285-F407 HydrophobicContact CD-CG 4.49Å; K285-F407 HydrophobicContact CG-CB 3.92Å; K285-F407 HydrophobicContact CG-CD2 3.69Å; K285-F407 HydrophobicContact CG-CG 4.05Å; K285-F407 WeakPolarHBondContact O-CE2 3.45Å; K285-Q409 VanDerWaalsContact CE-NE2 3.35Å
286	F	95.4	Very high	92.7	Very high	40 Å²	40	42.4 Å²	42.4	18%	0.175	23%	0.225	C	C	.	.	H	α-helix	trans	-63.8	-44.8	176.6	175.3	-101.8	0	0	0	111.4	D282 E283 D284 A288 I289 V290 L314 K317 M318 A321	D282-F286 PolarHBondContact O-N 3.28Å; E283-F286 WeakPolarHBondContact O-CB 3.34Å; E283-F286 PolarHBondContact O-N 2.8Å; D284-F286 VanDerWaalsContact C-N 3.33Å; D284-F286 PolarHBondContact O-N 3.3Å; F286-A288 PolarHBondContact O-N 3.16Å; F286-I289 WeakPolarHBondContact O-CB 3.43Å; F286-I289 PolarHBondContact O-N 2.87Å; F286-I289 VanDerWaalsContact O-N 3.13Å; F286-V290 HydrophobicContact CD1-CG2 4.36Å; F286-V290 HydrophobicContact CE1-CG2 3.92Å; F286-V290 HydrophobicContact CE2-CG2 4.45Å; F286-V290 HydrophobicContact CZ-CG2 3.98Å; F286-V290 WeakPolarHBondContact O-CG2 3.25Å; F286-V290 PolarHBondContact O-N 3.33Å; F286-V290 VanDerWaalsContact O-N 3.09Å; F286-L314 HydrophobicContact CD2-CD1 3.93Å; F286-K317 HydrophobicContact CD2-CB 3.93Å; F286-K317 HydrophobicContact CE2-CB 3.73Å; F286-K317 HydrophobicContact CG-CB 4.49Å; F286-K317 HydrophobicContact CG-CD 4.39Å; F286-K317 HydrophobicContact CZ-CB 4.15Å; F286-M318 HydrophobicContact CD2-CG 4.45Å; F286-M318 HydrophobicContact CE2-CG 3.96Å; F286-A321 HydrophobicContact CZ-CB 3.96Å
287	A	94.4	Very high	91.9	Very high	38 Å²	38	48 Å²	48	31%	0.314	26%	0.256	S	S	.	.	H	α-helix	trans	-58.5	-33.8	173.3	0	0	0	0	0	111.9	E283 D284 V290 D291 R433	E283-A287 PolarHBondContact O-N 2.96Å; D284-A287 PolarHBondContact O-N 3.46Å; A287-V290 PolarHBondContact O-N 3.03Å; A287-D291 PolarHBondContact O-N 3.05Å; A287-R433 PolarHBondContact O-NH2 3.46Å
288	A	95.2	Very high	91.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-45	175.9	0	0	0	0	0	111.6	D284 K285 F286 V290 D291 V292 F407 R433 L436	D284-A288 PolarHBondContact O-N 3.44Å; K285-A288 VanDerWaalsContact O-CB 3.22Å; K285-A288 WeakPolarHBondContact O-CB 3.2Å; K285-A288 PolarHBondContact O-N 3.07Å; F286-A288 PolarHBondContact O-N 3.16Å; A288-V290 VanDerWaalsContact C-N 3.32Å; A288-V290 PolarHBondContact O-N 3.32Å; A288-D291 PolarHBondContact O-N 2.72Å; A288-V292 VanDerWaalsContact O-CG2 3.32Å; A288-V292 WeakPolarHBondContact O-CG2 3.38Å; A288-V292 PolarHBondContact O-N 3.2Å; A288-V292 VanDerWaalsContact O-N 3.17Å; A288-F407 HydrophobicContact CB-CE1 3.7Å; A288-F407 HydrophobicContact CB-CE2 4.26Å; A288-F407 HydrophobicContact CB-CZ 3.55Å; A288-R433 VanDerWaalsContact N-NH1 3.16Å; A288-R433 VanDerWaalsContact N-NH2 3.11Å; A288-L436 HydrophobicContact CB-CD2 3.82Å
289	I	93.8	Very high	90.4	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-44.8	177.4	-62.5	164.8	0	0	0	109.7	K285 F286 D291 V292 Y293 I303 L314 M318 V371 Y373 F407	K285-I289 WeakPolarHBondContact O-CG1 3.2Å; K285-I289 PolarHBondContact O-N 3.46Å; F286-I289 WeakPolarHBondContact O-CB 3.43Å; F286-I289 PolarHBondContact O-N 2.87Å; F286-I289 VanDerWaalsContact O-N 3.13Å; I289-D291 PolarHBondContact O-N 2.66Å; I289-V292 WeakPolarHBondContact O-CB 3.47Å; I289-V292 PolarHBondContact O-N 2.91Å; I289-Y293 HydrophobicContact CG2-CD2 3.78Å; I289-Y293 HydrophobicContact CG2-CE2 3.75Å; I289-Y293 WeakPolarHBondContact O-CD2 3.43Å; I289-Y293 PolarHBondContact O-N 2.97Å; I289-I303 HydrophobicContact CD1-CD1 4.21Å; I289-L314 HydrophobicContact CD1-CD1 4.05Å; I289-L314 HydrophobicContact CD1-CD2 4.49Å; I289-M318 HydrophobicContact CG2-CE 3.94Å; I289-V371 HydrophobicContact CG1-CG1 4.43Å; I289-Y373 HydrophobicContact CD1-CD2 3.92Å; I289-Y373 HydrophobicContact CD1-CE2 4.1Å; I289-F407 HydrophobicContact CD1-CE2 3.97Å; I289-F407 HydrophobicContact CG1-CE2 3.64Å; I289-F407 HydrophobicContact CG1-CZ 3.76Å
290	V	91.7	Very high	90	Very high	42 Å²	42	45.1 Å²	45.1	26%	0.255	25%	0.251	S	S	.	.	H	α-helix	trans	-61	-43.8	178	175.3	0	0	0	0	111.8	F286 A287 A288 V292 Y293 N294	F286-V290 HydrophobicContact CD1-CG2 4.36Å; F286-V290 HydrophobicContact CE1-CG2 3.92Å; F286-V290 HydrophobicContact CE2-CG2 4.45Å; F286-V290 HydrophobicContact CZ-CG2 3.98Å; F286-V290 WeakPolarHBondContact O-CG2 3.25Å; F286-V290 PolarHBondContact O-N 3.33Å; F286-V290 VanDerWaalsContact O-N 3.09Å; A287-V290 PolarHBondContact O-N 3.03Å; A288-V290 VanDerWaalsContact C-N 3.32Å; A288-V290 PolarHBondContact O-N 3.32Å; V290-V292 VanDerWaalsContact C-N 3.28Å; V290-V292 PolarHBondContact O-N 3.49Å; V290-Y293 PolarHBondContact O-N 2.61Å; V290-N294 VanDerWaalsContact O-CG 3.31Å; V290-N294 PolarHBondContact O-N 2.99Å; V290-N294 PolarHBondContact O-ND2 2.8Å
291	D	91.3	Very high	89.9	Confident	26 Å²	26	39.5 Å²	39.5	14%	0.139	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-40.8	176	-81.3	-5.2	0	0	0	111.9	A287 A288 I289 N294 S295 R433 L436 K437	A287-D291 PolarHBondContact O-N 3.05Å; A288-D291 PolarHBondContact O-N 2.72Å; I289-D291 PolarHBondContact O-N 2.66Å; D291-N294 PolarHBondContact O-N 3.23Å; D291-S295 WeakPolarHBondContact O-CB 3.49Å; D291-S295 PolarHBondContact O-N 3.01Å; D291-R433 VanDerWaalsContact CG-NH2 3.28Å; D291-R433 IonicContact OD2-CZ 3.83Å; D291-R433 IonicContact OD2-NE 3.98Å; D291-R433 PolarHBondContact OD2-NE 3.03Å; D291-R433 IonicContact OD2-NH2 2.73Å; D291-R433 PolarHBondContact OD2-NH2 3.13Å; D291-L436 HydrophobicContact CB-CD2 4.31Å; D291-K437 HydrophobicContact CB-CG 3.89Å; D291-K437 WeakPolarHBondContact OD1-CE 3.4Å; D291-K437 WeakPolarHBondContact OD2-CE 3.35Å
292	V	90.9	Very high	89.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-65.5	-44.9	177.4	176.6	0	0	0	0	111.5	A288 I289 V290 N294 S295 M296 V298 L369 L405 L436	A288-V292 VanDerWaalsContact O-CG2 3.32Å; A288-V292 WeakPolarHBondContact O-CG2 3.38Å; A288-V292 PolarHBondContact O-N 3.2Å; A288-V292 VanDerWaalsContact O-N 3.17Å; I289-V292 WeakPolarHBondContact O-CB 3.47Å; I289-V292 PolarHBondContact O-N 2.91Å; V290-V292 VanDerWaalsContact C-N 3.28Å; V290-V292 PolarHBondContact O-N 3.49Å; V292-N294 PolarHBondContact O-N 3.42Å; V292-S295 PolarHBondContact O-N 3.3Å; V292-S295 VanDerWaalsContact O-N 3.14Å; V292-M296 HydrophobicContact CG1-CG 4Å; V292-M296 HydrophobicContact CG1-SD 3.96Å; V292-M296 PolarHBondContact O-N 2.98Å; V292-V298 HydrophobicContact CG1-CG2 4.31Å; V292-L369 HydrophobicContact CG1-CD2 3.68Å; V292-L405 HydrophobicContact CB-CD1 4.41Å; V292-L405 HydrophobicContact CG1-CD1 4.24Å; V292-L405 HydrophobicContact CG2-CD1 3.39Å; V292-L436 HydrophobicContact CG2-CD1 3.5Å; V292-L436 HydrophobicContact CG2-CD2 4.12Å; V292-L436 HydrophobicContact CG2-CG 3.75Å
293	Y	88	Confident	90	Very high	43 Å²	43	33.8 Å²	33.8	17%	0.169	19%	0.187	C	C	.	.	H	α-helix	trans	-62.9	-26.2	176.4	-89.5	-79.8	0	0	0	113.3	I289 V290 V298 C301 M318 H323 V351	I289-Y293 HydrophobicContact CG2-CD2 3.78Å; I289-Y293 HydrophobicContact CG2-CE2 3.75Å; I289-Y293 WeakPolarHBondContact O-CD2 3.43Å; I289-Y293 PolarHBondContact O-N 2.97Å; V290-Y293 PolarHBondContact O-N 2.61Å; Y293-V298 HydrophobicContact CD1-CB 3.97Å; Y293-V298 HydrophobicContact CD1-CG2 4.04Å; Y293-V298 HydrophobicContact CE1-CB 3.63Å; Y293-V298 HydrophobicContact CE1-CG1 3.76Å; Y293-V298 HydrophobicContact CE1-CG2 4.08Å; Y293-V298 HydrophobicContact CG-CG2 4.41Å; Y293-C301 WeakPolarHBondContact OH-CB 3.37Å; Y293-M318 HydrophobicContact CE2-CE 4Å; Y293-H323 AromaticContact CD1-CE1 3.99Å; Y293-H323 AromaticContact CG-CE1 3.9Å; Y293-V351 WeakPolarHBondContact OH-CG2 3.43Å
294	N	87	Confident	90	Very high	128 Å²	128	28.7 Å²	28.7	68%	0.684	16%	0.163	S	C	*	.	H	α-helix	trans	-84.5	-23.1	176.1	-69.3	-27.7	0	0	0	113.2	V290 D291 V292	V290-N294 VanDerWaalsContact O-CG 3.31Å; V290-N294 PolarHBondContact O-N 2.99Å; V290-N294 PolarHBondContact O-ND2 2.8Å; D291-N294 PolarHBondContact O-N 3.23Å; V292-N294 PolarHBondContact O-N 3.42Å
295	S	85.5	Confident	90	Very high	20 Å²	20	26.8 Å²	26.8	14%	0.14	15%	0.153	C	C	.	.	H	α-helix	trans	-93.5	-42.2	-175.8	172.4	0	0	0	0	113.1	D291 V292 K437 I439 D440	D291-S295 WeakPolarHBondContact O-CB 3.49Å; D291-S295 PolarHBondContact O-N 3.01Å; V292-S295 PolarHBondContact O-N 3.3Å; V292-S295 VanDerWaalsContact O-N 3.14Å; S295-K437 VanDerWaalsContact CB-O 3.24Å; S295-K437 WeakPolarHBondContact CB-O 3.39Å; S295-K437 VanDerWaalsContact OG-C 3.25Å; S295-K437 PolarHBondContact OG-O 3.45Å; S295-I439 PolarHBondContact OG-N 3.02Å; S295-I439 VanDerWaalsContact OG-N 3.1Å; S295-D440 PolarHBondContact OG-OD1 3.32Å
296	M	83.5	Confident	89.7	Confident	16 Å²	16	31.5 Å²	31.5	8%	0.079	17%	0.17	C	C	.	.	S	Bend	trans	-124.9	156	-174.8	71.8	176.5	-59.3	0	0	113	V292 V298 V403 I439 D440	V292-M296 HydrophobicContact CG1-CG 4Å; V292-M296 HydrophobicContact CG1-SD 3.96Å; V292-M296 PolarHBondContact O-N 2.98Å; M296-V298 HydrophobicContact CG-CG2 3.87Å; M296-V298 PolarHBondContact O-N 3.37Å; M296-V403 HydrophobicContact CE-CG2 4.16Å; M296-V403 HydrophobicContact SD-CG2 4.48Å; M296-I439 HydrophobicContact CB-CG2 4.15Å; M296-I439 HydrophobicContact CG-CG2 4.06Å; M296-I439 HydrophobicContact SD-CG2 3.91Å; M296-D440 HydrophobicContact CB-CB 4.19Å
297	I	79.9	Confident	89.4	Confident	148 Å²	148	32.9 Å²	32.9	76%	0.759	18%	0.182	S	C	*	.			trans	-72.6	100.7	172.2	-60.9	174.5	0	0	0	109	N368	I297-N368 PolarHBondContact O-ND2 2.94Å
298	V	80.4	Confident	89.2	Confident	10 Å²	10	37.5 Å²	37.5	6%	0.061	19%	0.192	C	C	.	.			trans	-87.3	111.8	174.1	-175.5	0	0	0	0	109.3	V292 Y293 M296 C301 L369	V292-V298 HydrophobicContact CG1-CG2 4.31Å; Y293-V298 HydrophobicContact CD1-CB 3.97Å; Y293-V298 HydrophobicContact CD1-CG2 4.04Å; Y293-V298 HydrophobicContact CE1-CB 3.63Å; Y293-V298 HydrophobicContact CE1-CG1 3.76Å; Y293-V298 HydrophobicContact CE1-CG2 4.08Å; Y293-V298 HydrophobicContact CG-CG2 4.41Å; M296-V298 HydrophobicContact CG-CG2 3.87Å; M296-V298 PolarHBondContact O-N 3.37Å; V298-C301 HydrophobicContact CG1-CB 3.87Å; V298-L369 HydrophobicContact CG1-CB 4.17Å; V298-L369 HydrophobicContact CG1-CD2 4.09Å; V298-L369 HydrophobicContact CG2-CD2 4.04Å
299	G	81.8	Confident	89.1	Confident	34 Å²	34	46.4 Å²	46.4	35%	0.351	23%	0.225	S	C	.	.	S	Bend	trans	-72.3	-67.4	174.6	0	0	0	0	0	110.5	N368	G299-N368 PolarHBondContact N-ND2 3.31Å; G299-N368 PolarHBondContact N-OD1 2.74Å
300	Q	87.5	Confident	89	Confident	13 Å²	13	46.9 Å²	46.9	6%	0.061	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.5	175.4	-69	-177.6	-37.6	0	0	110.3	F344 R350 P365 L367 N368 L369	Q300-F344 HydrophobicContact CB-CE2 4.07Å; Q300-F344 HydrophobicContact CB-CZ 3.93Å; Q300-F344 HydrophobicContact CG-CE2 4.37Å; Q300-F344 PolarHBondContact NE2-O 2.68Å; Q300-R350 WeakPolarHBondContact CA-O 3.14Å; Q300-P365 PolarHBondContact OE1-O 3.13Å; Q300-L367 HydrophobicContact CB-CD1 4.28Å; Q300-L367 WeakPolarHBondContact O-CD1 3.5Å; Q300-N368 PolarHBondContact N-OD1 2.82Å; Q300-N368 PolarHBondContact O-N 3.34Å; Q300-N368 PolarHBondContact O-OD1 3.37Å; Q300-N368 VanDerWaalsContact O-OD1 3.13Å; Q300-L369 PolarHBondContact O-N 3.04Å
301	C	90.8	Very high	89.2	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.2	-177.2	-179.4	0	0	0	0	111.4	Y293 V298 F344 R350 V351 L352 L369	Y293-C301 WeakPolarHBondContact OH-CB 3.37Å; V298-C301 HydrophobicContact CG1-CB 3.87Å; C301-F344 WeakPolarHBondContact O-CZ 3.31Å; C301-R350 PolarHBondContact N-O 3.17Å; C301-V351 CarbonylContact O-C 3.48Å; C301-V351 WeakPolarHBondContact O-CA 3.41Å; C301-L352 PolarHBondContact O-N 3.45Å; C301-L369 WeakPolarHBondContact CA-O 3.4Å; C301-L369 HydrophobicContact CB-CB 4.3Å; C301-L369 HydrophobicContact CB-CD2 4.32Å
302	M	92.6	Very high	89.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	123.2	174.5	-166.2	170.6	-158.4	0	0	109.2	F304 L352 V354 I362 L367 L369 V371 R394	M302-F304 HydrophobicContact CB-CE2 4.46Å; M302-F304 HydrophobicContact CE-CE1 4.11Å; M302-F304 HydrophobicContact CE-CZ 4.06Å; M302-F304 HydrophobicContact CG-CE1 4.31Å; M302-F304 HydrophobicContact CG-CE2 4.01Å; M302-F304 HydrophobicContact CG-CZ 3.79Å; M302-F304 HydrophobicContact SD-CE1 4.14Å; M302-F304 HydrophobicContact SD-CE2 4.17Å; M302-F304 HydrophobicContact SD-CZ 3.5Å; M302-F304 WeakPolarHBondContact SD-CZ 3.17Å; M302-L352 CarbonylContact C-O 3.6Å; M302-L352 WeakPolarHBondContact CA-O 3.39Å; M302-L352 HydrophobicContact CE-CD2 3.64Å; M302-L352 HydrophobicContact CE-CG 4.4Å; M302-V354 HydrophobicContact CE-CB 4.2Å; M302-V354 HydrophobicContact CE-CG1 3.64Å; M302-V354 HydrophobicContact CE-CG2 4.37Å; M302-V354 HydrophobicContact CG-CG1 4.04Å; M302-I362 HydrophobicContact CE-CD1 3.69Å; M302-L367 HydrophobicContact CB-CD1 3.67Å; M302-L367 HydrophobicContact CB-CD2 3.77Å; M302-L367 HydrophobicContact CB-CG 4.37Å; M302-L367 HydrophobicContact SD-CD2 4.41Å; M302-L369 PolarHBondContact N-O 3Å; M302-V371 PolarHBondContact O-N 3.4Å; M302-R394 HydrophobicContact SD-CB 4.43Å; M302-R394 HydrophobicContact SD-CG 4.23Å
303	I	94.9	Very high	89.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	118.4	-174.4	-48.9	-178.7	0	0	0	109.6	I289 L314 M318 V351 L352 I353 V354 V371 Y373	I289-I303 HydrophobicContact CD1-CD1 4.21Å; I303-L314 HydrophobicContact CB-CD2 4.37Å; I303-L314 HydrophobicContact CD1-CD2 4.24Å; I303-L314 HydrophobicContact CG2-CD2 3.61Å; I303-M318 HydrophobicContact CD1-SD 3.63Å; I303-V351 HydrophobicContact CD1-CG1 3.67Å; I303-V351 HydrophobicContact CG1-CG1 4.09Å; I303-L352 PolarHBondContact N-O 3.44Å; I303-I353 HydrophobicContact CB-CG1 4.26Å; I303-I353 HydrophobicContact CD1-CG1 4.42Å; I303-I353 WeakPolarHBondContact O-CA 3.5Å; I303-V354 PolarHBondContact O-N 3.46Å; I303-V371 CarbonylContact C-O 3.6Å; I303-V371 WeakPolarHBondContact CA-O 3.32Å; I303-V371 HydrophobicContact CB-CB 4.42Å; I303-V371 HydrophobicContact CG1-CB 4.12Å; I303-V371 HydrophobicContact CG1-CG2 4.43Å; I303-V371 HydrophobicContact CG2-CB 4.1Å; I303-V371 HydrophobicContact CG2-CG1 4.2Å; I303-Y373 HydrophobicContact CG2-CD2 4.44Å; I303-Y373 HydrophobicContact CG2-CG 4.4Å
