A0A060X3Z9_ONCMY Loading...

Cell cycle control protein

AlphaFold DB (A0A4W5Q6G5), UniProt , Accession A0A060X3Z9, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene TMEM30A, Length 364 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	39.3	Very low	40.2	Very low	241 Å²	241	149.6 Å²	149.6	100%	1.187	82%	0.817	S	S	*	*				0	113.9	0	-67.3	178.3	-161.8	0	0	107.7
2	M	33.9	Very low	40.9	Very low	194 Å²	194	141.9 Å²	141.9	96%	0.956	80%	0.798	S	S	*	*			trans	-137.8	99.8	162.9	-77.9	-145.3	-161	0	0	107.1
3	A	38.9	Very low	41.5	Very low	109 Å²	109	143.3 Å²	143.3	90%	0.901	79%	0.794	S	S	*	*			trans	-79.8	111.7	162.4	0	0	0	0	0	106.4
4	S	36.2	Very low	42.2	Very low	95 Å²	95	142.3 Å²	142.3	66%	0.664	79%	0.793	S	S	*	*			trans	-104.7	104.2	168.3	-166.7	0	0	0	0	107	Y6	S4-Y6 PolarHBondContact O-N 2.74Å
5	S	40.1	Very low	42.5	Very low	111 Å²	111	141.5 Å²	141.5	78%	0.776	79%	0.793	S	S	*	*			trans	-66.9	111.8	170.9	41.6	0	0	0	0	108.9	N7	S5-N7 PolarHBondContact O-N 2.74Å
6	Y	41.1	Very low	43.3	Very low	174 Å²	174	138.6 Å²	138.6	68%	0.682	78%	0.78	S	S	*	*			trans	-78.3	107.1	169.2	-85.7	-90.8	0	0	0	108.9	S4 A8	S4-Y6 PolarHBondContact O-N 2.74Å; Y6-A8 PolarHBondContact O-N 2.92Å
7	N	37.3	Very low	43.4	Very low	165 Å²	165	138.4 Å²	138.4	88%	0.882	79%	0.785	S	S	*	*			trans	-74.4	121.2	163.4	-97.3	-19.2	0	0	0	109	S5	S5-N7 PolarHBondContact O-N 2.74Å
8	A	42.9	Very low	44.2	Very low	90 Å²	90	134.7 Å²	134.7	74%	0.744	78%	0.783	S	S	*	*			trans	-87.3	136.6	178	0	0	0	0	0	111.2	Y6	Y6-A8 PolarHBondContact O-N 2.92Å
9	K	42.1	Very low	44.4	Very low	167 Å²	167	132.6 Å²	132.6	73%	0.726	79%	0.793	S	S	*	*			trans	57.3	104	154.4	-79.9	-178.6	159.6	-160.2	0	119.2	D11	K9-D11 WeakPolarHBondContact CD-OD2 3.32Å; K9-D11 WeakPolarHBondContact CE-OD2 3.27Å; K9-D11 IonicContact NZ-OD2 3.08Å; K9-D11 PolarHBondContact NZ-OD2 3.01Å; K9-D11 VanDerWaalsContact NZ-OD2 3.08Å
10	E	44.3	Very low	44.9	Very low	201 Å²	201	128.8 Å²	128.8	94%	0.939	78%	0.782	S	S	*	*			trans	-101.5	91.6	139	-84.5	-174	155.6	0	0	108.2	G12	E10-G12 PolarHBondContact O-N 3.13Å
11	D	46.1	Very low	45