304	F	94.6	Very high	89.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	116.2	-177.9	-66.6	-76.8	0	0	0	111.8	M302 V354 A359 V370 V371 Y373 D374 R391 R394	M302-F304 HydrophobicContact CB-CE2 4.46Å; M302-F304 HydrophobicContact CE-CE1 4.11Å; M302-F304 HydrophobicContact CE-CZ 4.06Å; M302-F304 HydrophobicContact CG-CE1 4.31Å; M302-F304 HydrophobicContact CG-CE2 4.01Å; M302-F304 HydrophobicContact CG-CZ 3.79Å; M302-F304 HydrophobicContact SD-CE1 4.14Å; M302-F304 HydrophobicContact SD-CE2 4.17Å; M302-F304 HydrophobicContact SD-CZ 3.5Å; M302-F304 WeakPolarHBondContact SD-CZ 3.17Å; F304-V354 WeakPolarHBondContact CA-O 2.99Å; F304-V354 HydrophobicContact CD1-CG1 3.34Å; F304-V354 HydrophobicContact CE1-CG1 3.3Å; F304-V354 HydrophobicContact CG-CG1 4.2Å; F304-V354 HydrophobicContact CZ-CG1 4.2Å; F304-A359 HydrophobicContact CD1-CB 4.07Å; F304-A359 HydrophobicContact CE1-CB 3.43Å; F304-A359 VanDerWaalsContact CE1-CB 3.43Å; F304-A359 HydrophobicContact CZ-CB 4.44Å; F304-V370 HydrophobicContact CD2-CG1 3.92Å; F304-V370 HydrophobicContact CE2-CG1 3.7Å; F304-V371 PolarHBondContact N-O 3.33Å; F304-Y373 WeakPolarHBondContact O-CB 3.11Å; F304-Y373 PolarHBondContact O-N 3.07Å; F304-Y373 VanDerWaalsContact O-N 3.1Å; F304-D374 PolarHBondContact O-N 2.86Å; F304-R391 HydrophobicContact CD1-CG 3.75Å; F304-R391 HydrophobicContact CD2-CB 3.75Å; F304-R391 HydrophobicContact CD2-CG 3.68Å; F304-R391 HydrophobicContact CE1-CB 4.48Å; F304-R391 HydrophobicContact CE1-CG 3.82Å; F304-R391 HydrophobicContact CE2-CB 3.51Å; F304-R391 HydrophobicContact CE2-CG 3.69Å; F304-R391 HydrophobicContact CG-CB 4.31Å; F304-R391 HydrophobicContact CG-CG 3.7Å; F304-R391 HydrophobicContact CZ-CB 3.91Å; F304-R391 HydrophobicContact CZ-CG 3.77Å; F304-R394 HydrophobicContact CZ-CG 4.4Å
305	C	94.2	Very high	90.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.1	174.1	-63.6	0	0	0	0	110.9	A311 V354 T355	C305-A311 HydrophobicContact CB-CB 3.79Å; C305-V354 PolarHBondContact N-O 3.38Å; C305-T355 WeakPolarHBondContact O-CA 3.33Å
306	R	89.9	Confident	90.9	Very high	100 Å²	100	50.3 Å²	50.3	38%	0.377	23%	0.231	S	C	.	.	S	Bend	trans	-75.3	-42	177.5	-175.3	-178	-61.3	150.3	3.2	111.3	D374 L375 I377	R306-D374 HydrophobicContact CB-CB 3.64Å; R306-D374 WeakPolarHBondContact CB-OD2 3.25Å; R306-D374 PolarHBondContact N-OD2 3.34Å; R306-L375 PolarHBondContact NH2-O 3.02Å; R306-I377 VanDerWaalsContact CZ-CD1 3.45Å
307	T	89.6	Confident	91.4	Very high	69 Å²	69	52.3 Å²	52.3	42%	0.423	24%	0.239	S	C	.	.	S	Bend	trans	-115.6	149.9	-174.8	74.3	0	0	0	0	111.9	R309 S310 A311	T307-R309 PolarHBondContact O-N 3.44Å; T307-S310 PolarHBondContact O-N 3.04Å; T307-S310 WeakPolarHBondContact OG1-CB 3.47Å; T307-S310 PolarHBondContact OG1-N 2.96Å; T307-S310 VanDerWaalsContact OG1-N 3.09Å; T307-A311 PolarHBondContact O-N 3.18Å
308	R	90.5	Very high	92.1	Very high	136 Å²	136	45.2 Å²	45.2	51%	0.513	20%	0.203	S	C	.	.	H	α-helix	trans	-59.8	-33.5	173.4	-71	-174.4	-77.6	161.3	-8.6	112.5	R312 T329 E331 T355	R308-R312 WeakPolarHBondContact O-CB 3.49Å; R308-R312 PolarHBondContact O-N 3.05Å; R308-T329 HydrophobicContact CG-CG2 4.39Å; R308-E331 IonicContact NH1-OE2 2.59Å; R308-E331 PolarHBondContact NH1-OE2 3.32Å; R308-E331 VanDerWaalsContact NH1-OE2 3.16Å; R308-T355 HydrophobicContact CG-CG2 4.28Å
309	R	92.5	Very high	92.8	Very high	187 Å²	187	49.7 Å²	49.7	71%	0.706	22%	0.219	S	C	*	.	H	α-helix	trans	-64.7	-54.1	177.5	-178.4	176.7	177.3	178.3	0.8	110.9	T307 A311 R312 D313	T307-R309 PolarHBondContact O-N 3.44Å; R309-A311 VanDerWaalsContact C-N 3.29Å; R309-A311 PolarHBondContact O-N 2.75Å; R309-R312 PolarHBondContact O-N 2.95Å; R309-R312 VanDerWaalsContact O-N 3.11Å; R309-D313 WeakPolarHBondContact CG-OD2 3.38Å; R309-D313 IonicContact NE-OD2 3.91Å; R309-D313 VanDerWaalsContact O-CG 3.24Å; R309-D313 PolarHBondContact O-N 3.27Å
310	S	92.7	Very high	93.4	Very high	11 Å²	11	55.9 Å²	55.9	8%	0.077	24%	0.239	C	C	.	.	H	α-helix	trans	-55.9	-44	176	169.8	0	0	0	0	111.8	T307 R312 D313 L314 Y373	T307-S310 PolarHBondContact O-N 3.04Å; T307-S310 WeakPolarHBondContact OG1-CB 3.47Å; T307-S310 PolarHBondContact OG1-N 2.96Å; T307-S310 VanDerWaalsContact OG1-N 3.09Å; S310-R312 PolarHBondContact O-N 3.13Å; S310-D313 PolarHBondContact O-N 2.99Å; S310-L314 WeakPolarHBondContact O-CB 3.4Å; S310-L314 PolarHBondContact O-N 3.4Å; S310-Y373 WeakPolarHBondContact OG-CE1 3.32Å
311	A	94.6	Very high	93.5	Very high	0 Å²	0	58 Å²	58	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.3	-43.6	176.8	0	0	0	0	0	112.8	C305 T307 R309 W315 L327 T329 I353 T355	C305-A311 HydrophobicContact CB-CB 3.79Å; T307-A311 PolarHBondContact O-N 3.18Å; R309-A311 VanDerWaalsContact C-N 3.29Å; R309-A311 PolarHBondContact O-N 2.75Å; A311-W315 VanDerWaalsContact O-CB 3.31Å; A311-W315 WeakPolarHBondContact O-CB 3.49Å; A311-W315 PolarHBondContact O-N 2.87Å; A311-L327 HydrophobicContact CB-CD1 3.8Å; A311-T329 HydrophobicContact CB-CG2 4.38Å; A311-I353 HydrophobicContact CB-CG2 3.86Å; A311-T355 HydrophobicContact CB-CG2 4.21Å
312	R	95.1	Very high	93.5	Very high	98 Å²	98	61.2 Å²	61.2	37%	0.37	29%	0.291	S	S	.	.	H	α-helix	trans	-70.8	-42.4	179.3	-170.7	178.1	-65.1	141.7	-0.1	112.1	R308 R309 S310 L314 W315 H316 L327 E331	R308-R312 WeakPolarHBondContact O-CB 3.49Å; R308-R312 PolarHBondContact O-N 3.05Å; R309-R312 PolarHBondContact O-N 2.95Å; R309-R312 VanDerWaalsContact O-N 3.11Å; S310-R312 PolarHBondContact O-N 3.13Å; R312-L314 VanDerWaalsContact C-N 3.34Å; R312-L314 PolarHBondContact O-N 3.02Å; R312-W315 WeakPolarHBondContact O-CB 3.49Å; R312-W315 PolarHBondContact O-N 3.16Å; R312-H316 PolarHBondContact O-CD2 2.85Å; R312-H316 PolarHBondContact O-N 3.07Å; R312-L327 HydrophobicContact CB-CD2 4.47Å; R312-E331 IonicContact CZ-OE1 2.93Å; R312-E331 IonicContact NH2-OE1 3.81Å; R312-E331 PolarHBondContact NH2-OE1 3.22Å; R312-E331 IonicContact NH2-OE2 2.63Å; R312-E331 PolarHBondContact NH2-OE2 3.37Å
313	D	95.4	Very high	93.5	Very high	74 Å²	74	63.3 Å²	63.3	40%	0.396	30%	0.301	S	S	.	.	H	α-helix	trans	-62.2	-43.9	178.4	-65.7	-16.8	0	0	0	110.4	R309 S310 H316 K317	R309-D313 WeakPolarHBondContact CG-OD2 3.38Å; R309-D313 IonicContact NE-OD2 3.91Å; R309-D313 VanDerWaalsContact O-CG 3.24Å; R309-D313 PolarHBondContact O-N 3.27Å; S310-D313 PolarHBondContact O-N 2.99Å; D313-H316 PolarHBondContact O-N 3.19Å; D313-K317 WeakPolarHBondContact O-CG 3.27Å; D313-K317 PolarHBondContact O-N 2.88Å; D313-K317 VanDerWaalsContact O-N 3.15Å
314	L	96.1	Very high	93.3	Very high	2 Å²	2	65 Å²	65	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-64.3	-41.4	173.8	178.6	63.1	0	0	0	112.1	F286 I289 I303 S310 R312 H316 K317 M318 I353 Y373	F286-L314 HydrophobicContact CD2-CD1 3.93Å; I289-L314 HydrophobicContact CD1-CD1 4.05Å; I289-L314 HydrophobicContact CD1-CD2 4.49Å; I303-L314 HydrophobicContact CB-CD2 4.37Å; I303-L314 HydrophobicContact CD1-CD2 4.24Å; I303-L314 HydrophobicContact CG2-CD2 3.61Å; S310-L314 WeakPolarHBondContact O-CB 3.4Å; S310-L314 PolarHBondContact O-N 3.4Å; R312-L314 VanDerWaalsContact C-N 3.34Å; R312-L314 PolarHBondContact O-N 3.02Å; L314-H316 VanDerWaalsContact C-N 3.34Å; L314-H316 PolarHBondContact O-N 2.81Å; L314-K317 PolarHBondContact O-N 2.86Å; L314-M318 HydrophobicContact CD1-CG 3.92Å; L314-M318 HydrophobicContact CD1-SD 4.45Å; L314-M318 HydrophobicContact CG-CG 4.25Å; L314-M318 WeakPolarHBondContact O-CG 3.47Å; L314-M318 PolarHBondContact O-N 2.9Å; L314-I353 HydrophobicContact CB-CD1 4.23Å; L314-I353 HydrophobicContact CD2-CD1 3.95Å; L314-I353 HydrophobicContact CD2-CG1 4.24Å; L314-I353 HydrophobicContact CD2-CG2 4.46Å; L314-I353 HydrophobicContact CG-CD1 3.75Å; L314-Y373 HydrophobicContact CD1-CE2 4.06Å; L314-Y373 HydrophobicContact CD2-CD2 3.89Å; L314-Y373 HydrophobicContact CD2-CE2 4.15Å; L314-Y373 HydrophobicContact CD2-CG 4.23Å
315	W	96.2	Very high	93.3	Very high	74 Å²	74	65 Å²	65	28%	0.28	32%	0.315	S	S	.	.	H	α-helix	trans	-57.9	-45.3	177.4	177.2	83.7	0	0	0	112.2	A311 R312 M318 R319 V325 L327 I353	A311-W315 VanDerWaalsContact O-CB 3.31Å; A311-W315 WeakPolarHBondContact O-CB 3.49Å; A311-W315 PolarHBondContact O-N 2.87Å; R312-W315 WeakPolarHBondContact O-CB 3.49Å; R312-W315 PolarHBondContact O-N 3.16Å; W315-M318 PolarHBondContact O-N 3.45Å; W315-R319 HydrophobicContact CD2-CG 4.32Å; W315-R319 HydrophobicContact CZ2-CG 4.11Å; W315-R319 WeakPolarHBondContact O-CB 3.46Å; W315-R319 WeakPolarHBondContact O-CG 3.47Å; W315-R319 PolarHBondContact O-N 3.07Å; W315-V325 PolarHBondContact NE1-O 2.8Å; W315-L327 HydrophobicContact CB-CB 4.46Å; W315-L327 HydrophobicContact CB-CD1 4.42Å; W315-L327 HydrophobicContact CB-CD2 4.25Å; W315-L327 HydrophobicContact CG-CB 3.99Å; W315-L327 HydrophobicContact CG-CD2 4.21Å; W315-I353 VanDerWaalsContact CA-CD1 3.48Å; W315-I353 HydrophobicContact CB-CD1 3.86Å
316	H	95.7	Very high	93.3	Very high	85 Å²	85	65.2 Å²	65.2	39%	0.394	32%	0.316	S	S	.	.	H	α-helix	trans	-60.6	-50.3	174.8	-75.7	-68.6	0	0	0	111.5	R312 D313 L314 M318 R319 E320	R312-H316 PolarHBondContact O-CD2 2.85Å; R312-H316 PolarHBondContact O-N 3.07Å; D313-H316 PolarHBondContact O-N 3.19Å; L314-H316 VanDerWaalsContact C-N 3.34Å; L314-H316 PolarHBondContact O-N 2.81Å; H316-M318 VanDerWaalsContact C-N 3.34Å; H316-M318 PolarHBondContact O-N 3.48Å; H316-R319 PolarHBondContact O-N 3.28Å; H316-E320 WeakPolarHBondContact O-CB 3.5Å; H316-E320 WeakPolarHBondContact O-CG 3.22Å; H316-E320 PolarHBondContact O-N 2.84Å
317	K	95	Very high	93.5	Very high	57 Å²	57	61.6 Å²	61.6	25%	0.248	31%	0.305	C	S	.	.	H	α-helix	trans	-58.4	-43.2	179.7	-72.5	179.3	175.8	-179.6	0	112.4	E283 F286 D313 L314 E320 A321	E283-K317 IonicContact OE1-NZ 3.62Å; E283-K317 PolarHBondContact OE1-NZ 3.01Å; F286-K317 HydrophobicContact CD2-CB 3.93Å; F286-K317 HydrophobicContact CE2-CB 3.73Å; F286-K317 HydrophobicContact CG-CB 4.49Å; F286-K317 HydrophobicContact CG-CD 4.39Å; F286-K317 HydrophobicContact CZ-CB 4.15Å; D313-K317 WeakPolarHBondContact O-CG 3.27Å; D313-K317 PolarHBondContact O-N 2.88Å; D313-K317 VanDerWaalsContact O-N 3.15Å; L314-K317 PolarHBondContact O-N 2.86Å; K317-E320 PolarHBondContact O-N 3.21Å; K317-A321 PolarHBondContact O-N 3.01Å
318	M	94.1	Very high	93.6	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-69.4	-38.1	178.9	-69.1	-150	76.6	0	0	112.8	F286 I289 Y293 I303 L314 W315 H316 A321 G322 H323 V325 V351 I353	F286-M318 HydrophobicContact CD2-CG 4.45Å; F286-M318 HydrophobicContact CE2-CG 3.96Å; I289-M318 HydrophobicContact CG2-CE 3.94Å; Y293-M318 HydrophobicContact CE2-CE 4Å; I303-M318 HydrophobicContact CD1-SD 3.63Å; L314-M318 HydrophobicContact CD1-CG 3.92Å; L314-M318 HydrophobicContact CD1-SD 4.45Å; L314-M318 HydrophobicContact CG-CG 4.25Å; L314-M318 WeakPolarHBondContact O-CG 3.47Å; L314-M318 PolarHBondContact O-N 2.9Å; W315-M318 PolarHBondContact O-N 3.45Å; H316-M318 VanDerWaalsContact C-N 3.34Å; H316-M318 PolarHBondContact O-N 3.48Å; M318-A321 PolarHBondContact O-N 3.48Å; M318-G322 PolarHBondContact O-N 3.17Å; M318-H323 HydrophobicContact CB-CB 4.45Å; M318-H323 HydrophobicContact CE-CB 4.23Å; M318-H323 WeakPolarHBondContact O-CB 3.36Å; M318-H323 PolarHBondContact O-CD2 3.25Å; M318-H323 PolarHBondContact O-N 3.07Å; M318-V325 HydrophobicContact CB-CG2 3.57Å; M318-V351 HydrophobicContact CE-CG1 4.34Å; M318-V351 HydrophobicContact CE-CG2 4.1Å; M318-V351 HydrophobicContact SD-CG1 3.83Å; M318-I353 HydrophobicContact SD-CD1 4.47Å
319	R	94.4	Very high	93.5	Very high	103 Å²	103	51.9 Å²	51.9	39%	0.389	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-41.2	174.5	-77.6	-78	-175.5	-176.1	-1.6	111.6	W315 H316 A321 G322 H323 V325 D349	W315-R319 HydrophobicContact CD2-CG 4.32Å; W315-R319 HydrophobicContact CZ2-CG 4.11Å; W315-R319 WeakPolarHBondContact O-CB 3.46Å; W315-R319 WeakPolarHBondContact O-CG 3.47Å; W315-R319 PolarHBondContact O-N 3.07Å; H316-R319 PolarHBondContact O-N 3.28Å; R319-A321 VanDerWaalsContact C-N 3.28Å; R319-A321 PolarHBondContact O-N 2.98Å; R319-G322 PolarHBondContact O-N 3.47Å; R319-H323 WeakPolarHBondContact CD-O 3.37Å; R319-V325 HydrophobicContact CG-CB 4.32Å; R319-V325 HydrophobicContact CG-CG2 4.45Å; R319-V325 VanDerWaalsContact CZ-N 3.35Å; R319-V325 VanDerWaalsContact CZ-O 3.31Å; R319-V325 PolarHBondContact NE-O 3.15Å; R319-V325 VanDerWaalsContact NE-O 3.16Å; R319-V325 PolarHBondContact NH2-O 2.81Å; R319-D349 IonicContact CZ-OD1 2.85Å; R319-D349 IonicContact NH2-OD1 3.83Å; R319-D349 PolarHBondContact NH2-OD1 3.14Å; R319-D349 IonicContact NH2-OD2 3.81Å
320	E	94.4	Very high	93.1	Very high	165 Å²	165	46.1 Å²	46.1	77%	0.771	25%	0.252	S	S	*	.	H	α-helix	trans	-63.1	-33.8	175.2	-75.3	179.9	172.5	0	0	112.6	H316 K317 G322	H316-E320 WeakPolarHBondContact O-CB 3.5Å; H316-E320 WeakPolarHBondContact O-CG 3.22Å; H316-E320 PolarHBondContact O-N 2.84Å; K317-E320 PolarHBondContact O-N 3.21Å; E320-G322 PolarHBondContact O-N 3.07Å
321	A	91.1	Very high	92.7	Very high	56 Å²	56	49.4 Å²	49.4	46%	0.463	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	1.6	172.1	0	0	0	0	0	114.2	F286 K317 M318 R319	F286-A321 HydrophobicContact CZ-CB 3.96Å; K317-A321 PolarHBondContact O-N 3.01Å; M318-A321 PolarHBondContact O-N 3.48Å; R319-A321 VanDerWaalsContact C-N 3.28Å; R319-A321 PolarHBondContact O-N 2.98Å
322	G	91.1	Very high	92.2	Very high	68 Å²	68	51.4 Å²	51.4	70%	0.701	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	9.6	173.7	0	0	0	0	0	115.4	M318 R319 E320	M318-G322 PolarHBondContact O-N 3.17Å; R319-G322 PolarHBondContact O-N 3.47Å; E320-G322 PolarHBondContact O-N 3.07Å
323	H	90.8	Very high	91.7	Very high	45 Å²	45	50.4 Å²	50.4	21%	0.208	28%	0.282	C	S	.	.			trans	-79.9	146	177.3	-61	-85.5	0	0	0	112.1	Y293 M318 R319 V325 V351	Y293-H323 AromaticContact CD1-CE1 3.99Å; Y293-H323 AromaticContact CG-CE1 3.9Å; M318-H323 HydrophobicContact CB-CB 4.45Å; M318-H323 HydrophobicContact CE-CB 4.23Å; M318-H323 WeakPolarHBondContact O-CB 3.36Å; M318-H323 PolarHBondContact O-CD2 3.25Å; M318-H323 PolarHBondContact O-N 3.07Å; R319-H323 WeakPolarHBondContact CD-O 3.37Å; H323-V325 HydrophobicContact CB-CG2 3.68Å; H323-V351 HydrophobicContact CB-CG2 4.47Å
324	A	91.8	Very high	90.7	Very high	34 Å²	34	48.4 Å²	48.4	28%	0.281	27%	0.272	S	S	.	.			trans	-83.7	109.9	167.8	0	0	0	0	0	109.9	E348 D349 R350 V351	A324-E348 WeakPolarHBondContact CB-O 3.34Å; A324-D349 VanDerWaalsContact C-OD1 3.27Å; A324-R350 PolarHBondContact O-N 3.22Å; A324-V351 PolarHBondContact O-N 3.23Å
325	V	94.1	Very high	90	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	121.4	-165.6	-170.8	0	0	0	0	111.6	W315 M318 R319 H323 D349 V351 I353	W315-V325 PolarHBondContact NE1-O 2.8Å; M318-V325 HydrophobicContact CB-CG2 3.57Å; R319-V325 HydrophobicContact CG-CB 4.32Å; R319-V325 HydrophobicContact CG-CG2 4.45Å; R319-V325 VanDerWaalsContact CZ-N 3.35Å; R319-V325 VanDerWaalsContact CZ-O 3.31Å; R319-V325 PolarHBondContact NE-O 3.15Å; R319-V325 VanDerWaalsContact NE-O 3.16Å; R319-V325 PolarHBondContact NH2-O 2.81Å; H323-V325 HydrophobicContact CB-CG2 3.68Å; V325-D349 PolarHBondContact N-OD1 3.41Å; V325-D349 VanDerWaalsContact N-OD1 3.13Å; V325-V351 CarbonylContact C-O 3.58Å; V325-V351 WeakPolarHBondContact CA-O 3.27Å; V325-V351 HydrophobicContact CB-CB 4.26Å; V325-V351 HydrophobicContact CG1-CB 4Å; V325-V351 HydrophobicContact CG1-CG1 4.07Å; V325-V351 HydrophobicContact CG2-CB 4Å; V325-V351 HydrophobicContact CG2-CG2 4.24Å; V325-I353 HydrophobicContact CG1-CD1 3.54Å; V325-I353 HydrophobicContact CG1-CG1 3.83Å
326	S	94	Very high	89.7	Confident	5 Å²	5	57.8 Å²	57.8	4%	0.035	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	142.2	167.3	-96.8	0	0	0	0	110.7	C340 D349 V351 I353	S326-C340 PolarHBondContact OG-O 3.05Å; S326-D349 WeakPolarHBondContact CB-OD2 3.48Å; S326-D349 PolarHBondContact OG-OD2 3.23Å; S326-V351 PolarHBondContact N-O 2.66Å; S326-I353 PolarHBondContact O-N 3.5Å
327	L	94.4	Very high	89.1	Confident	25 Å²	25	55.5 Å²	55.5	13%	0.131	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	117.3	177	175	63.2	0	0	0	109.3	A311 R312 W315 T329 L332 I353	A311-L327 HydrophobicContact CB-CD1 3.8Å; R312-L327 HydrophobicContact CB-CD2 4.47Å; W315-L327 HydrophobicContact CB-CB 4.46Å; W315-L327 HydrophobicContact CB-CD1 4.42Å; W315-L327 HydrophobicContact CB-CD2 4.25Å; W315-L327 HydrophobicContact CG-CB 3.99Å; W315-L327 HydrophobicContact CG-CD2 4.21Å; L327-T329 HydrophobicContact CD1-CG2 3.72Å; L327-T329 HydrophobicContact CD2-CG2 4.36Å; L327-T329 HydrophobicContact CG-CG2 3.9Å; L327-L332 WeakPolarHBondContact O-CD1 3.41Å; L327-I353 CarbonylContact C-O 3.55Å; L327-I353 HydrophobicContact CD1-CB 4.08Å; L327-I353 HydrophobicContact CD1-CG2 3.89Å
328	L	91.2	Very high	88.4	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	97.5	-179.2	-170.1	72.7	0	0	0	111.4	L332 R337 C340 L341 L352 I353 V354 T355 C358 I362	L328-L332 HydrophobicContact CD1-CD1 4.33Å; L328-R337 HydrophobicContact CD1-CB 3.8Å; L328-R337 HydrophobicContact CD1-CG 3.72Å; L328-C340 HydrophobicContact CD1-CB 4.43Å; L328-L341 HydrophobicContact CD2-CD2 4.04Å; L328-L341 HydrophobicContact CD2-CG 4.42Å; L328-L352 HydrophobicContact CB-CD1 3.9Å; L328-I353 PolarHBondContact N-O 3.01Å; L328-V354 HydrophobicContact CB-CB 4.39Å; L328-V354 HydrophobicContact CB-CG2 4.08Å; L328-V354 HydrophobicContact CD2-CG2 3.94Å; L328-V354 HydrophobicContact CG-CG2 4.3Å; L328-V354 WeakPolarHBondContact O-CA 3.39Å; L328-T355 PolarHBondContact O-N 3.3Å; L328-C358 HydrophobicContact CD2-CB 3.96Å; L328-C358 HydrophobicContact CG-CB 3.85Å; L328-I362 HydrophobicContact CD2-CD1 3.4Å; L328-I362 HydrophobicContact CD2-CG1 4.49Å
329	T	89.5	Confident	88.1	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.006	32%	0.322	C	S	.	.			trans	-121	161.2	178.6	62.6	0	0	0	0	110.9	R308 A311 L327 E331 L332 T355	R308-T329 HydrophobicContact CG-CG2 4.39Å; A311-T329 HydrophobicContact CB-CG2 4.38Å; L327-T329 HydrophobicContact CD1-CG2 3.72Å; L327-T329 HydrophobicContact CD2-CG2 4.36Å; L327-T329 HydrophobicContact CG-CG2 3.9Å; T329-E331 PolarHBondContact O-N 3.01Å; T329-E331 VanDerWaalsContact O-N 3.12Å; T329-E331 WeakPolarHBondContact OG1-CG 3.39Å; T329-E331 PolarHBondContact OG1-OE1 2.91Å; T329-L332 PolarHBondContact O-N 3Å; T329-T355 HydrophobicContact CG2-CG2 4.19Å
330	A	82.9	Confident	87.8	Confident	65 Å²	65	54.4 Å²	54.4	54%	0.537	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-5.6	-177	0	0	0	0	0	114.6	C358	A330-C358 PolarHBondContact N-SG 2.96Å; A330-C358 VanDerWaalsContact N-SG 3.37Å
331	E	84.7	Confident	87.3	Confident	81 Å²	81	47.8 Å²	47.8	38%	0.379	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-14.8	178.4	75.4	-145.5	157	0	0	113.2	R308 R312 T329	R308-E331 IonicContact NH1-OE2 2.59Å; R308-E331 PolarHBondContact NH1-OE2 3.32Å; R308-E331 VanDerWaalsContact NH1-OE2 3.16Å; R312-E331 IonicContact CZ-OE1 2.93Å; R312-E331 IonicContact NH2-OE1 3.81Å; R312-E331 PolarHBondContact NH2-OE1 3.22Å; R312-E331 IonicContact NH2-OE2 2.63Å; R312-E331 PolarHBondContact NH2-OE2 3.37Å; T329-E331 PolarHBondContact O-N 3.01Å; T329-E331 VanDerWaalsContact O-N 3.12Å; T329-E331 WeakPolarHBondContact OG1-CG 3.39Å; T329-E331 PolarHBondContact OG1-OE1 2.91Å
332	L	85	Confident	87	Confident	42 Å²	42	49.3 Å²	49.3	22%	0.22	28%	0.277	C	S	.	.	S	Bend	trans	-67.4	141.8	174.7	-66.5	-174	0	0	0	111	L327 L328 T329 E336 R337	L327-L332 WeakPolarHBondContact O-CD1 3.41Å; L328-L332 HydrophobicContact CD1-CD1 4.33Å; T329-L332 PolarHBondContact O-N 3Å; L332-E336 HydrophobicContact CB-CB 4.03Å; L332-E336 HydrophobicContact CD1-CB 4.4Å; L332-E336 HydrophobicContact CD2-CB 4.13Å; L332-E336 HydrophobicContact CG-CB 4.42Å; L332-R337 HydrophobicContact CB-CG 3.63Å; L332-R337 HydrophobicContact CD1-CG 4.34Å
333	T	83.8	Confident	86.9	Confident	76 Å²	76	48.3 Å²	48.3	47%	0.466	26%	0.256	S	S	.	.			trans	-63.4	159	168.2	64.8	0	0	0	0	110.6	R335 E336 R337	T333-R335 PolarHBondContact O-N 2.77Å; T333-E336 WeakPolarHBondContact CB-OE2 3.4Å; T333-E336 WeakPolarHBondContact CG2-OE2 3.37Å; T333-E336 PolarHBondContact N-OE2 3.01Å; T333-E336 PolarHBondContact O-N 3.3Å; T333-E336 VanDerWaalsContact O-N 3.16Å; T333-E336 WeakPolarHBondContact OG1-CB 3.5Å; T333-E336 WeakPolarHBondContact OG1-CG 3.36Å; T333-E336 PolarHBondContact OG1-N 2.82Å; T333-E336 PolarHBondContact OG1-OE2 3.07Å; T333-R337 WeakPolarHBondContact O-CG 3.49Å; T333-R337 PolarHBondContact O-N 3Å
334	V	73.9	Confident	86.8	Confident	32 Å²	32	46.1 Å²	46.1	19%	0.194	25%	0.246	C	C	.	.	H	α-helix	trans	-55.8	-39.6	178.9	-177.4	0	0	0	0	111.5	Y134 E162 R337 A338	Y134-V334 HydrophobicContact CD1-CG1 3.3Å; Y134-V334 HydrophobicContact CD2-CG1 4Å; Y134-V334 HydrophobicContact CE1-CG1 3.16Å; Y134-V334 HydrophobicContact CE2-CG1 3.9Å; Y134-V334 HydrophobicContact CG-CG1 3.72Å; Y134-V334 VanDerWaalsContact CZ-CG1 3.48Å; E162-V334 HydrophobicContact CG-CG1 4.38Å; E162-V334 WeakPolarHBondContact OE1-CG1 3.11Å; V334-R337 PolarHBondContact O-N 2.89Å; V334-A338 PolarHBondContact O-N 2.91Å
335	R	82.6	Confident	86.3	Confident	185 Å²	185	49.8 Å²	49.8	70%	0.698	25%	0.252	S	S	*	.	H	α-helix	trans	-64.4	-48.8	176.2	-173.9	175.4	-178.6	163.7	2.1	112.4	T333 R337 A338 D339	T333-R335 PolarHBondContact O-N 2.77Å; R335-R337 VanDerWaalsContact C-N 3.27Å; R335-R337 PolarHBondContact O-N 3.16Å; R335-A338 WeakPolarHBondContact O-CB 3.15Å; R335-A338 PolarHBondContact O-N 2.9Å; R335-A338 VanDerWaalsContact O-N 3.12Å; R335-D339 VanDerWaalsContact O-CG 3.28Å; R335-D339 PolarHBondContact O-N 2.83Å
336	E	88.3	Confident	85.8	Confident	88 Å²	88	57.5 Å²	57.5	41%	0.411	28%	0.282	S	S	.	.	H	α-helix	trans	-61.4	-36.4	177.4	-71.4	162.8	147.8	0	0	112	L332 T333 D339 C340	L332-E336 HydrophobicContact CB-CB 4.03Å; L332-E336 HydrophobicContact CD1-CB 4.4Å; L332-E336 HydrophobicContact CD2-CB 4.13Å; L332-E336 HydrophobicContact CG-CB 4.42Å; T333-E336 WeakPolarHBondContact CB-OE2 3.4Å; T333-E336 WeakPolarHBondContact CG2-OE2 3.37Å; T333-E336 PolarHBondContact N-OE2 3.01Å; T333-E336 PolarHBondContact O-N 3.3Å; T333-E336 VanDerWaalsContact O-N 3.16Å; T333-E336 WeakPolarHBondContact OG1-CB 3.5Å; T333-E336 WeakPolarHBondContact OG1-CG 3.36Å; T333-E336 PolarHBondContact OG1-N 2.82Å; T333-E336 PolarHBondContact OG1-OE2 3.07Å; E336-D339 PolarHBondContact O-N 2.85Å; E336-C340 WeakPolarHBondContact O-CB 3.13Å; E336-C340 PolarHBondContact O-N 3.38Å; E336-C340 PolarHBondContact O-SG 2.84Å
337	R	85	Confident	85.3	Confident	38 Å²	38	58.7 Å²	58.7	14%	0.143	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-44.3	174.1	-66.8	177.3	72.1	-152.5	-5.3	111.3	E135 L328 L332 T333 V334 R335 C340 L341	E135-R337 IonicContact OE1-CZ 3.28Å; E135-R337 IonicContact OE1-NE 2.85Å; E135-R337 PolarHBondContact OE1-NE 3.41Å; E135-R337 VanDerWaalsContact OE1-NE 3.16Å; E135-R337 IonicContact OE1-NH1 2.79Å; E135-R337 PolarHBondContact OE1-NH1 3Å; E135-R337 IonicContact OE1-NH2 3.12Å; E135-R337 PolarHBondContact OE1-NH2 2.92Å; E135-R337 IonicContact OE2-CZ 3.44Å; E135-R337 VanDerWaalsContact OE2-CZ 3.26Å; E135-R337 IonicContact OE2-NH1 2.78Å; E135-R337 PolarHBondContact OE2-NH1 3.49Å; E135-R337 IonicContact OE2-NH2 2.98Å; E135-R337 PolarHBondContact OE2-NH2 2.62Å; L328-R337 HydrophobicContact CD1-CB 3.8Å; L328-R337 HydrophobicContact CD1-CG 3.72Å; L332-R337 HydrophobicContact CB-CG 3.63Å; L332-R337 HydrophobicContact CD1-CG 4.34Å; T333-R337 WeakPolarHBondContact O-CG 3.49Å; T333-R337 PolarHBondContact O-N 3Å; V334-R337 PolarHBondContact O-N 2.89Å; R335-R337 VanDerWaalsContact C-N 3.27Å; R335-R337 PolarHBondContact O-N 3.16Å; R337-C340 PolarHBondContact O-N 3.23Å; R337-L341 WeakPolarHBondContact O-CB 3.17Å; R337-L341 WeakPolarHBondContact O-CG 3.38Å; R337-L341 PolarHBondContact O-N 3.12Å
338	A	80.2	Confident	85	Confident	36 Å²	36	63.3 Å²	63.3	30%	0.298	32%	0.317	S	S	.	.	H	α-helix	trans	-62.7	-42.4	176.2	0	0	0	0	0	111.8	V334 R335 L341 H342	V334-A338 PolarHBondContact O-N 2.91Å; R335-A338 WeakPolarHBondContact O-CB 3.15Å; R335-A338 PolarHBondContact O-N 2.9Å; R335-A338 VanDerWaalsContact O-N 3.12Å; A338-L341 PolarHBondContact O-N 3.48Å; A338-H342 VanDerWaalsContact O-CB 3.31Å; A338-H342 WeakPolarHBondContact O-CB 3.33Å; A338-H342 PolarHBondContact O-N 2.86Å
339	D	86.8	Confident	84.9	Confident	79 Å²	79	63.9 Å²	63.9	42%	0.422	32%	0.32	S	S	.	.	H	α-helix	trans	-64.9	-45.4	177.7	-65.6	-21.8	0	0	0	111.2	R335 E336 L341 H342 N343	R335-D339 VanDerWaalsContact O-CG 3.28Å; R335-D339 PolarHBondContact O-N 2.83Å; E336-D339 PolarHBondContact O-N 2.85Å; D339-L341 VanDerWaalsContact C-N 3.33Å; D339-L341 PolarHBondContact O-N 2.83Å; D339-H342 WeakPolarHBondContact O-CB 3.37Å; D339-H342 PolarHBondContact O-N 3.38Å; D339-N343 PolarHBondContact O-N 3.13Å; D339-N343 PolarHBondContact O-OD1 3.01Å
340	C	88.3	Confident	85	Confident	22 Å²	22	69.4 Å²	69.4	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-58.7	-44.5	175.1	-68.5	0	0	0	0	111.9	S326 L328 E336 R337 H342 F344	S326-C340 PolarHBondContact OG-O 3.05Å; L328-C340 HydrophobicContact CD1-CB 4.43Å; E336-C340 WeakPolarHBondContact O-CB 3.13Å; E336-C340 PolarHBondContact O-N 3.38Å; E336-C340 PolarHBondContact O-SG 2.84Å; R337-C340 PolarHBondContact O-N 3.23Å; C340-H342 VanDerWaalsContact C-N 3.33Å; C340-F344 WeakPolarHBondContact O-CB 3.46Å; C340-F344 PolarHBondContact O-N 3.38Å
341	L	83.9	Confident	85.4	Confident	25 Å²	25	66.4 Å²	66.4	13%	0.131	32%	0.315	C	S	.	.	H	α-helix	trans	-69.2	-32.9	178.5	-71.8	177.9	0	0	0	112.4	E135 L328 R337 A338 D339 R345 L352 I362	E135-L341 HydrophobicContact CB-CD1 4.29Å; E135-L341 HydrophobicContact CG-CD1 3.54Å; L328-L341 HydrophobicContact CD2-CD2 4.04Å; L328-L341 HydrophobicContact CD2-CG 4.42Å; R337-L341 WeakPolarHBondContact O-CB 3.17Å; R337-L341 WeakPolarHBondContact O-CG 3.38Å; R337-L341 PolarHBondContact O-N 3.12Å; A338-L341 PolarHBondContact O-N 3.48Å; D339-L341 VanDerWaalsContact C-N 3.33Å; D339-L341 PolarHBondContact O-N 2.83Å; L341-R345 WeakPolarHBondContact O-CB 3.46Å; L341-R345 PolarHBondContact O-N 3.18Å; L341-L352 HydrophobicContact CD2-CD2 4.13Å; L341-I362 HydrophobicContact CD2-CD1 4.02Å; L341-I362 HydrophobicContact CD2-CG1 4.29Å; L341-I362 HydrophobicContact CD2-CG2 3.58Å
342	H	84.8	Confident	85.8	Confident	88 Å²	88	62.5 Å²	62.5	41%	0.407	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-55.9	172.8	-177.2	94.9	0	0	0	110.4	A338 D339 C340 F344 R345 Y346	A338-H342 VanDerWaalsContact O-CB 3.31Å; A338-H342 WeakPolarHBondContact O-CB 3.33Å; A338-H342 PolarHBondContact O-N 2.86Å; D339-H342 WeakPolarHBondContact O-CB 3.37Å; D339-H342 PolarHBondContact O-N 3.38Å; C340-H342 VanDerWaalsContact C-N 3.33Å; H342-F344 VanDerWaalsContact C-N 3.26Å; H342-F344 PolarHBondContact O-N 3.02Å; H342-R345 PolarHBondContact O-N 2.99Å; H342-R345 VanDerWaalsContact O-N 3.08Å; H342-Y346 AromaticContact CD2-CD2 3.76Å; H342-Y346 AromaticContact CE1-CD2 3.4Å; H342-Y346 VanDerWaalsContact CE1-CD2 3.4Å; H342-Y346 WeakPolarHBondContact CE1-CD2 3.5Å; H342-Y346 AromaticContact CE1-CE2 3.19Å; H342-Y346 WeakPolarHBondContact CE1-CE2 3.42Å; H342-Y346 AromaticContact CG-CD2 3.81Å; H342-Y346 AromaticContact CG-CE2 4Å; H342-Y346 AromaticContact ND1-CD2 3.61Å; H342-Y346 AromaticContact ND1-CE2 3.33Å; H342-Y346 VanDerWaalsContact ND1-CE2 3.33Å; H342-Y346 WeakPolarHBondContact ND1-CE2 3.32Å; H342-Y346 AromaticContact NE2-CD2 3.5Å; H342-Y346 WeakPolarHBondContact NE2-CD2 3.34Å; H342-Y346 AromaticContact NE2-CE2 3.8Å; H342-Y346 VanDerWaalsContact O-CD2 3.27Å; H342-Y346 WeakPolarHBondContact O-CD2 3.35Å; H342-Y346 PolarHBondContact O-N 2.93Å
343	N	88.7	Confident	86.3	Confident	47 Å²	47	60.5 Å²	60.5	25%	0.251	29%	0.287	S	S	.	.	H	α-helix	trans	-56.7	-42.8	-179.4	-64.4	4.1	0	0	0	111.3	D339 G347 E348 D349	D339-N343 PolarHBondContact O-N 3.13Å; D339-N343 PolarHBondContact O-OD1 3.01Å; N343-G347 PolarHBondContact O-N 3.36Å; N343-E348 HydrophobicContact CB-CB 4.17Å; N343-E348 WeakPolarHBondContact O-CB 3.47Å; N343-E348 PolarHBondContact O-N 2.9Å; N343-E348 PolarHBondContact OD1-OE2 3.25Å; N343-D349 PolarHBondContact O-N 3.08Å; N343-D349 VanDerWaalsContact O-N 3.16Å
344	F	88.1	Confident	86.7	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-51.5	174.7	-170.4	-123.5	0	0	0	111.4	Q300 C301 C340 H342 Y346 G347 D349 L352 V364 L367	Q300-F344 HydrophobicContact CB-CE2 4.07Å; Q300-F344 HydrophobicContact CB-CZ 3.93Å; Q300-F344 HydrophobicContact CG-CE2 4.37Å; Q300-F344 PolarHBondContact NE2-O 2.68Å; C301-F344 WeakPolarHBondContact O-CZ 3.31Å; C340-F344 WeakPolarHBondContact O-CB 3.46Å; C340-F344 PolarHBondContact O-N 3.38Å; H342-F344 VanDerWaalsContact C-N 3.26Å; H342-F344 PolarHBondContact O-N 3.02Å; F344-Y346 VanDerWaalsContact C-N 3.29Å; F344-Y346 PolarHBondContact O-N 3.28Å; F344-G347 PolarHBondContact O-N 2.96Å; F344-D349 VanDerWaalsContact CD2-O 3.31Å; F344-D349 WeakPolarHBondContact CD2-O 3.49Å; F344-L352 HydrophobicContact CD1-CB 3.78Å; F344-L352 HydrophobicContact CD1-CD2 3.61Å; F344-L352 HydrophobicContact CD1-CG 4.26Å; F344-L352 HydrophobicContact CD2-CB 3.69Å; F344-L352 HydrophobicContact CE1-CB 3.65Å; F344-L352 HydrophobicContact CE1-CD2 3.79Å; F344-L352 HydrophobicContact CE1-CG 4.37Å; F344-L352 HydrophobicContact CE2-CB 3.62Å; F344-L352 HydrophobicContact CG-CB 3.79Å; F344-L352 HydrophobicContact CG-CD2 4.22Å; F344-L352 HydrophobicContact CG-CG 4.46Å; F344-L352 HydrophobicContact CZ-CB 3.6Å; F344-V364 HydrophobicContact CD1-CB 4.27Å; F344-V364 HydrophobicContact CD1-CG1 3.47Å; F344-V364 VanDerWaalsContact CD1-CG1 3.47Å; F344-V364 HydrophobicContact CD1-CG2 3.85Å; F344-V364 HydrophobicContact CE1-CB 3.92Å; F344-V364 HydrophobicContact CE1-CG1 3.24Å; F344-V364 HydrophobicContact CE1-CG2 3.72Å; F344-V364 HydrophobicContact CZ-CG1 4.19Å; F344-L367 HydrophobicContact CE1-CD1 4.37Å; F344-L367 HydrophobicContact CZ-CD1 3.93Å
345	R	82.5	Confident	87.4	Confident	110 Å²	110	55.8 Å²	55.8	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-59.5	-36.2	-177.2	179.2	175.4	-74.1	172.4	-3.4	113.5	L341 H342 G347 D363	L341-R345 WeakPolarHBondContact O-CB 3.46Å; L341-R345 PolarHBondContact O-N 3.18Å; H342-R345 PolarHBondContact O-N 2.99Å; H342-R345 VanDerWaalsContact O-N 3.08Å; R345-G347 VanDerWaalsContact C-N 3.32Å; R345-D363 PolarHBondContact NH2-O 2.76Å
346	Y	83.4	Confident	87.1	Confident	162 Å²	162	48.9 Å²	48.9	64%	0.635	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	3.4	179.1	-68.7	-75.2	0	0	0	113.6	H342 F344 E348	H342-Y346 AromaticContact CD2-CD2 3.76Å; H342-Y346 AromaticContact CE1-CD2 3.4Å; H342-Y346 VanDerWaalsContact CE1-CD2 3.4Å; H342-Y346 WeakPolarHBondContact CE1-CD2 3.5Å; H342-Y346 AromaticContact CE1-CE2 3.19Å; H342-Y346 WeakPolarHBondContact CE1-CE2 3.42Å; H342-Y346 AromaticContact CG-CD2 3.81Å; H342-Y346 AromaticContact CG-CE2 4Å; H342-Y346 AromaticContact ND1-CD2 3.61Å; H342-Y346 AromaticContact ND1-CE2 3.33Å; H342-Y346 VanDerWaalsContact ND1-CE2 3.33Å; H342-Y346 WeakPolarHBondContact ND1-CE2 3.32Å; H342-Y346 AromaticContact NE2-CD2 3.5Å; H342-Y346 WeakPolarHBondContact NE2-CD2 3.34Å; H342-Y346 AromaticContact NE2-CE2 3.8Å; H342-Y346 VanDerWaalsContact O-CD2 3.27Å; H342-Y346 WeakPolarHBondContact O-CD2 3.35Å; H342-Y346 PolarHBondContact O-N 2.93Å; F344-Y346 VanDerWaalsContact C-N 3.29Å; F344-Y346 PolarHBondContact O-N 3.28Å; Y346-E348 VanDerWaalsContact C-N 3.31Å; Y346-E348 PolarHBondContact O-N 3.35Å
347	G	83.3	Confident	86	Confident	31 Å²	31	49.2 Å²	49.2	32%	0.32	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	13.8	174.3	0	0	0	0	0	114.7	N343 F344 R345	N343-G347 PolarHBondContact O-N 3.36Å; F344-G347 PolarHBondContact O-N 2.96Å; R345-G347 VanDerWaalsContact C-N 3.32Å
348	E	87.7	Confident	85.2	Confident	122 Å²	122	47.5 Å²	47.5	57%	0.57	24%	0.237	S	C	*	.	S	Bend	trans	-66	-44.1	171.3	-60.4	-170.8	163.3	0	0	110.4	A324 N343 Y346	A324-E348 WeakPolarHBondContact CB-O 3.34Å; N343-E348 HydrophobicContact CB-CB 4.17Å; N343-E348 WeakPolarHBondContact O-CB 3.47Å; N343-E348 PolarHBondContact O-N 2.9Å; N343-E348 PolarHBondContact OD1-OE2 3.25Å; Y346-E348 VanDerWaalsContact C-N 3.31Å; Y346-E348 PolarHBondContact O-N 3.35Å
349	D	90.5	Very high	84.5	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.064	23%	0.226	C	C	.	.	S	Bend	trans	-102.8	130.7	164.1	-70.7	-44	0	0	0	108.9	R319 A324 V325 S326 N343 F344	R319-D349 IonicContact CZ-OD1 2.85Å; R319-D349 IonicContact NH2-OD1 3.83Å; R319-D349 PolarHBondContact NH2-OD1 3.14Å; R319-D349 IonicContact NH2-OD2 3.81Å; A324-D349 VanDerWaalsContact C-OD1 3.27Å; V325-D349 PolarHBondContact N-OD1 3.41Å; V325-D349 VanDerWaalsContact N-OD1 3.13Å; S326-D349 WeakPolarHBondContact CB-OD2 3.48Å; S326-D349 PolarHBondContact OG-OD2 3.23Å; N343-D349 PolarHBondContact O-N 3.08Å; N343-D349 VanDerWaalsContact O-N 3.16Å; F344-D349 VanDerWaalsContact CD2-O 3.31Å; F344-D349 WeakPolarHBondContact CD2-O 3.49Å
350	R	89.6	Confident	83.5	Confident	117 Å²	117	43.9 Å²	43.9	44%	0.442	21%	0.211	S	C	.	.	S	Bend	trans	-94.2	-9.9	177.5	-65.1	-169.3	-176.9	-173.4	1.2	113	Q300 C301 A324	Q300-R350 WeakPolarHBondContact CA-O 3.14Å; C301-R350 PolarHBondContact N-O 3.17Å; A324-R350 PolarHBondContact O-N 3.22Å
351	V	92.9	Very high	82.1	Confident	1 Å²	1	43 Å²	43	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	129.3	-179.8	-168.9	0	0	0	0	109.8	Y293 C301 I303 M318 H323 A324 V325 S326 I353	Y293-V351 WeakPolarHBondContact OH-CG2 3.43Å; C301-V351 CarbonylContact O-C 3.48Å; C301-V351 WeakPolarHBondContact O-CA 3.41Å; I303-V351 HydrophobicContact CD1-CG1 3.67Å; I303-V351 HydrophobicContact CG1-CG1 4.09Å; M318-V351 HydrophobicContact CE-CG1 4.34Å; M318-V351 HydrophobicContact CE-CG2 4.1Å; M318-V351 HydrophobicContact SD-CG1 3.83Å; H323-V351 HydrophobicContact CB-CG2 4.47Å; A324-V351 PolarHBondContact O-N 3.23Å; V325-V351 CarbonylContact C-O 3.58Å; V325-V351 WeakPolarHBondContact CA-O 3.27Å; V325-V351 HydrophobicContact CB-CB 4.26Å; V325-V351 HydrophobicContact CG1-CB 4Å; V325-V351 HydrophobicContact CG1-CG1 4.07Å; V325-V351 HydrophobicContact CG2-CB 4Å; V325-V351 HydrophobicContact CG2-CG2 4.24Å; S326-V351 PolarHBondContact N-O 2.66Å; V351-I353 HydrophobicContact CG1-CG1 4.27Å
352	L	93.2	Very high	81.3	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	108.4	170.5	-179.3	62.3	0	0	0	109.8	C301 M302 I303 L328 L341 F344 I362	C301-L352 PolarHBondContact O-N 3.45Å; M302-L352 CarbonylContact C-O 3.6Å; M302-L352 WeakPolarHBondContact CA-O 3.39Å; M302-L352 HydrophobicContact CE-CD2 3.64Å; M302-L352 HydrophobicContact CE-CG 4.4Å; I303-L352 PolarHBondContact N-O 3.44Å; L328-L352 HydrophobicContact CB-CD1 3.9Å; L341-L352 HydrophobicContact CD2-CD2 4.13Å; F344-L352 HydrophobicContact CD1-CB 3.78Å; F344-L352 HydrophobicContact CD1-CD2 3.61Å; F344-L352 HydrophobicContact CD1-CG 4.26Å; F344-L352 HydrophobicContact CD2-CB 3.69Å; F344-L352 HydrophobicContact CE1-CB 3.65Å; F344-L352 HydrophobicContact CE1-CD2 3.79Å; F344-L352 HydrophobicContact CE1-CG 4.37Å; F344-L352 HydrophobicContact CE2-CB 3.62Å; F344-L352 HydrophobicContact CG-CB 3.79Å; F344-L352 HydrophobicContact CG-CD2 4.22Å; F344-L352 HydrophobicContact CG-CG 4.46Å; F344-L352 HydrophobicContact CZ-CB 3.6Å; L352-I362 HydrophobicContact CD2-CD1 4.48Å
353	I	94.8	Very high	80.4	Confident	0 Å²	0	40 Å²	40	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	128.2	170.9	-59.5	171.5	0	0	0	108.1	I303 A311 L314 W315 M318 V325 S326 L327 L328 V351	I303-I353 HydrophobicContact CB-CG1 4.26Å; I303-I353 HydrophobicContact CD1-CG1 4.42Å; I303-I353 WeakPolarHBondContact O-CA 3.5Å; A311-I353 HydrophobicContact CB-CG2 3.86Å; L314-I353 HydrophobicContact CB-CD1 4.23Å; L314-I353 HydrophobicContact CD2-CD1 3.95Å; L314-I353 HydrophobicContact CD2-CG1 4.24Å; L314-I353 HydrophobicContact CD2-CG2 4.46Å; L314-I353 HydrophobicContact CG-CD1 3.75Å; W315-I353 VanDerWaalsContact CA-CD1 3.48Å; W315-I353 HydrophobicContact CB-CD1 3.86Å; M318-I353 HydrophobicContact SD-CD1 4.47Å; V325-I353 HydrophobicContact CG1-CD1 3.54Å; V325-I353 HydrophobicContact CG1-CG1 3.83Å; S326-I353 PolarHBondContact O-N 3.5Å; L327-I353 CarbonylContact C-O 3.55Å; L327-I353 HydrophobicContact CD1-CB 4.08Å; L327-I353 HydrophobicContact CD1-CG2 3.89Å; L328-I353 PolarHBondContact N-O 3.01Å; V351-I353 HydrophobicContact CG1-CG1 4.27Å
354	V	92.5	Very high	79.4	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	149.3	-172.6	69	0	0	0	0	111.8	M302 I303 F304 C305 L328 C358 A359 I362	M302-V354 HydrophobicContact CE-CB 4.2Å; M302-V354 HydrophobicContact CE-CG1 3.64Å; M302-V354 HydrophobicContact CE-CG2 4.37Å; M302-V354 HydrophobicContact CG-CG1 4.04Å; I303-V354 PolarHBondContact O-N 3.46Å; F304-V354 WeakPolarHBondContact CA-O 2.99Å; F304-V354 HydrophobicContact CD1-CG1 3.34Å; F304-V354 HydrophobicContact CE1-CG1 3.3Å; F304-V354 HydrophobicContact CG-CG1 4.2Å; F304-V354 HydrophobicContact CZ-CG1 4.2Å; C305-V354 PolarHBondContact N-O 3.38Å; L328-V354 HydrophobicContact CB-CB 4.39Å; L328-V354 HydrophobicContact CB-CG2 4.08Å; L328-V354 HydrophobicContact CD2-CG2 3.94Å; L328-V354 HydrophobicContact CG-CG2 4.3Å; L328-V354 WeakPolarHBondContact O-CA 3.39Å; V354-C358 HydrophobicContact CG2-CB 3.8Å; V354-A359 HydrophobicContact CG1-CB 4.38Å; V354-A359 HydrophobicContact CG2-CB 4.19Å; V354-I362 HydrophobicContact CG2-CD1 4.45Å
355	T	89.1	Confident	77.9	Confident	9 Å²	9	39.9 Å²	39.9	6%	0.055	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	151.5	168.3	57	0	0	0	0	110.8	C305 R308 A311 L328 T329 V357 C358 A359	C305-T355 WeakPolarHBondContact O-CA 3.33Å; R308-T355 HydrophobicContact CG-CG2 4.28Å; A311-T355 HydrophobicContact CB-CG2 4.21Å; L328-T355 PolarHBondContact O-N 3.3Å; T329-T355 HydrophobicContact CG2-CG2 4.19Å; T355-V357 PolarHBondContact O-N 3.04Å; T355-C358 PolarHBondContact O-N 2.99Å; T355-A359 PolarHBondContact O-N 3.02Å
356	N	74.6	Confident	77.2	Confident	39 Å²	39	38.9 Å²	38.9	21%	0.209	19%	0.191	C	C	.	.	H	α-helix	trans	-45.5	-41.8	-176.2	-81	-9.2	0	0	0	115	C358 A359 R391	N356-C358 VanDerWaalsContact C-N 3.29Å; N356-C358 PolarHBondContact O-N 3.46Å; N356-A359 WeakPolarHBondContact O-CB 3.34Å; N356-A359 PolarHBondContact O-N 3.47Å; N356-R391 VanDerWaalsContact CG-NH2 3.33Å; N356-R391 PolarHBondContact ND2-NH2 3.32Å; N356-R391 PolarHBondContact OD1-NE 3.43Å; N356-R391 PolarHBondContact OD1-NH2 3.46Å
357	V	66	Low	76.9	Confident	96 Å²	96	31.6 Å²	31.6	58%	0.582	16%	0.163	S	C	*	.	H	α-helix	trans	-63.5	-37.1	-177.2	-178.4	0	0	0	0	111.5	T355	T355-V357 PolarHBondContact O-N 3.04Å
358	C	69	Low	77	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	15%	0.154	C	C	.	.	H	α-helix	trans	-87.5	-15.7	-177.4	-63.9	0	0	0	0	113.4	L328 A330 V354 T355 N356 R360 I362	L328-C358 HydrophobicContact CD2-CB 3.96Å; L328-C358 HydrophobicContact CG-CB 3.85Å; A330-C358 PolarHBondContact N-SG 2.96Å; A330-C358 VanDerWaalsContact N-SG 3.37Å; V354-C358 HydrophobicContact CG2-CB 3.8Å; T355-C358 PolarHBondContact O-N 2.99Å; N356-C358 VanDerWaalsContact C-N 3.29Å; N356-C358 PolarHBondContact O-N 3.46Å; C358-R360 VanDerWaalsContact C-N 3.3Å; C358-R360 PolarHBondContact O-N 3.28Å; C358-I362 WeakPolarHBondContact O-CD1 3.19Å
359	A	64.6	Low	77.1	Confident	8 Å²	8	25.6 Å²	25.6	7%	0.066	13%	0.128	C	C	.	.	H	α-helix	trans	-66.6	-27.2	-176.2	0	0	0	0	0	114.8	F304 V354 T355 N356	F304-A359 HydrophobicContact CD1-CB 4.07Å; F304-A359 HydrophobicContact CE1-CB 3.43Å; F304-A359 VanDerWaalsContact CE1-CB 3.43Å; F304-A359 HydrophobicContact CZ-CB 4.44Å; V354-A359 HydrophobicContact CG1-CB 4.38Å; V354-A359 HydrophobicContact CG2-CB 4.19Å; T355-A359 PolarHBondContact O-N 3.02Å; N356-A359 WeakPolarHBondContact O-CB 3.34Å; N356-A359 PolarHBondContact O-N 3.47Å
360	R	66.6	Low	77.1	Confident	31 Å²	31	25 Å²	25	12%	0.117	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	144.1	-171	-65.6	-163.4	179.2	104.4	-5.3	111.7	E211 C358 I362	E211-R360 VanDerWaalsContact CD-CD 3.48Å; E211-R360 VanDerWaalsContact CD-CZ 3.43Å; E211-R360 IonicContact OE1-CZ 3.78Å; E211-R360 IonicContact OE1-NH1 3.79Å; E211-R360 PolarHBondContact OE1-NH1 2.93Å; E211-R360 WeakPolarHBondContact OE2-CD 3.26Å; E211-R360 IonicContact OE2-CZ 2.8Å; E211-R360 IonicContact OE2-NE 3.3Å; E211-R360 PolarHBondContact OE2-NE 3.34Å; E211-R360 VanDerWaalsContact OE2-NE 3.12Å; E211-R360 IonicContact OE2-NH1 3.01Å; E211-R360 PolarHBondContact OE2-NH1 3.29Å; E211-R360 IonicContact OE2-NH2 3Å; E211-R360 PolarHBondContact OE2-NH2 3.4Å; C358-R360 VanDerWaalsContact C-N 3.3Å; C358-R360 PolarHBondContact O-N 3.28Å; R360-I362 PolarHBondContact O-N 3.09Å
361	G	58.6	Low	77.4	Confident	3 Å²	3	19.6 Å²	19.6	3%	0.031	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	2	-176	0	0	0	0	0	116.8	Q139 E208 D363	Q139-G361 PolarHBondContact OE1-O 2.92Å; Q139-G361 VanDerWaalsContact OE1-O 3.12Å; E208-G361 VanDerWaalsContact OE1-CA 3.31Å; E208-G361 WeakPolarHBondContact OE1-CA 3.31Å; E208-G361 PolarHBondContact OE1-N 2.91Å; G361-D363 PolarHBondContact O-N 2.75Å
362	I	67.2	Low	77.5	Confident	6 Å²	6	19.5 Å²	19.5	3%	0.031	10%	0.104	C	C	.	.			trans	-80.1	111.8	177.5	-51.6	172.7	0	0	0	109.9	M302 L328 L341 L352 V354 C358 R360 V364 R394	M302-I362 HydrophobicContact CE-CD1 3.69Å; L328-I362 HydrophobicContact CD2-CD1 3.4Å; L328-I362 HydrophobicContact CD2-CG1 4.49Å; L341-I362 HydrophobicContact CD2-CD1 4.02Å; L341-I362 HydrophobicContact CD2-CG1 4.29Å; L341-I362 HydrophobicContact CD2-CG2 3.58Å; L352-I362 HydrophobicContact CD2-CD1 4.48Å; V354-I362 HydrophobicContact CG2-CD1 4.45Å; C358-I362 WeakPolarHBondContact O-CD1 3.19Å; R360-I362 PolarHBondContact O-N 3.09Å; I362-V364 HydrophobicContact CB-CG2 4.5Å; I362-V364 HydrophobicContact CG2-CG2 3.35Å; I362-R394 PolarHBondContact O-NH1 3.02Å
363	D	65.6	Low	77.7	Confident	44 Å²	44	19.7 Å²	19.7	24%	0.235	11%	0.105	C	C	.	.			trans	-92.5	107.8	165.9	-172.1	28.5	0	0	0	110.7	Q139 R345 G361 R397	Q139-D363 VanDerWaalsContact CD-CB 3.48Å; R345-D363 PolarHBondContact NH2-O 2.76Å; G361-D363 PolarHBondContact O-N 2.75Å; D363-R397 IonicContact OD1-CZ 3.27Å; D363-R397 IonicContact OD1-NH1 3.99Å; D363-R397 PolarHBondContact OD1-NH1 3.09Å
364	V	67.3	Low	77.6	Confident	7 Å²	7	20.5 Å²	20.5	4%	0.042	11%	0.109	C	C	.	.			trans	-113.7	107	174.7	-166.5	0	0	0	0	107.5	F344 I362	F344-V364 HydrophobicContact CD1-CB 4.27Å; F344-V364 HydrophobicContact CD1-CG1 3.47Å; F344-V364 VanDerWaalsContact CD1-CG1 3.47Å; F344-V364 HydrophobicContact CD1-CG2 3.85Å; F344-V364 HydrophobicContact CE1-CB 3.92Å; F344-V364 HydrophobicContact CE1-CG1 3.24Å; F344-V364 HydrophobicContact CE1-CG2 3.72Å; F344-V364 HydrophobicContact CZ-CG1 4.19Å; I362-V364 HydrophobicContact CB-CG2 4.5Å; I362-V364 HydrophobicContact CG2-CG2 3.35Å
365	P	57.9	Low	77.6	Confident	37 Å²	37	20.5 Å²	20.5	24%	0.24	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	144	170	29.2	-32.4	0	0	0	108.9	Q300	Q300-P365 PolarHBondContact OE1-O 3.13Å
366	Y	65.8	Low	77.7	Confident	89 Å²	89	20.1 Å²	20.1	35%	0.349	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	79	21.2	174.8	-41.3	-65.6	0	0	0	118.5	I26 L27 N368 M400	I26-Y366 HydrophobicContact CG2-CD1 4.38Å; I26-Y366 HydrophobicContact CG2-CE1 3.75Å; L27-Y366 VanDerWaalsContact CD2-OH 3.31Å; L27-Y366 WeakPolarHBondContact CD2-OH 3.42Å; Y366-N368 PolarHBondContact O-N 3.12Å; Y366-M400 HydrophobicContact CD1-SD 4.27Å
367	L	78.3	Confident	78.5	Confident	9 Å²	9	20.7 Å²	20.7	5%	0.047	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	109.4	171.9	-164	77.4	0	0	0	111.5	Q300 M302 F344 V370 R394 S395	Q300-L367 HydrophobicContact CB-CD1 4.28Å; Q300-L367 WeakPolarHBondContact O-CD1 3.5Å; M302-L367 HydrophobicContact CB-CD1 3.67Å; M302-L367 HydrophobicContact CB-CD2 3.77Å; M302-L367 HydrophobicContact CB-CG 4.37Å; M302-L367 HydrophobicContact SD-CD2 4.41Å; F344-L367 HydrophobicContact CE1-CD1 4.37Å; F344-L367 HydrophobicContact CZ-CD1 3.93Å; L367-V370 HydrophobicContact CD2-CG2 3.42Å; L367-V370 VanDerWaalsContact CD2-CG2 3.42Å; L367-V370 HydrophobicContact CG-CG2 4.37Å; L367-R394 HydrophobicContact CD2-CB 3.45Å; L367-R394 VanDerWaalsContact CD2-CB 3.45Å; L367-S395 VanDerWaalsContact O-CA 3.27Å; L367-S395 WeakPolarHBondContact O-CA 3.32Å; L367-S395 VanDerWaalsContact O-CB 3.22Å; L367-S395 WeakPolarHBondContact O-CB 3.49Å
368	N	84.3	Confident	79.5	Confident	27 Å²	27	19.8 Å²	19.8	14%	0.144	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-18.1	176.1	72.3	-30.5	0	0	0	113.4	I297 G299 Q300 Y366 G402 V403	I297-N368 PolarHBondContact O-ND2 2.94Å; G299-N368 PolarHBondContact N-ND2 3.31Å; G299-N368 PolarHBondContact N-OD1 2.74Å; Q300-N368 PolarHBondContact N-OD1 2.82Å; Q300-N368 PolarHBondContact O-N 3.34Å; Q300-N368 PolarHBondContact O-OD1 3.37Å; Q300-N368 VanDerWaalsContact O-OD1 3.13Å; Y366-N368 PolarHBondContact O-N 3.12Å; N368-G402 WeakPolarHBondContact O-CA 3.21Å; N368-V403 PolarHBondContact O-N 3.03Å
369	L	89.9	Confident	80.2	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126	178.2	-178.1	61.9	0	0	0	112.4	V292 V298 Q300 C301 M302 V371 V403 L405	V292-L369 HydrophobicContact CG1-CD2 3.68Å; V298-L369 HydrophobicContact CG1-CB 4.17Å; V298-L369 HydrophobicContact CG1-CD2 4.09Å; V298-L369 HydrophobicContact CG2-CD2 4.04Å; Q300-L369 PolarHBondContact O-N 3.04Å; C301-L369 WeakPolarHBondContact CA-O 3.4Å; C301-L369 HydrophobicContact CB-CB 4.3Å; C301-L369 HydrophobicContact CB-CD2 4.32Å; M302-L369 PolarHBondContact N-O 3Å; L369-V371 HydrophobicContact CD1-CG2 4.24Å; L369-V371 HydrophobicContact CD2-CG2 4.11Å; L369-V371 HydrophobicContact CG-CG2 3.95Å; L369-V403 WeakPolarHBondContact CA-O 3.41Å; L369-V403 HydrophobicContact CD1-CB 3.94Å; L369-V403 HydrophobicContact CD1-CG1 4Å; L369-L405 HydrophobicContact CD1-CD1 4Å; L369-L405 HydrophobicContact CD1-CG 4.02Å
370	V	91.7	Very high	81.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	128	167.9	169.4	0	0	0	0	108.5	F304 L367 R391 R394 V403 A404 L405	F304-V370 HydrophobicContact CD2-CG1 3.92Å; F304-V370 HydrophobicContact CE2-CG1 3.7Å; L367-V370 HydrophobicContact CD2-CG2 3.42Å; L367-V370 VanDerWaalsContact CD2-CG2 3.42Å; L367-V370 HydrophobicContact CG-CG2 4.37Å; V370-R391 WeakPolarHBondContact CG2-O 3.39Å; V370-R394 HydrophobicContact CG2-CB 4.41Å; V370-V403 PolarHBondContact N-O 3.37Å; V370-A404 CarbonylContact O-C 3.56Å; V370-A404 WeakPolarHBondContact O-CA 3.31Å; V370-L405 PolarHBondContact O-N 3.11Å
371	V	95.1	Very high	82.4	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.012	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	112.1	174.6	-176.5	0	0	0	0	109.5	I289 M302 I303 F304 L369 Y373 L405 F407	I289-V371 HydrophobicContact CG1-CG1 4.43Å; M302-V371 PolarHBondContact O-N 3.4Å; I303-V371 CarbonylContact C-O 3.6Å; I303-V371 WeakPolarHBondContact CA-O 3.32Å; I303-V371 HydrophobicContact CB-CB 4.42Å; I303-V371 HydrophobicContact CG1-CB 4.12Å; I303-V371 HydrophobicContact CG1-CG2 4.43Å; I303-V371 HydrophobicContact CG2-CB 4.1Å; I303-V371 HydrophobicContact CG2-CG1 4.2Å; F304-V371 PolarHBondContact N-O 3.33Å; L369-V371 HydrophobicContact CD1-CG2 4.24Å; L369-V371 HydrophobicContact CD2-CG2 4.11Å; L369-V371 HydrophobicContact CG-CG2 3.95Å; V371-Y373 VanDerWaalsContact C-N 3.3Å; V371-Y373 PolarHBondContact O-N 3.1Å; V371-Y373 VanDerWaalsContact O-N 3.07Å; V371-L405 CarbonylContact C-O 3.56Å; V371-L405 WeakPolarHBondContact CA-O 3.49Å; V371-L405 HydrophobicContact CG2-CB 4.5Å; V371-F407 HydrophobicContact CG1-CD2 4.11Å; V371-F407 HydrophobicContact CG1-CE1 4.42Å; V371-F407 HydrophobicContact CG1-CE2 3.52Å; V371-F407 HydrophobicContact CG1-CZ 3.69Å
372	N	95.7	Very high	84	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	84	163.9	-64.9	-53	0	0	0	108.3	D374 Y388 R391 L405 T406 F407	N372-D374 PolarHBondContact O-N 3.35Å; N372-Y388 WeakPolarHBondContact ND2-CE2 3.48Å; N372-R391 WeakPolarHBondContact OD1-CD 3.43Å; N372-R391 PolarHBondContact OD1-NH1 3.1Å; N372-L405 PolarHBondContact N-O 3.18Å; N372-T406 HydrophobicContact CB-CG2 3.97Å; N372-T406 PolarHBondContact ND2-OG1 3.04Å; N372-F407 PolarHBondContact O-N 2.66Å
373	Y	96.4	Very high	85.1	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.016	20%	0.203	C	C	.	.	S	Bend	trans	-60.8	-37.8	176.8	-170.4	-91.6	0	0	0	111.2	D282 K285 I289 I303 F304 S310 L314 V371 F407	D282-Y373 WeakPolarHBondContact CA-OH 3.31Å; D282-Y373 WeakPolarHBondContact CB-OH 3.31Å; D282-Y373 PolarHBondContact O-OH 2.95Å; K285-Y373 HydrophobicContact CB-CD2 4.16Å; K285-Y373 HydrophobicContact CB-CE2 3.44Å; K285-Y373 VanDerWaalsContact CB-CE2 3.44Å; K285-Y373 HydrophobicContact CD-CD1 4.13Å; K285-Y373 HydrophobicContact CD-CD2 4.2Å; K285-Y373 HydrophobicContact CD-CE1 3.76Å; K285-Y373 HydrophobicContact CD-CE2 3.86Å; K285-Y373 HydrophobicContact CD-CG 4.33Å; K285-Y373 VanDerWaalsContact CE-O 3.23Å; K285-Y373 WeakPolarHBondContact CE-O 3.12Å; K285-Y373 HydrophobicContact CG-CE2 4.31Å; K285-Y373 PolarHBondContact NZ-O 3.29Å; I289-Y373 HydrophobicContact CD1-CD2 3.92Å; I289-Y373 HydrophobicContact CD1-CE2 4.1Å; I303-Y373 HydrophobicContact CG2-CD2 4.44Å; I303-Y373 HydrophobicContact CG2-CG 4.4Å; F304-Y373 WeakPolarHBondContact O-CB 3.11Å; F304-Y373 PolarHBondContact O-N 3.07Å; F304-Y373 VanDerWaalsContact O-N 3.1Å; S310-Y373 WeakPolarHBondContact OG-CE1 3.32Å; L314-Y373 HydrophobicContact CD1-CE2 4.06Å; L314-Y373 HydrophobicContact CD2-CD2 3.89Å; L314-Y373 HydrophobicContact CD2-CE2 4.15Å; L314-Y373 HydrophobicContact CD2-CG 4.23Å; V371-Y373 VanDerWaalsContact C-N 3.3Å; V371-Y373 PolarHBondContact O-N 3.1Å; V371-Y373 VanDerWaalsContact O-N 3.07Å; Y373-F407 AromaticContact CD2-CD2 3.97Å; Y373-F407 HydrophobicContact CD2-CD2 3.97Å; Y373-F407 HydrophobicContact CD2-CE2 4.08Å
374	D	94.1	Very high	86.2	Confident	16 Å²	16	39.8 Å²	39.8	9%	0.086	20%	0.198	C	C	.	.	S	Bend	trans	-120.7	134.8	166.8	-60.3	-46.8	0	0	0	110.5	K285 F304 R306 N372 R391	K285-D374 IonicContact NZ-OD1 3.44Å; K285-D374 PolarHBondContact NZ-OD1 2.93Å; K285-D374 VanDerWaalsContact NZ-OD1 3.13Å; F304-D374 PolarHBondContact O-N 2.86Å; R306-D374 HydrophobicContact CB-CB 3.64Å; R306-D374 WeakPolarHBondContact CB-OD2 3.25Å; R306-D374 PolarHBondContact N-OD2 3.34Å; N372-D374 PolarHBondContact O-N 3.35Å; D374-R391 PolarHBondContact O-NH1 2.78Å
375	L	92.7	Very high	87.1	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.207	C	C	.	.			trans	-58.8	133.8	177.1	-163	68.2	0	0	0	111	R306 I377 T406 E413 I416 V417 I420	R306-L375 PolarHBondContact NH2-O 3.02Å; L375-I377 HydrophobicContact CB-CG2 4.36Å; L375-I377 HydrophobicContact CD2-CG2 4.27Å; L375-I377 HydrophobicContact CG-CG2 4.28Å; L375-I377 PolarHBondContact O-N 3.16Å; L375-T406 HydrophobicContact CD1-CG2 3.33Å; L375-E413 HydrophobicContact CD2-CB 4.07Å; L375-E413 HydrophobicContact CD2-CG 4.27Å; L375-I416 HydrophobicContact CD2-CB 3.55Å; L375-I416 HydrophobicContact CD2-CD1 4.12Å; L375-I416 HydrophobicContact CD2-CG1 4.44Å; L375-I416 HydrophobicContact CD2-CG2 3.34Å; L375-I416 HydrophobicContact CG-CG2 4.12Å; L375-V417 HydrophobicContact CD1-CG2 3.64Å; L375-V417 HydrophobicContact CD2-CG2 4.37Å; L375-I420 HydrophobicContact CD1-CD1 4.35Å
376	P	90.2	Very high	88.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.205	C	C	.	.			trans	-71.9	110.9	174.6	28.7	-28.9	0	0	0	109.2	D384 Y388	P376-D384 HydrophobicContact CB-CB 4.23Å; P376-D384 PolarHBondContact O-N 2.58Å; P376-Y388 HydrophobicContact CG-CD2 3.85Å; P376-Y388 HydrophobicContact CG-CG 4.28Å
377	I	91	Very high	89.1	Confident	52 Å²	52	38.7 Å²	38.7	27%	0.267	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-126.1	147.3	-179	61.9	172.5	0	0	0	110.6	R306 L375 T382 I416	R306-I377 VanDerWaalsContact CZ-CD1 3.45Å; L375-I377 HydrophobicContact CB-CG2 4.36Å; L375-I377 HydrophobicContact CD2-CG2 4.27Å; L375-I377 HydrophobicContact CG-CG2 4.28Å; L375-I377 PolarHBondContact O-N 3.16Å; I377-T382 CarbonylContact C-O 3.59Å; I377-T382 VanDerWaalsContact CA-O 3.25Å; I377-T382 WeakPolarHBondContact CA-O 3.4Å; I377-T382 WeakPolarHBondContact CB-O 3.39Å; I377-I416 HydrophobicContact CG2-CD1 4Å; I377-I416 HydrophobicContact CG2-CG2 4.44Å
378	L	86.9	Confident	89.5	Confident	77 Å²	77	38.2 Å²	38.2	40%	0.403	19%	0.189	S	C	.	.			trans	-76.1	172.5	170.4	-65.4	179.9	0	0	0	110.7	D380 G381 T382 D384	L378-D380 WeakPolarHBondContact CB-OD1 3.38Å; L378-D380 PolarHBondContact O-N 3.26Å; L378-G381 PolarHBondContact O-N 2.77Å; L378-G381 VanDerWaalsContact O-N 3.07Å; L378-T382 PolarHBondContact N-O 2.9Å; L378-D384 HydrophobicContact CD2-CB 3.78Å; L378-D384 HydrophobicContact CG-CB 3.93Å
379	R	84.3	Confident	89.4	Confident	267 Å²	267	37.4 Å²	37.4	100%	1.008	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-25.8	-176.3	-68.8	-174.6	180	-165	0.5	113.7	G381	R379-G381 VanDerWaalsContact C-N 3.28Å
380	D	88.9	Confident	88.8	Confident	119 Å²	119	37.9 Å²	37.9	64%	0.636	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.4	175.6	56.9	3.6	0	0	0	113	L378 T382	L378-D380 WeakPolarHBondContact CB-OD1 3.38Å; L378-D380 PolarHBondContact O-N 3.26Å; D380-T382 PolarHBondContact OD1-N 2.85Å; D380-T382 VanDerWaalsContact OD1-N 3.16Å; D380-T382 PolarHBondContact OD1-OG1 3.36Å; D380-T382 VanDerWaalsContact OD1-OG1 3.07Å
381	G	88.2	Confident	88.5	Confident	34 Å²	34	38.2 Å²	38.2	35%	0.351	19%	0.188	S	C	.	.	S	Bend	trans	89.2	2.9	178.4	0	0	0	0	0	114.7	L378 R379 I416	L378-G381 PolarHBondContact O-N 2.77Å; L378-G381 VanDerWaalsContact O-N 3.07Å; R379-G381 VanDerWaalsContact C-N 3.28Å; G381-I416 WeakPolarHBondContact O-CD1 3.46Å
382	T	91.9	Very high	88	Confident	67 Å²	67	38.2 Å²	38.2	41%	0.411	19%	0.187	S	C	.	.	S	Bend	trans	-81.1	169.1	174.2	69.1	0	0	0	0	111.5	I377 L378 D380 D384	I377-T382 CarbonylContact C-O 3.59Å; I377-T382 VanDerWaalsContact CA-O 3.25Å; I377-T382 WeakPolarHBondContact CA-O 3.4Å; I377-T382 WeakPolarHBondContact CB-O 3.39Å; L378-T382 PolarHBondContact N-O 2.9Å; D380-T382 PolarHBondContact OD1-N 2.85Å; D380-T382 VanDerWaalsContact OD1-N 3.16Å; D380-T382 PolarHBondContact OD1-OG1 3.36Å; D380-T382 VanDerWaalsContact OD1-OG1 3.07Å; T382-D384 PolarHBondContact O-N 2.86Å
383	A	90.7	Very high	87	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.008	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-57.7	135.3	174.2	0	0	0	0	0	111.5	F385 I416 I420	A383-F385 HydrophobicContact CB-CD1 3.84Å; A383-F385 HydrophobicContact CB-CD2 4.43Å; A383-F385 HydrophobicContact CB-CE1 3.5Å; A383-F385 VanDerWaalsContact CB-CE1 3.5Å; A383-F385 HydrophobicContact CB-CE2 4.15Å; A383-F385 HydrophobicContact CB-CG 4.28Å; A383-F385 HydrophobicContact CB-CZ 3.68Å; A383-F385 PolarHBondContact O-N 2.99Å; A383-I416 HydrophobicContact CB-CG2 3.68Å; A383-I420 HydrophobicContact CB-CD1 4.18Å; A383-I420 HydrophobicContact CB-CG1 3.71Å
384	D	89.2	Confident	85.8	Confident	25 Å²	25	39 Å²	39	13%	0.134	19%	0.192	C	C	.	.			trans	-93.2	83.5	161.2	-176.2	-13.5	0	0	0	108.2	P376 L378 T382 Y386 S387 Y388	P376-D384 HydrophobicContact CB-CB 4.23Å; P376-D384 PolarHBondContact O-N 2.58Å; L378-D384 HydrophobicContact CD2-CB 3.78Å; L378-D384 HydrophobicContact CG-CB 3.93Å; T382-D384 PolarHBondContact O-N 2.86Å; D384-Y386 VanDerWaalsContact C-N 3.26Å; D384-Y386 PolarHBondContact O-N 3.17Å; D384-S387 PolarHBondContact O-N 3.44Å; D384-S387 WeakPolarHBondContact OD1-CB 3.35Å; D384-S387 PolarHBondContact OD1-N 3.14Å; D384-S387 PolarHBondContact OD1-OG 2.93Å; D384-S387 WeakPolarHBondContact OD2-CB 3.35Å; D384-S387 PolarHBondContact OD2-OG 3.44Å; D384-Y388 PolarHBondContact O-N 3.47Å
385	F	86.9	Confident	84.6	Confident	52 Å²	52	38.2 Å²	38.2	23%	0.228	19%	0.188	C	C	.	.	H	α-helix	trans	-54.9	-42.2	-176.3	-58.2	-70.7	0	0	0	112	A383 Y388 L389 S419 I420 H423 F424	A383-F385 HydrophobicContact CB-CD1 3.84Å; A383-F385 HydrophobicContact CB-CD2 4.43Å; A383-F385 HydrophobicContact CB-CE1 3.5Å; A383-F385 VanDerWaalsContact CB-CE1 3.5Å; A383-F385 HydrophobicContact CB-CE2 4.15Å; A383-F385 HydrophobicContact CB-CG 4.28Å; A383-F385 HydrophobicContact CB-CZ 3.68Å; A383-F385 PolarHBondContact O-N 2.99Å; F385-Y388 WeakPolarHBondContact O-CB 3.34Å; F385-Y388 PolarHBondContact O-N 2.88Å; F385-L389 PolarHBondContact O-N 3.4Å; F385-S419 WeakPolarHBondContact CE1-O 3.31Å; F385-I420 HydrophobicContact CD1-CB 4.43Å; F385-I420 HydrophobicContact CD1-CG1 3.92Å; F385-I420 HydrophobicContact CE1-CG1 4.08Å; F385-H423 HydrophobicContact CD1-CB 3.7Å; F385-H423 AromaticContact CD1-CD2 3.7Å; F385-H423 AromaticContact CD1-CG 3.73Å; F385-H423 HydrophobicContact CE1-CB 3.64Å; F385-H423 HydrophobicContact CG-CB 4.43Å; F385-H423 AromaticContact CG-CD2 3.68Å; F385-H423 AromaticContact CG-CG 3.97Å; F385-H423 HydrophobicContact CZ-CB 4.31Å; F385-F424 HydrophobicContact CB-CE2 4.17Å; F385-F424 HydrophobicContact CB-CZ 3.97Å; F385-F424 WeakPolarHBondContact O-CZ 3.49Å
386	Y	80.3	Confident	83	Confident	51 Å²	51	38.4 Å²	38.4	20%	0.2	19%	0.19	C	C	.	.	H	α-helix	trans	-71.3	-43.1	-176.6	-58.4	-53	0	0	0	112.2	T241 D243 D384 Y388 L389 H390	T241-Y386 HydrophobicContact CG2-CD1 3.19Å; T241-Y386 HydrophobicContact CG2-CE1 3.92Å; T241-Y386 HydrophobicContact CG2-CG 3.84Å; D243-Y386 WeakPolarHBondContact CA-OH 3.41Å; D243-Y386 HydrophobicContact CB-CE2 3.59Å; D243-Y386 VanDerWaalsContact CB-OH 3.25Å; D243-Y386 WeakPolarHBondContact CB-OH 3.39Å; D384-Y386 VanDerWaalsContact C-N 3.26Å; D384-Y386 PolarHBondContact O-N 3.17Å; Y386-Y388 VanDerWaalsContact C-N 3.3Å; Y386-Y388 PolarHBondContact O-N 3.24Å; Y386-L389 PolarHBondContact O-N 3.5Å; Y386-H390 WeakPolarHBondContact O-CB 3.23Å; Y386-H390 PolarHBondContact O-CD2 2.9Å; Y386-H390 VanDerWaalsContact O-CG 3.31Å; Y386-H390 PolarHBondContact O-N 3.32Å
387	S	83.6	Confident	81.7	Confident	7 Å²	7	39.9 Å²	39.9	5%	0.049	20%	0.196	C	C	.	.	H	α-helix	trans	-61	-41.2	171.4	-72.3	0	0	0	0	111.4	D384 H390 R391	D384-S387 PolarHBondContact O-N 3.44Å; D384-S387 WeakPolarHBondContact OD1-CB 3.35Å; D384-S387 PolarHBondContact OD1-N 3.14Å; D384-S387 PolarHBondContact OD1-OG 2.93Å; D384-S387 WeakPolarHBondContact OD2-CB 3.35Å; D384-S387 PolarHBondContact OD2-OG 3.44Å; S387-H390 PolarHBondContact O-N 3.22Å; S387-R391 WeakPolarHBondContact O-CB 3.44Å; S387-R391 WeakPolarHBondContact O-CG 3.49Å; S387-R391 PolarHBondContact O-N 3.25Å
388	Y	87.9	Confident	79.9	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-56.9	-52.8	175.6	-174.7	-93.7	0	0	0	111.5	Q274 N372 P376 D384 F385 Y386 H390 R391 I392 I420 F424 I428	Q274-Y388 PolarHBondContact OE1-OH 2.9Å; N372-Y388 WeakPolarHBondContact ND2-CE2 3.48Å; P376-Y388 HydrophobicContact CG-CD2 3.85Å; P376-Y388 HydrophobicContact CG-CG 4.28Å; D384-Y388 PolarHBondContact O-N 3.47Å; F385-Y388 WeakPolarHBondContact O-CB 3.34Å; F385-Y388 PolarHBondContact O-N 2.88Å; Y386-Y388 VanDerWaalsContact C-N 3.3Å; Y386-Y388 PolarHBondContact O-N 3.24Å; Y388-H390 VanDerWaalsContact C-N 3.29Å; Y388-H390 PolarHBondContact O-N 2.9Å; Y388-R391 WeakPolarHBondContact O-CB 3.44Å; Y388-R391 PolarHBondContact O-N 3.18Å; Y388-R391 VanDerWaalsContact O-N 3.13Å; Y388-I392 HydrophobicContact CD1-CD1 4.17Å; Y388-I392 HydrophobicContact CD1-CG2 4.41Å; Y388-I392 HydrophobicContact CE1-CD1 3.74Å; Y388-I392 HydrophobicContact CE1-CG1 4.39Å; Y388-I392 HydrophobicContact CE1-CG2 3.98Å; Y388-I392 HydrophobicContact CE2-CG2 4.37Å; Y388-I392 PolarHBondContact O-N 3.16Å; Y388-I420 HydrophobicContact CD1-CG2 3.42Å; Y388-I420 VanDerWaalsContact CD1-CG2 3.42Å; Y388-I420 HydrophobicContact CD2-CD1 3.9Å; Y388-I420 HydrophobicContact CD2-CG2 4.29Å; Y388-I420 HydrophobicContact CE1-CG2 3.58Å; Y388-I420 HydrophobicContact CE2-CD1 4.42Å; Y388-I420 HydrophobicContact CE2-CG2 4.42Å; Y388-I420 HydrophobicContact CG-CD1 4.1Å; Y388-I420 HydrophobicContact CG-CG2 3.8Å; Y388-F424 HydrophobicContact CD1-CE2 4.26Å; Y388-I428 HydrophobicContact CE1-CD1 4.2Å; Y388-I428 WeakPolarHBondContact OH-CD1 3.47Å
389	L	81.7	Confident	78.5	Confident	9 Å²	9	40.8 Å²	40.8	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-42.1	178.1	-173.5	67	0	0	0	111.9	T241 L267 F385 Y386 R391 G393 F424	T241-L389 HydrophobicContact CG2-CD2 4.28Å; L267-L389 HydrophobicContact CB-CD2 4.01Å; L267-L389 HydrophobicContact CD1-CD2 4.45Å; L267-L389 WeakPolarHBondContact O-CD1 3.48Å; F385-L389 PolarHBondContact O-N 3.4Å; Y386-L389 PolarHBondContact O-N 3.5Å; L389-R391 VanDerWaalsContact C-N 3.32Å; L389-R391 PolarHBondContact O-N 3.24Å; L389-G393 VanDerWaalsContact O-CA 3.31Å; L389-G393 WeakPolarHBondContact O-CA 3.17Å; L389-G393 PolarHBondContact O-N 3.14Å; L389-F424 HydrophobicContact CB-CE1 4.32Å; L389-F424 HydrophobicContact CB-CE2 4.45Å; L389-F424 HydrophobicContact CB-CZ 3.81Å; L389-F424 HydrophobicContact CD1-CE1 4.21Å; L389-F424 HydrophobicContact CD1-CZ 4.36Å; L389-F424 HydrophobicContact CD2-CE1 4.07Å; L389-F424 HydrophobicContact CD2-CZ 4.36Å; L389-F424 HydrophobicContact CG-CE1 4.44Å; L389-F424 HydrophobicContact CG-CZ 4.4Å
390	H	76.9	Confident	77.5	Confident	12 Å²	12	31.4 Å²	31.4	6%	0.056	18%	0.178	C	C	.	.	H	α-helix	trans	-67.2	-32.9	179.7	-77.9	-155.5	0	0	0	113.4	D210 A240 T241 Y386 S387 Y388 R394	D210-H390 IonicContact OD2-CE1 3.56Å; D210-H390 PolarHBondContact OD2-CE1 2.81Å; D210-H390 IonicContact OD2-NE2 3.41Å; A240-H390 VanDerWaalsContact CB-NE2 3.26Å; A240-H390 WeakPolarHBondContact CB-NE2 3.41Å; T241-H390 WeakPolarHBondContact CG2-NE2 3.39Å; Y386-H390 WeakPolarHBondContact O-CB 3.23Å; Y386-H390 PolarHBondContact O-CD2 2.9Å; Y386-H390 VanDerWaalsContact O-CG 3.31Å; Y386-H390 PolarHBondContact O-N 3.32Å; S387-H390 PolarHBondContact O-N 3.22Å; Y388-H390 VanDerWaalsContact C-N 3.29Å; Y388-H390 PolarHBondContact O-N 2.9Å; H390-R394 WeakPolarHBondContact O-CG 3.22Å; H390-R394 PolarHBondContact O-NE 3.3Å; H390-R394 VanDerWaalsContact O-NE 3.11Å
391	R	85.8	Confident	76.8	Confident	6 Å²	6	28.7 Å²	28.7	2%	0.023	17%	0.168	C	C	.	.	H	α-helix	trans	-72.9	-51.6	178.8	-72.6	177.9	-177.9	-170.7	1.1	110.8	F304 N356 V370 N372 D374 S387 Y388 L389 G393 R394	F304-R391 HydrophobicContact CD1-CG 3.75Å; F304-R391 HydrophobicContact CD2-CB 3.75Å; F304-R391 HydrophobicContact CD2-CG 3.68Å; F304-R391 HydrophobicContact CE1-CB 4.48Å; F304-R391 HydrophobicContact CE1-CG 3.82Å; F304-R391 HydrophobicContact CE2-CB 3.51Å; F304-R391 HydrophobicContact CE2-CG 3.69Å; F304-R391 HydrophobicContact CG-CB 4.31Å; F304-R391 HydrophobicContact CG-CG 3.7Å; F304-R391 HydrophobicContact CZ-CB 3.91Å; F304-R391 HydrophobicContact CZ-CG 3.77Å; N356-R391 VanDerWaalsContact CG-NH2 3.33Å; N356-R391 PolarHBondContact ND2-NH2 3.32Å; N356-R391 PolarHBondContact OD1-NE 3.43Å; N356-R391 PolarHBondContact OD1-NH2 3.46Å; V370-R391 WeakPolarHBondContact CG2-O 3.39Å; N372-R391 WeakPolarHBondContact OD1-CD 3.43Å; N372-R391 PolarHBondContact OD1-NH1 3.1Å; D374-R391 PolarHBondContact O-NH1 2.78Å; S387-R391 WeakPolarHBondContact O-CB 3.44Å; S387-R391 WeakPolarHBondContact O-CG 3.49Å; S387-R391 PolarHBondContact O-N 3.25Å; Y388-R391 WeakPolarHBondContact O-CB 3.44Å; Y388-R391 PolarHBondContact O-N 3.18Å; Y388-R391 VanDerWaalsContact O-N 3.13Å; L389-R391 VanDerWaalsContact C-N 3.32Å; L389-R391 PolarHBondContact O-N 3.24Å; R391-G393 PolarHBondContact O-N 3Å; R391-R394 WeakPolarHBondContact O-CB 3.37Å; R391-R394 WeakPolarHBondContact O-CG 3.46Å; R391-R394 PolarHBondContact O-N 3.14Å
392	I	83.9	Confident	76.5	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-68.7	-28.8	177.6	70.8	166.9	0	0	0	111.3	V272 Q274 Y388 R394 S395 A404	V272-I392 HydrophobicContact CG1-CB 4.46Å; Q274-I392 HydrophobicContact CG-CD1 4.39Å; Y388-I392 HydrophobicContact CD1-CD1 4.17Å; Y388-I392 HydrophobicContact CD1-CG2 4.41Å; Y388-I392 HydrophobicContact CE1-CD1 3.74Å; Y388-I392 HydrophobicContact CE1-CG1 4.39Å; Y388-I392 HydrophobicContact CE1-CG2 3.98Å; Y388-I392 HydrophobicContact CE2-CG2 4.37Å; Y388-I392 PolarHBondContact O-N 3.16Å; I392-R394 PolarHBondContact O-N 3.28Å; I392-S395 PolarHBondContact O-N 3.12Å; I392-S395 PolarHBondContact O-OG 3.39Å; I392-A404 HydrophobicContact CB-CB 4.08Å; I392-A404 HydrophobicContact CG2-CB 3.53Å
393	G	74.9	Confident	76.4	Confident	5 Å²	5	24 Å²	24	5%	0.052	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-6.3	171.1	0	0	0	0	0	116.4	L269 L389 R391 R397	L269-G393 VanDerWaalsContact CD1-CA 3.49Å; L389-G393 VanDerWaalsContact O-CA 3.31Å; L389-G393 WeakPolarHBondContact O-CA 3.17Å; L389-G393 PolarHBondContact O-N 3.14Å; R391-G393 PolarHBondContact O-N 3Å; G393-R397 PolarHBondContact O-NE 3.02Å; G393-R397 PolarHBondContact O-NH2 3.15Å
394	R	72	Confident	76.5	Confident	15 Å²	15	24 Å²	24	6%	0.057	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-29.3	178.1	-56.1	-64.5	157.2	178.9	-3	111.8	M302 F304 I362 L367 V370 H390 R391 I392	M302-R394 HydrophobicContact SD-CB 4.43Å; M302-R394 HydrophobicContact SD-CG 4.23Å; F304-R394 HydrophobicContact CZ-CG 4.4Å; I362-R394 PolarHBondContact O-NH1 3.02Å; L367-R394 HydrophobicContact CD2-CB 3.45Å; L367-R394 VanDerWaalsContact CD2-CB 3.45Å; V370-R394 HydrophobicContact CG2-CB 4.41Å; H390-R394 WeakPolarHBondContact O-CG 3.22Å; H390-R394 PolarHBondContact O-NE 3.3Å; H390-R394 VanDerWaalsContact O-NE 3.11Å; R391-R394 WeakPolarHBondContact O-CB 3.37Å; R391-R394 WeakPolarHBondContact O-CG 3.46Å; R391-R394 PolarHBondContact O-N 3.14Å; I392-R394 PolarHBondContact O-N 3.28Å
395	S	68.7	Low	76.7	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	S	Bend	trans	-93.2	173.1	170.7	60.8	0	0	0	0	110.7	L269 L367 I392 R397	L269-S395 WeakPolarHBondContact CD1-O 3.42Å; L367-S395 VanDerWaalsContact O-CA 3.27Å; L367-S395 WeakPolarHBondContact O-CA 3.32Å; L367-S395 VanDerWaalsContact O-CB 3.22Å; L367-S395 WeakPolarHBondContact O-CB 3.49Å; I392-S395 PolarHBondContact O-N 3.12Å; I392-S395 PolarHBondContact O-OG 3.39Å; S395-R397 VanDerWaalsContact C-N 3.28Å; S395-R397 PolarHBondContact O-N 3.44Å
396	G	59.3	Low	77.2	Confident	5 Å²	5	20.3 Å²	20.3	5%	0.052	12%	0.115	C	C	.	.	S	Bend	trans	75.3	13	173.9	0	0	0	0	0	115.4	M400	G396-M400 CarbonylContact C-O 3.55Å; G396-M400 WeakPolarHBondContact CA-O 3.41Å
397	R	62.2	Low	78	Confident	32 Å²	32	18 Å²	18	12%	0.121	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-78.9	146.9	-176.9	-65.3	-173.5	177.2	-176.3	-0.4	111.1	D363 G393 S395 G399 M400	D363-R397 IonicContact OD1-CZ 3.27Å; D363-R397 IonicContact OD1-NH1 3.99Å; D363-R397 PolarHBondContact OD1-NH1 3.09Å; G393-R397 PolarHBondContact O-NE 3.02Å; G393-R397 PolarHBondContact O-NH2 3.15Å; S395-R397 VanDerWaalsContact C-N 3.28Å; S395-R397 PolarHBondContact O-N 3.44Å; R397-G399 VanDerWaalsContact C-N 3.35Å; R397-G399 PolarHBondContact O-N 3.17Å; R397-M400 PolarHBondContact O-N 2.9Å
398	F	54.4	Low	78.6	Confident	96 Å²	96	17.7 Å²	17.7	42%	0.421	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	60.7	36.2	174	-48.4	-70.3	0	0	0	114.7	L31 M400	L31-F398 HydrophobicContact CD2-CD1 3.93Å; L31-F398 HydrophobicContact CD2-CE1 3.8Å; F398-M400 PolarHBondContact O-N 3.16Å
399	G	56.8	Low	78.9	Confident	52 Å²	52	21.3 Å²	21.3	54%	0.536	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	77.8	1.6	178.2	0	0	0	0	0	114.8	R397	R397-G399 VanDerWaalsContact C-N 3.35Å; R397-G399 PolarHBondContact O-N 3.17Å
400	M	64.1	Low	79.5	Confident	69 Å²	69	24.5 Å²	24.5	34%	0.34	14%	0.138	S	C	.	.			trans	-72.9	143.2	170.7	-65.3	-172.6	63.1	0	0	110.2	N271 Y366 G396 R397 F398	N271-M400 WeakPolarHBondContact CB-O 3.14Å; Y366-M400 HydrophobicContact CD1-SD 4.27Å; G396-M400 CarbonylContact C-O 3.55Å; G396-M400 WeakPolarHBondContact CA-O 3.41Å; R397-M400 PolarHBondContact O-N 2.9Å; F398-M400 PolarHBondContact O-N 3.16Å
401	S	74.3	Confident	80.3	Confident	63 Å²	63	27.7 Å²	27.7	44%	0.441	17%	0.167	S	C	.	.			trans	-71.7	142.7	166.6	-59.4	0	0	0	0	110.3	N271	N271-S401 CarbonylContact O-C 3.56Å; N271-S401 WeakPolarHBondContact O-CA 3.48Å
402	G	81.9	Confident	80.7	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	156.8	174.1	0	0	0	0	0	111.4	N271 V272 F273 N368	N271-G402 PolarHBondContact O-N 2.92Å; V272-G402 CarbonylContact C-O 3.58Å; V272-G402 VanDerWaalsContact CA-O 3.31Å; V272-G402 WeakPolarHBondContact CA-O 3.46Å; F273-G402 PolarHBondContact N-O 3.33Å; N368-G402 WeakPolarHBondContact O-CA 3.21Å
403	V	89.1	Confident	81.2	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.012	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.4	173.5	-176.8	0	0	0	0	109	F273 F275 M296 N368 L369 V370 L405 I439 V443	F273-V403 WeakPolarHBondContact O-CA 3.39Å; F275-V403 HydrophobicContact CD2-CG1 4.01Å; F275-V403 HydrophobicContact CE2-CG1 4.18Å; M296-V403 HydrophobicContact CE-CG2 4.16Å; M296-V403 HydrophobicContact SD-CG2 4.48Å; N368-V403 PolarHBondContact O-N 3.03Å; L369-V403 WeakPolarHBondContact CA-O 3.41Å; L369-V403 HydrophobicContact CD1-CB 3.94Å; L369-V403 HydrophobicContact CD1-CG1 4Å; V370-V403 PolarHBondContact N-O 3.37Å; V403-L405 HydrophobicContact CG1-CD2 3.97Å; V403-L405 HydrophobicContact CG1-CG 4.04Å; V403-I439 HydrophobicContact CG1-CD1 3.89Å; V403-V443 HydrophobicContact CG2-CB 4.25Å; V403-V443 HydrophobicContact CG2-CG1 3.57Å; V403-V443 HydrophobicContact CG2-CG2 3.71Å
404	A	91.9	Very high	82.2	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111.8	171.2	0	0	0	0	0	109.4	V272 F273 Q274 F275 V370 I392	V272-A404 HydrophobicContact CG1-CB 3.72Å; F273-A404 PolarHBondContact O-N 2.88Å; Q274-A404 HydrophobicContact CG-CB 4.22Å; F275-A404 PolarHBondContact N-O 2.98Å; V370-A404 CarbonylContact O-C 3.56Å; V370-A404 WeakPolarHBondContact O-CA 3.31Å; I392-A404 HydrophobicContact CB-CB 4.08Å; I392-A404 HydrophobicContact CG2-CB 3.53Å
405	L	94.9	Very high	83.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.6	175.1	-63.7	-177.6	0	0	0	110.3	F275 V292 L369 V370 V371 N372 V403 F407 L431 L436 I439	F275-L405 HydrophobicContact CB-CD2 3.78Å; F275-L405 HydrophobicContact CD2-CD2 3.99Å; F275-L405 HydrophobicContact CG-CD2 4.31Å; V292-L405 HydrophobicContact CB-CD1 4.41Å; V292-L405 HydrophobicContact CG1-CD1 4.24Å; V292-L405 HydrophobicContact CG2-CD1 3.39Å; L369-L405 HydrophobicContact CD1-CD1 4Å; L369-L405 HydrophobicContact CD1-CG 4.02Å; V370-L405 PolarHBondContact O-N 3.11Å; V371-L405 CarbonylContact C-O 3.56Å; V371-L405 WeakPolarHBondContact CA-O 3.49Å; V371-L405 HydrophobicContact CG2-CB 4.5Å; N372-L405 PolarHBondContact N-O 3.18Å; V403-L405 HydrophobicContact CG1-CD2 3.97Å; V403-L405 HydrophobicContact CG1-CG 4.04Å; L405-F407 HydrophobicContact CB-CE1 4.38Å; L405-L431 HydrophobicContact CD2-CD1 4.43Å; L405-L436 HydrophobicContact CD1-CD1 4.01Å; L405-L436 HydrophobicContact CD2-CD1 4.24Å; L405-I439 HydrophobicContact CD1-CD1 4.41Å; L405-I439 HydrophobicContact CD2-CD1 3.81Å
406	T	96.7	Very high	84.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.6	178.2	-56.9	0	0	0	0	110.9	F275 Y276 V277 N372 L375 V408 V417	F275-T406 PolarHBondContact O-N 3.32Å; Y276-T406 CarbonylContact C-O 3.58Å; Y276-T406 WeakPolarHBondContact CA-O 3.47Å; Y276-T406 WeakPolarHBondContact CB-O 3.37Å; V277-T406 PolarHBondContact N-O 3.01Å; N372-T406 HydrophobicContact CB-CG2 3.97Å; N372-T406 PolarHBondContact ND2-OG1 3.04Å; L375-T406 HydrophobicContact CD1-CG2 3.33Å; T406-V408 HydrophobicContact CG2-CG1 4.49Å; T406-V417 HydrophobicContact CG2-CG2 4.04Å
407	F	97.3	Very high	86.4	Confident	1 Å²	1	37.3 Å²	37.3	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133.6	177.7	-58.9	-25.2	0	0	0	110.8	V277 K285 A288 I289 V371 N372 Y373 L405	V277-F407 HydrophobicContact CB-CD1 3.99Å; V277-F407 HydrophobicContact CB-CE1 4.26Å; V277-F407 HydrophobicContact CG2-CD1 4.43Å; V277-F407 HydrophobicContact CG2-CE1 4.31Å; V277-F407 WeakPolarHBondContact O-CA 3.32Å; K285-F407 HydrophobicContact CB-CD2 3.69Å; K285-F407 HydrophobicContact CB-CE2 4.08Å; K285-F407 HydrophobicContact CB-CG 4.45Å; K285-F407 HydrophobicContact CD-CB 4.07Å; K285-F407 HydrophobicContact CD-CD2 4.03Å; K285-F407 HydrophobicContact CD-CG 4.49Å; K285-F407 HydrophobicContact CG-CB 3.92Å; K285-F407 HydrophobicContact CG-CD2 3.69Å; K285-F407 HydrophobicContact CG-CG 4.05Å; K285-F407 WeakPolarHBondContact O-CE2 3.45Å; A288-F407 HydrophobicContact CB-CE1 3.7Å; A288-F407 HydrophobicContact CB-CE2 4.26Å; A288-F407 HydrophobicContact CB-CZ 3.55Å; I289-F407 HydrophobicContact CD1-CE2 3.97Å; I289-F407 HydrophobicContact CG1-CE2 3.64Å; I289-F407 HydrophobicContact CG1-CZ 3.76Å; V371-F407 HydrophobicContact CG1-CD2 4.11Å; V371-F407 HydrophobicContact CG1-CE1 4.42Å; V371-F407 HydrophobicContact CG1-CE2 3.52Å; V371-F407 HydrophobicContact CG1-CZ 3.69Å; N372-F407 PolarHBondContact O-N 2.66Å; Y373-F407 AromaticContact CD2-CD2 3.97Å; Y373-F407 HydrophobicContact CD2-CD2 3.97Å; Y373-F407 HydrophobicContact CD2-CE2 4.08Å; L405-F407 HydrophobicContact CB-CE1 4.38Å
408	V	96.6	Very high	87.9	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.3	177.6	-62.3	0	0	0	0	109.4	Y276 V277 Q278 C279 T406 E413 V414 V417	Y276-V408 HydrophobicContact CD2-CG2 3.76Å; Y276-V408 HydrophobicContact CE2-CG2 4.36Å; V277-V408 PolarHBondContact O-N 3.41Å; Q278-V408 CarbonylContact C-O 3.5Å; Q278-V408 WeakPolarHBondContact CA-O 3.24Å; Q278-V408 HydrophobicContact CB-CG2 4.42Å; Q278-V408 HydrophobicContact CG-CG2 3.85Å; C279-V408 PolarHBondContact N-O 2.93Å; T406-V408 HydrophobicContact CG2-CG1 4.49Å; V408-E413 WeakPolarHBondContact CA-OE2 3.42Å; V408-E413 HydrophobicContact CB-CB 3.81Å; V408-E413 HydrophobicContact CG1-CB 3.95Å; V408-V414 HydrophobicContact CB-CG2 4.45Å; V408-V414 HydrophobicContact CG2-CG2 3.8Å; V408-V417 HydrophobicContact CG1-CG2 3.55Å
409	Q	93.9	Very high	89.8	Confident	76 Å²	76	37.2 Å²	37.2	36%	0.355	23%	0.227	S	C	.	.			trans	-108.2	-19.5	-174.7	-63	-175.1	-46.3	0	0	114.1	C279 D282 K285 E413	C279-Q409 VanDerWaalsContact O-CA 3.25Å; C279-Q409 WeakPolarHBondContact O-CA 3.34Å; C279-Q409 WeakPolarHBondContact O-CG 3.35Å; D282-Q409 PolarHBondContact OD1-NE2 3.07Å; D282-Q409 VanDerWaalsContact OD1-NE2 3.17Å; K285-Q409 VanDerWaalsContact CE-NE2 3.35Å; Q409-E413 PolarHBondContact N-OE2 3.4Å
410	N	93.5	Very high	91.5	Very high	77 Å²	77	34.7 Å²	34.7	41%	0.412	20%	0.201	S	C	.	.	S	Bend	trans	-149.8	169.5	-174.1	59.9	63.3	0	0	0	111.9	A412 E413 V414	N410-A412 VanDerWaalsContact C-N 3.26Å; N410-A412 PolarHBondContact O-N 3.02Å; N410-A412 WeakPolarHBondContact OD1-CB 3.5Å; N410-A412 PolarHBondContact OD1-N 3.22Å; N410-A412 VanDerWaalsContact OD1-N 3.09Å; N410-E413 PolarHBondContact O-N 3.41Å; N410-E413 PolarHBondContact OD1-N 2.98Å; N410-V414 PolarHBondContact O-N 2.99Å; N410-V414 VanDerWaalsContact O-N 3.15Å
411	A	93.8	Very high	92.8	Very high	79 Å²	79	32.3 Å²	32.3	65%	0.653	19%	0.193	S	C	*	.	H	α-helix	trans	-60	-33.2	-178.6	0	0	0	0	0	113.3	V414 E415	A411-V414 WeakPolarHBondContact O-CB 3.4Å; A411-V414 PolarHBondContact O-N 3.34Å; A411-E415 PolarHBondContact O-N 3.48Å; A411-E415 VanDerWaalsContact O-N 3.07Å
412	A	93.8	Very high	93.7	Very high	64 Å²	64	36.7 Å²	36.7	53%	0.529	21%	0.206	S	C	.	.	H	α-helix	trans	-66.1	-40.8	177.6	0	0	0	0	0	111.5	N410 V414 E415 I416	N410-A412 VanDerWaalsContact C-N 3.26Å; N410-A412 PolarHBondContact O-N 3.02Å; N410-A412 WeakPolarHBondContact OD1-CB 3.5Å; N410-A412 PolarHBondContact OD1-N 3.22Å; N410-A412 VanDerWaalsContact OD1-N 3.09Å; A412-V414 VanDerWaalsContact C-N 3.32Å; A412-V414 PolarHBondContact O-N 2.97Å; A412-E415 PolarHBondContact O-N 2.94Å; A412-I416 WeakPolarHBondContact O-CG1 3.17Å; A412-I416 PolarHBondContact O-N 3.39Å
413	E	95.2	Very high	93.9	Very high	22 Å²	22	39.4 Å²	39.4	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-67.1	-31.8	174.6	-70.3	-172.2	158.4	0	0	112.7	L375 V408 Q409 N410 I416 V417	L375-E413 HydrophobicContact CD2-CB 4.07Å; L375-E413 HydrophobicContact CD2-CG 4.27Å; V408-E413 WeakPolarHBondContact CA-OE2 3.42Å; V408-E413 HydrophobicContact CB-CB 3.81Å; V408-E413 HydrophobicContact CG1-CB 3.95Å; Q409-E413 PolarHBondContact N-OE2 3.4Å; N410-E413 PolarHBondContact O-N 3.41Å; N410-E413 PolarHBondContact OD1-N 2.98Å; E413-I416 PolarHBondContact O-N 3.44Å; E413-V417 PolarHBondContact O-N 3.13Å
414	V	95.7	Very high	93.7	Very high	14 Å²	14	39.8 Å²	39.8	9%	0.085	22%	0.22	C	C	.	.	H	α-helix	trans	-63.2	-43.1	171.4	173.9	0	0	0	0	111.1	Y276 Q278 V408 N410 A411 A412 I416 V417 K418	Y276-V414 HydrophobicContact CE2-CG1 4.39Å; Y276-V414 HydrophobicContact CE2-CG2 4.27Å; Q278-V414 HydrophobicContact CG-CG2 4.37Å; V408-V414 HydrophobicContact CB-CG2 4.45Å; V408-V414 HydrophobicContact CG2-CG2 3.8Å; N410-V414 PolarHBondContact O-N 2.99Å; N410-V414 VanDerWaalsContact O-N 3.15Å; A411-V414 WeakPolarHBondContact O-CB 3.4Å; A411-V414 PolarHBondContact O-N 3.34Å; A412-V414 VanDerWaalsContact C-N 3.32Å; A412-V414 PolarHBondContact O-N 2.97Å; V414-I416 VanDerWaalsContact C-N 3.31Å; V414-I416 PolarHBondContact O-N 3.18Å; V414-V417 PolarHBondContact O-N 3.18Å; V414-K418 WeakPolarHBondContact O-CG 3.35Å; V414-K418 PolarHBondContact O-N 2.84Å
415	E	95.8	Very high	93.3	Very high	108 Å²	108	42.8 Å²	42.8	51%	0.505	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-35.7	175.7	-65.9	-52.6	122.6	0	0	112.2	A411 A412 K418 S419	A411-E415 PolarHBondContact O-N 3.48Å; A411-E415 VanDerWaalsContact O-N 3.07Å; A412-E415 PolarHBondContact O-N 2.94Å; E415-K418 PolarHBondContact O-N 3.26Å; E415-K418 IonicContact OE1-NZ 2.96Å; E415-K418 PolarHBondContact OE1-NZ 3.09Å; E415-K418 IonicContact OE2-NZ 2.66Å; E415-S419 PolarHBondContact O-N 2.83Å
416	I	96	Very high	92.8	Very high	25 Å²	25	44.4 Å²	44.4	13%	0.128	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-44.6	173.4	-63.9	169.2	0	0	0	110.4	L375 I377 G381 A383 A412 E413 V414 K418 S419 I420	L375-I416 HydrophobicContact CD2-CB 3.55Å; L375-I416 HydrophobicContact CD2-CD1 4.12Å; L375-I416 HydrophobicContact CD2-CG1 4.44Å; L375-I416 HydrophobicContact CD2-CG2 3.34Å; L375-I416 HydrophobicContact CG-CG2 4.12Å; I377-I416 HydrophobicContact CG2-CD1 4Å; I377-I416 HydrophobicContact CG2-CG2 4.44Å; G381-I416 WeakPolarHBondContact O-CD1 3.46Å; A383-I416 HydrophobicContact CB-CG2 3.68Å; A412-I416 WeakPolarHBondContact O-CG1 3.17Å; A412-I416 PolarHBondContact O-N 3.39Å; E413-I416 PolarHBondContact O-N 3.44Å; V414-I416 VanDerWaalsContact C-N 3.31Å; V414-I416 PolarHBondContact O-N 3.18Å; I416-K418 VanDerWaalsContact C-N 3.32Å; I416-K418 PolarHBondContact O-N 3.46Å; I416-S419 PolarHBondContact O-N 2.98Å; I416-S419 PolarHBondContact O-OG 2.73Å; I416-I420 HydrophobicContact CG2-CD1 4.34Å; I416-I420 WeakPolarHBondContact O-CG1 3.42Å; I416-I420 PolarHBondContact O-N 2.63Å
417	V	96	Very high	92.4	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.012	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-41.9	175	171	0	0	0	0	111.7	Y276 L375 T406 V408 E413 V414 S419 I420 A421 I428	Y276-V417 HydrophobicContact CD1-CG1 3.8Å; Y276-V417 HydrophobicContact CE1-CG1 4.45Å; Y276-V417 HydrophobicContact CG-CG1 4.05Å; L375-V417 HydrophobicContact CD1-CG2 3.64Å; L375-V417 HydrophobicContact CD2-CG2 4.37Å; T406-V417 HydrophobicContact CG2-CG2 4.04Å; V408-V417 HydrophobicContact CG1-CG2 3.55Å; E413-V417 PolarHBondContact O-N 3.13Å; V414-V417 PolarHBondContact O-N 3.18Å; V417-S419 PolarHBondContact O-N 3.16Å; V417-I420 WeakPolarHBondContact O-CB 3.44Å; V417-I420 PolarHBondContact O-N 2.97Å; V417-A421 PolarHBondContact O-N 3.17Å; V417-I428 HydrophobicContact CG1-CB 3.94Å; V417-I428 HydrophobicContact CG1-CD1 3.92Å; V417-I428 HydrophobicContact CG1-CG2 3.77Å
418	K	95	Very high	92.2	Very high	90 Å²	90	49.4 Å²	49.4	39%	0.391	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-43.3	174.9	-70	175.6	-176.1	168.8	0	112	V414 E415 I416 I420 A421 E422	V414-K418 WeakPolarHBondContact O-CG 3.35Å; V414-K418 PolarHBondContact O-N 2.84Å; E415-K418 PolarHBondContact O-N 3.26Å; E415-K418 IonicContact OE1-NZ 2.96Å; E415-K418 PolarHBondContact OE1-NZ 3.09Å; E415-K418 IonicContact OE2-NZ 2.66Å; I416-K418 VanDerWaalsContact C-N 3.32Å; I416-K418 PolarHBondContact O-N 3.46Å; K418-I420 PolarHBondContact O-N 3.3Å; K418-A421 WeakPolarHBondContact O-CB 3.37Å; K418-A421 PolarHBondContact O-N 3.26Å; K418-A421 VanDerWaalsContact O-N 3.12Å; K418-E422 WeakPolarHBondContact O-CG 3.45Å; K418-E422 PolarHBondContact O-N 3.27Å
419	S	94.6	Very high	92.1	Very high	35 Å²	35	53.6 Å²	53.6	25%	0.245	31%	0.312	C	S	.	.	H	α-helix	trans	-60.7	-35	176.5	76.3	0	0	0	0	112.3	F385 E415 I416 V417 H423	F385-S419 WeakPolarHBondContact CE1-O 3.31Å; E415-S419 PolarHBondContact O-N 2.83Å; I416-S419 PolarHBondContact O-N 2.98Å; I416-S419 PolarHBondContact O-OG 2.73Å; V417-S419 PolarHBondContact O-N 3.16Å; S419-H423 VanDerWaalsContact O-CB 3.3Å; S419-H423 WeakPolarHBondContact O-CB 3.46Å; S419-H423 PolarHBondContact O-N 2.98Å
420	I	92.1	Very high	92.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-46.1	174.6	-66.3	167.8	0	0	0	110.4	L375 A383 F385 Y388 I416 V417 K418 E422 H423 F424 I428	L375-I420 HydrophobicContact CD1-CD1 4.35Å; A383-I420 HydrophobicContact CB-CD1 4.18Å; A383-I420 HydrophobicContact CB-CG1 3.71Å; F385-I420 HydrophobicContact CD1-CB 4.43Å; F385-I420 HydrophobicContact CD1-CG1 3.92Å; F385-I420 HydrophobicContact CE1-CG1 4.08Å; Y388-I420 HydrophobicContact CD1-CG2 3.42Å; Y388-I420 VanDerWaalsContact CD1-CG2 3.42Å; Y388-I420 HydrophobicContact CD2-CD1 3.9Å; Y388-I420 HydrophobicContact CD2-CG2 4.29Å; Y388-I420 HydrophobicContact CE1-CG2 3.58Å; Y388-I420 HydrophobicContact CE2-CD1 4.42Å; Y388-I420 HydrophobicContact CE2-CG2 4.42Å; Y388-I420 HydrophobicContact CG-CD1 4.1Å; Y388-I420 HydrophobicContact CG-CG2 3.8Å; I416-I420 HydrophobicContact CG2-CD1 4.34Å; I416-I420 WeakPolarHBondContact O-CG1 3.42Å; I416-I420 PolarHBondContact O-N 2.63Å; V417-I420 WeakPolarHBondContact O-CB 3.44Å; V417-I420 PolarHBondContact O-N 2.97Å; K418-I420 PolarHBondContact O-N 3.3Å; I420-E422 VanDerWaalsContact C-N 3.33Å; I420-E422 PolarHBondContact O-N 3.35Å; I420-H423 PolarHBondContact O-N 3.48Å; I420-F424 HydrophobicContact CG2-CD2 3.82Å; I420-F424 HydrophobicContact CG2-CE2 3.95Å; I420-F424 VanDerWaalsContact O-CD2 3.3Å; I420-F424 WeakPolarHBondContact O-CD2 3.22Å; I420-F424 PolarHBondContact O-N 3.48Å; I420-F424 VanDerWaalsContact O-N 3.14Å; I420-I428 HydrophobicContact CB-CD1 4.17Å; I420-I428 HydrophobicContact CG2-CD1 3.8Å
421	A	91.6	Very high	92.2	Very high	19 Å²	19	49.1 Å²	49.1	16%	0.157	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-42.8	177.1	0	0	0	0	0	112	V417 K418 G425 K426 I428	V417-A421 PolarHBondContact O-N 3.17Å; K418-A421 WeakPolarHBondContact O-CB 3.37Å; K418-A421 PolarHBondContact O-N 3.26Å; K418-A421 VanDerWaalsContact O-N 3.12Å; A421-G425 WeakPolarHBondContact O-CA 3.49Å; A421-G425 PolarHBondContact O-N 3.37Å; A421-K426 VanDerWaalsContact CA-O 3.23Å; A421-K426 WeakPolarHBondContact CA-O 3.42Å; A421-K426 VanDerWaalsContact CB-O 3.24Å; A421-K426 WeakPolarHBondContact CB-O 3.43Å; A421-K426 PolarHBondContact O-N 3.06Å; A421-K426 VanDerWaalsContact O-N 3.11Å; A421-I428 HydrophobicContact CB-CB 4.45Å; A421-I428 HydrophobicContact CB-CD1 4.16Å; A421-I428 HydrophobicContact CB-CG1 4Å
422	E	91.7	Very high	92.1	Very high	154 Å²	154	48.9 Å²	48.9	72%	0.72	28%	0.284	S	S	*	.	H	α-helix	trans	-64.4	-45.9	176	-73.1	173.7	-176.6	0	0	112.1	K418 I420 F424 G425	K418-E422 WeakPolarHBondContact O-CG 3.45Å; K418-E422 PolarHBondContact O-N 3.27Å; I420-E422 VanDerWaalsContact C-N 3.33Å; I420-E422 PolarHBondContact O-N 3.35Å; E422-F424 VanDerWaalsContact C-N 3.34Å; E422-F424 PolarHBondContact O-N 3.21Å; E422-G425 PolarHBondContact O-N 3.33Å
423	H	86.9	Confident	92	Very high	58 Å²	58	48.4 Å²	48.4	27%	0.269	27%	0.269	S	S	.	.	H	α-helix	trans	-60.8	-41	-179.1	-179.7	69.3	0	0	0	112.6	E264 F385 S419 I420	E264-H423 IonicContact OE2-CE1 3.26Å; F385-H423 HydrophobicContact CD1-CB 3.7Å; F385-H423 AromaticContact CD1-CD2 3.7Å; F385-H423 AromaticContact CD1-CG 3.73Å; F385-H423 HydrophobicContact CE1-CB 3.64Å; F385-H423 HydrophobicContact CG-CB 4.43Å; F385-H423 AromaticContact CG-CD2 3.68Å; F385-H423 AromaticContact CG-CG 3.97Å; F385-H423 HydrophobicContact CZ-CB 4.31Å; S419-H423 VanDerWaalsContact O-CB 3.3Å; S419-H423 WeakPolarHBondContact O-CB 3.46Å; S419-H423 PolarHBondContact O-N 2.98Å; I420-H423 PolarHBondContact O-N 3.48Å
424	F	84.1	Confident	91.8	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.044	30%	0.295	C	S	.	.	H	α-helix	trans	-93.2	-2.3	-179.8	-65.3	-61.2	0	0	0	114.2	F385 Y388 L389 I420 E422 K426	F385-F424 HydrophobicContact CB-CE2 4.17Å; F385-F424 HydrophobicContact CB-CZ 3.97Å; F385-F424 WeakPolarHBondContact O-CZ 3.49Å; Y388-F424 HydrophobicContact CD1-CE2 4.26Å; L389-F424 HydrophobicContact CB-CE1 4.32Å; L389-F424 HydrophobicContact CB-CE2 4.45Å; L389-F424 HydrophobicContact CB-CZ 3.81Å; L389-F424 HydrophobicContact CD1-CE1 4.21Å; L389-F424 HydrophobicContact CD1-CZ 4.36Å; L389-F424 HydrophobicContact CD2-CE1 4.07Å; L389-F424 HydrophobicContact CD2-CZ 4.36Å; L389-F424 HydrophobicContact CG-CE1 4.44Å; L389-F424 HydrophobicContact CG-CZ 4.4Å; I420-F424 HydrophobicContact CG2-CD2 3.82Å; I420-F424 HydrophobicContact CG2-CE2 3.95Å; I420-F424 VanDerWaalsContact O-CD2 3.3Å; I420-F424 WeakPolarHBondContact O-CD2 3.22Å; I420-F424 PolarHBondContact O-N 3.48Å; I420-F424 VanDerWaalsContact O-N 3.14Å; E422-F424 VanDerWaalsContact C-N 3.34Å; E422-F424 PolarHBondContact O-N 3.21Å; F424-K426 PolarHBondContact O-N 3.13Å
425	G	84.9	Confident	91.6	Very high	63 Å²	63	56.6 Å²	56.6	65%	0.649	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	21.8	-177.1	0	0	0	0	0	114.5	A421 E422	A421-G425 WeakPolarHBondContact O-CA 3.49Å; A421-G425 PolarHBondContact O-N 3.37Å; E422-G425 PolarHBondContact O-N 3.33Å
426	K	83.2	Confident	91.3	Very high	34 Å²	34	51.4 Å²	51.4	15%	0.148	29%	0.286	C	S	.	.			trans	-123.9	133.2	-178	-77.3	-162	171.5	160.6	0	112.1	S268 L269 D270 A421 F424	S268-K426 PolarHBondContact O-NZ 3.03Å; S268-K426 WeakPolarHBondContact OG-CD 3Å; S268-K426 WeakPolarHBondContact OG-CE 3.33Å; S268-K426 PolarHBondContact OG-NZ 2.93Å; L269-K426 PolarHBondContact O-NZ 3.05Å; D270-K426 VanDerWaalsContact N-NZ 3.15Å; D270-K426 VanDerWaalsContact OD1-CE 3.24Å; D270-K426 WeakPolarHBondContact OD1-CE 3.41Å; D270-K426 IonicContact OD1-NZ 3.43Å; D270-K426 PolarHBondContact OD1-NZ 3.27Å; A421-K426 VanDerWaalsContact CA-O 3.23Å; A421-K426 WeakPolarHBondContact CA-O 3.42Å; A421-K426 VanDerWaalsContact CB-O 3.24Å; A421-K426 WeakPolarHBondContact CB-O 3.43Å; A421-K426 PolarHBondContact O-N 3.06Å; A421-K426 VanDerWaalsContact O-N 3.11Å; F424-K426 PolarHBondContact O-N 3.13Å
427	P	88.6	Confident	91	Very high	92 Å²	92	55.5 Å²	55.5	60%	0.597	30%	0.303	S	S	*	.			trans	-68.8	136.2	-179.4	28.9	-34.1	0	0	0	111.3
428	I	93.6	Very high	90.6	Very high	15 Å²	15	56.7 Å²	56.7	8%	0.077	31%	0.313	C	S	.	.			trans	-109.3	102.8	166.4	-53.9	173.6	0	0	0	106.4	Q274 Y276 Y388 V417 I420 A421	Q274-I428 HydrophobicContact CB-CB 4.44Å; Q274-I428 HydrophobicContact CB-CG1 4.07Å; Q274-I428 HydrophobicContact CB-CG2 4.25Å; Q274-I428 WeakPolarHBondContact O-CA 3.32Å; Y276-I428 HydrophobicContact CD1-CG2 4.03Å; Y276-I428 WeakPolarHBondContact CD1-O 3.42Å; Y276-I428 WeakPolarHBondContact CE1-O 3.35Å; Y388-I428 HydrophobicContact CE1-CD1 4.2Å; Y388-I428 WeakPolarHBondContact OH-CD1 3.47Å; V417-I428 HydrophobicContact CG1-CB 3.94Å; V417-I428 HydrophobicContact CG1-CD1 3.92Å; V417-I428 HydrophobicContact CG1-CG2 3.77Å; I420-I428 HydrophobicContact CB-CD1 4.17Å; I420-I428 HydrophobicContact CG2-CD1 3.8Å; A421-I428 HydrophobicContact CB-CB 4.45Å; A421-I428 HydrophobicContact CB-CD1 4.16Å; A421-I428 HydrophobicContact CB-CG1 4Å
429	N	93.3	Very high	90.1	Very high	88 Å²	88	52.4 Å²	52.4	47%	0.471	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	139.2	-169.6	-66.8	-44.6	0	0	0	111.6	Q274 F275 Y276 L431	Q274-N429 PolarHBondContact O-N 3.03Å; F275-N429 CarbonylContact C-O 3.59Å; F275-N429 WeakPolarHBondContact CA-O 3.21Å; F275-N429 HydrophobicContact CD1-CB 3.84Å; F275-N429 HydrophobicContact CE1-CB 4.17Å; Y276-N429 PolarHBondContact N-O 3.27Å; N429-L431 PolarHBondContact O-N 3.44Å
430	C	95.5	Very high	89.6	Confident	53 Å²	53	53.7 Å²	53.7	36%	0.358	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	128.4	172.2	-166.9	0	0	0	0	109.5	Y276	Y276-C430 HydrophobicContact CD1-CB 4.32Å; Y276-C430 HydrophobicContact CE1-CB 3.6Å; Y276-C430 HydrophobicContact CE2-CB 3.92Å; Y276-C430 VanDerWaalsContact CE2-SG 3.54Å; Y276-C430 WeakPolarHBondContact O-CA 3.4Å; Y276-C430 WeakPolarHBondContact OH-CB 3.32Å
431	L	94.3	Very high	89.1	Confident	7 Å²	7	60.4 Å²	60.4	4%	0.037	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	131.2	167.2	-64.2	179.9	0	0	0	110.1	F275 Y276 V277 L405 N429 Q435 L436 I439 I442	F275-L431 HydrophobicContact CB-CD1 3.67Å; F275-L431 HydrophobicContact CB-CG 3.85Å; F275-L431 HydrophobicContact CD1-CD1 3.61Å; F275-L431 HydrophobicContact CD1-CD2 3.68Å; F275-L431 HydrophobicContact CD1-CG 3.51Å; F275-L431 HydrophobicContact CD2-CD1 3.95Å; F275-L431 HydrophobicContact CE1-CD1 4.22Å; F275-L431 HydrophobicContact CE1-CD2 3.96Å; F275-L431 HydrophobicContact CE1-CG 4.25Å; F275-L431 HydrophobicContact CE2-CD1 4.5Å; F275-L431 HydrophobicContact CG-CD1 3.46Å; F275-L431 VanDerWaalsContact CG-CD1 3.46Å; F275-L431 HydrophobicContact CG-CD2 4.41Å; F275-L431 HydrophobicContact CG-CG 3.79Å; Y276-L431 PolarHBondContact O-N 3.23Å; V277-L431 HydrophobicContact CG2-CB 4.31Å; L405-L431 HydrophobicContact CD2-CD1 4.43Å; N429-L431 PolarHBondContact O-N 3.44Å; L431-Q435 HydrophobicContact CB-CB 4.33Å; L431-Q435 HydrophobicContact CD2-CB 3.97Å; L431-L436 HydrophobicContact CD1-CD1 4.16Å; L431-I439 HydrophobicContact CD1-CD1 4.04Å; L431-I439 HydrophobicContact CD1-CG1 4.31Å; L431-I442 HydrophobicContact CD2-CD1 3.72Å
432	T	93	Very high	88.5	Confident	73 Å²	73	62.5 Å²	62.5	45%	0.448	34%	0.337	S	S	.	.			trans	-71	165.5	163	70.2	0	0	0	0	109.9	D434 Q435 L436	T432-D434 PolarHBondContact O-N 2.99Å; T432-D434 PolarHBondContact OG1-N 3.26Å; T432-Q435 PolarHBondContact O-N 3.43Å; T432-Q435 WeakPolarHBondContact OG1-CG 3.49Å; T432-Q435 PolarHBondContact OG1-N 2.91Å; T432-Q435 PolarHBondContact OG1-OE1 2.89Å; T432-L436 WeakPolarHBondContact O-CB 3.43Å; T432-L436 PolarHBondContact O-N 2.85Å
433	R	90.9	Very high	87.8	Confident	55 Å²	55	55.5 Å²	55.5	21%	0.208	31%	0.305	C	S	.	.	H	α-helix	trans	-59.2	-35	174	-65.7	-54	-55.1	-134.9	-5.1	112.9	D284 A287 A288 D291 L436 K437	D284-R433 PolarHBondContact O-NH1 3.49Å; D284-R433 IonicContact OD1-CZ 3.84Å; D284-R433 IonicContact OD1-NH1 3.73Å; D284-R433 PolarHBondContact OD1-NH1 3.15Å; A287-R433 PolarHBondContact O-NH2 3.46Å; A288-R433 VanDerWaalsContact N-NH1 3.16Å; A288-R433 VanDerWaalsContact N-NH2 3.11Å; D291-R433 VanDerWaalsContact CG-NH2 3.28Å; D291-R433 IonicContact OD2-CZ 3.83Å; D291-R433 IonicContact OD2-NE 3.98Å; D291-R433 PolarHBondContact OD2-NE 3.03Å; D291-R433 IonicContact OD2-NH2 2.73Å; D291-R433 PolarHBondContact OD2-NH2 3.13Å; R433-L436 PolarHBondContact O-N 3.37Å; R433-K437 WeakPolarHBondContact O-CG 3.47Å; R433-K437 PolarHBondContact O-N 2.85Å
434	D	90	Very high	86.8	Confident	122 Å²	122	57 Å²	57	65%	0.652	31%	0.312	S	S	*	.	H	α-helix	trans	-71.3	-40.4	178	-62.8	-30	0	0	0	111.2	T432 L436 K437	T432-D434 PolarHBondContact O-N 2.99Å; T432-D434 PolarHBondContact OG1-N 3.26Å; D434-L436 VanDerWaalsContact C-N 3.31Å; D434-L436 PolarHBondContact O-N 3.49Å; D434-K437 PolarHBondContact O-N 3.01Å
435	Q	91.6	Very high	85.2	Confident	85 Å²	85	60.7 Å²	60.7	40%	0.397	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-33.8	173.8	-68.8	173.1	-50.3	0	0	112.3	L431 T432 K437 A438 I439 I442	L431-Q435 HydrophobicContact CB-CB 4.33Å; L431-Q435 HydrophobicContact CD2-CB 3.97Å; T432-Q435 PolarHBondContact O-N 3.43Å; T432-Q435 WeakPolarHBondContact OG1-CG 3.49Å; T432-Q435 PolarHBondContact OG1-N 2.91Å; T432-Q435 PolarHBondContact OG1-OE1 2.89Å; Q435-K437 VanDerWaalsContact C-N 3.26Å; Q435-K437 PolarHBondContact O-N 3.07Å; Q435-A438 CarbonylContact O-C 3.26Å; Q435-A438 VanDerWaalsContact O-C 3.26Å; Q435-A438 PolarHBondContact O-N 3.48Å; Q435-A438 VanDerWaalsContact O-N 3.12Å; Q435-I439 PolarHBondContact O-N 2.9Å; Q435-I442 HydrophobicContact CB-CD1 4.12Å
436	L	89.6	Confident	82.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-31.6	176.7	-170	67	0	0	0	112.5	V277 A288 D291 V292 L405 L431 T432 R433 D434 A438 I439	V277-L436 HydrophobicContact CG1-CD2 4.37Å; V277-L436 HydrophobicContact CG2-CD1 4.02Å; V277-L436 HydrophobicContact CG2-CD2 4.22Å; A288-L436 HydrophobicContact CB-CD2 3.82Å; D291-L436 HydrophobicContact CB-CD2 4.31Å; V292-L436 HydrophobicContact CG2-CD1 3.5Å; V292-L436 HydrophobicContact CG2-CD2 4.12Å; V292-L436 HydrophobicContact CG2-CG 3.75Å; L405-L436 HydrophobicContact CD1-CD1 4.01Å; L405-L436 HydrophobicContact CD2-CD1 4.24Å; L431-L436 HydrophobicContact CD1-CD1 4.16Å; T432-L436 WeakPolarHBondContact O-CB 3.43Å; T432-L436 PolarHBondContact O-N 2.85Å; R433-L436 PolarHBondContact O-N 3.37Å; D434-L436 VanDerWaalsContact C-N 3.31Å; D434-L436 PolarHBondContact O-N 3.49Å; L436-A438 PolarHBondContact O-N 3.26Å; L436-I439 HydrophobicContact CD1-CD1 4.18Å; L436-I439 WeakPolarHBondContact O-CB 3.4Å
437	K	89.5	Confident	80.5	Confident	111 Å²	111	72.7 Å²	72.7	48%	0.483	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-8.1	175.6	-70	173.1	-177.5	175	0	113.8	D291 S295 R433 D434 Q435	D291-K437 HydrophobicContact CB-CG 3.89Å; D291-K437 WeakPolarHBondContact OD1-CE 3.4Å; D291-K437 WeakPolarHBondContact OD2-CE 3.35Å; S295-K437 VanDerWaalsContact CB-O 3.24Å; S295-K437 WeakPolarHBondContact CB-O 3.39Å; S295-K437 VanDerWaalsContact OG-C 3.25Å; S295-K437 PolarHBondContact OG-O 3.45Å; R433-K437 WeakPolarHBondContact O-CG 3.47Å; R433-K437 PolarHBondContact O-N 2.85Å; D434-K437 PolarHBondContact O-N 3.01Å; Q435-K437 VanDerWaalsContact C-N 3.26Å; Q435-K437 PolarHBondContact O-N 3.07Å
438	A	87.5	Confident	80.1	Confident	26 Å²	26	71.7 Å²	71.7	22%	0.215	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	35.4	175.4	0	0	0	0	0	109.8	Q435 L436 D440 E441	Q435-A438 CarbonylContact O-C 3.26Å; Q435-A438 VanDerWaalsContact O-C 3.26Å; Q435-A438 PolarHBondContact O-N 3.48Å; Q435-A438 VanDerWaalsContact O-N 3.12Å; L436-A438 PolarHBondContact O-N 3.26Å; A438-D440 VanDerWaalsContact C-N 3.27Å; A438-D440 VanDerWaalsContact C-OD1 3.24Å; A438-D440 WeakPolarHBondContact CA-OD1 3.43Å; A438-D440 PolarHBondContact O-N 3.38Å; A438-E441 HydrophobicContact CB-CG 4.49Å; A438-E441 PolarHBondContact O-N 3.24Å
439	I	85.8	Confident	79.4	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-70.4	-28	-174.9	-166.7	172.4	0	0	0	111.8	F275 S295 M296 V403 L405 L431 Q435 L436 E441 I442 V443	F275-I439 HydrophobicContact CD2-CD1 4.35Å; F275-I439 HydrophobicContact CE2-CD1 4.43Å; S295-I439 PolarHBondContact OG-N 3.02Å; S295-I439 VanDerWaalsContact OG-N 3.1Å; M296-I439 HydrophobicContact CB-CG2 4.15Å; M296-I439 HydrophobicContact CG-CG2 4.06Å; M296-I439 HydrophobicContact SD-CG2 3.91Å; V403-I439 HydrophobicContact CG1-CD1 3.89Å; L405-I439 HydrophobicContact CD1-CD1 4.41Å; L405-I439 HydrophobicContact CD2-CD1 3.81Å; L431-I439 HydrophobicContact CD1-CD1 4.04Å; L431-I439 HydrophobicContact CD1-CG1 4.31Å; Q435-I439 PolarHBondContact O-N 2.9Å; L436-I439 HydrophobicContact CD1-CD1 4.18Å; L436-I439 WeakPolarHBondContact O-CB 3.4Å; I439-E441 VanDerWaalsContact C-N 3.33Å; I439-E441 PolarHBondContact O-N 3.41Å; I439-I442 PolarHBondContact O-N 3.32Å; I439-I442 VanDerWaalsContact O-N 3.14Å; I439-V443 HydrophobicContact CG1-CG2 3.88Å; I439-V443 WeakPolarHBondContact O-CB 3.36Å; I439-V443 WeakPolarHBondContact O-CG2 3.5Å; I439-V443 PolarHBondContact O-N 3.38Å
440	D	82.9	Confident	78.7	Confident	62 Å²	62	73.9 Å²	73.9	33%	0.332	39%	0.387	S	S	.	.	H	α-helix	trans	-55.3	-46.7	171.1	58.1	-29.6	0	0	0	111.5	S295 M296 A438 I442 V443 E444	S295-D440 PolarHBondContact OG-OD1 3.32Å; M296-D440 HydrophobicContact CB-CB 4.19Å; A438-D440 VanDerWaalsContact C-N 3.27Å; A438-D440 VanDerWaalsContact C-OD1 3.24Å; A438-D440 WeakPolarHBondContact CA-OD1 3.43Å; A438-D440 PolarHBondContact O-N 3.38Å; D440-I442 PolarHBondContact O-N 2.98Å; D440-V443 PolarHBondContact O-N 3.03Å; D440-E444 PolarHBondContact O-N 3.43Å
441	E	82.8	Confident	77.7	Confident	142 Å²	142	75.2 Å²	75.2	66%	0.664	39%	0.389	S	S	*	.	H	α-helix	trans	-63.2	-26.6	177.2	-59.5	-177.8	178.7	0	0	113.2	A438 I439	A438-E441 HydrophobicContact CB-CG 4.49Å; A438-E441 PolarHBondContact O-N 3.24Å; I439-E441 VanDerWaalsContact C-N 3.33Å; I439-E441 PolarHBondContact O-N 3.41Å
442	I	79.8	Confident	76.6	Confident	62 Å²	62	79.4 Å²	79.4	32%	0.318	41%	0.411	S	S	.	.	H	α-helix	trans	-85	-37.9	-178.4	-60.1	173.3	0	0	0	111.3	F275 L431 Q435 I439 D440	F275-I442 HydrophobicContact CE1-CG2 3.9Å; F275-I442 HydrophobicContact CZ-CG2 3.64Å; L431-I442 HydrophobicContact CD2-CD1 3.72Å; Q435-I442 HydrophobicContact CB-CD1 4.12Å; I439-I442 PolarHBondContact O-N 3.32Å; I439-I442 VanDerWaalsContact O-N 3.14Å; D440-I442 PolarHBondContact O-N 2.98Å
443	V	75	Confident	75.5	Confident	7 Å²	7	79.9 Å²	79.9	4%	0.042	41%	0.408	C	S	.	.	H	α-helix	trans	-92.6	-31.4	-171.3	175.1	0	0	0	0	111.7	F273 F275 V403 I439 D440 P445	F273-V443 HydrophobicContact CB-CG2 4.38Å; F273-V443 HydrophobicContact CD2-CB 4.48Å; F273-V443 HydrophobicContact CD2-CG1 3.67Å; F273-V443 HydrophobicContact CE2-CG1 3.9Å; F273-V443 HydrophobicContact CG-CG1 4.32Å; F273-V443 HydrophobicContact CG-CG2 4.41Å; F275-V443 HydrophobicContact CE2-CG2 3.84Å; F275-V443 HydrophobicContact CZ-CG2 4.19Å; V403-V443 HydrophobicContact CG2-CB 4.25Å; V403-V443 HydrophobicContact CG2-CG1 3.57Å; V403-V443 HydrophobicContact CG2-CG2 3.71Å; I439-V443 HydrophobicContact CG1-CG2 3.88Å; I439-V443 WeakPolarHBondContact O-CB 3.36Å; I439-V443 WeakPolarHBondContact O-CG2 3.5Å; I439-V443 PolarHBondContact O-N 3.38Å; D440-V443 PolarHBondContact O-N 3.03Å; V443-P445 VanDerWaalsContact C-CD 3.43Å
444	E	66.6	Low	74.4	Confident	89 Å²	89	81.6 Å²	81.6	42%	0.416	42%	0.423	S	S	.	.			trans	-128.2	60	-177	-63.3	-178.6	166.7	0	0	110.9	D440 D446 I447	D440-E444 PolarHBondContact O-N 3.43Å; E444-D446 PolarHBondContact O-N 3.42Å; E444-I447 HydrophobicContact CB-CD1 4.01Å; E444-I447 HydrophobicContact CB-CG1 4.15Å; E444-I447 HydrophobicContact CG-CD1 4.08Å; E444-I447 WeakPolarHBondContact OE2-CD1 3.48Å
445	P	50	Low	73.2	Confident	89 Å²	89	78.5 Å²	78.5	58%	0.578	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.9	-175.4	26.8	-35.1	0	0	0	114.5	V443	V443-P445 VanDerWaalsContact C-CD 3.43Å
446	D	35.4	Very low	71.7	Confident	160 Å²	160	78 Å²	78	86%	0.856	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.1	24.4	-171.5	-68.3	-46.1	0	0	0	114.4	E444	E444-D446 PolarHBondContact O-N 3.42Å
447	I	35.8	Very low	70.1	Confident	188 Å²	188	85.1 Å²	85.1	96%	0.964	44%	0.442	S	S	*	.			trans	-98.5	0	161.6	-55.8	-175.7	0	0	0	108.8	E444	E444-I447 HydrophobicContact CB-CD1 4.01Å; E444-I447 HydrophobicContact CB-CG1 4.15Å; E444-I447 HydrophobicContact CG-CD1 4.08Å; E444-I447 WeakPolarHBondContact OE2-CD1 3.48Å

Retrieved 447 of 447 residues in 720.1 ms (Link to these results)

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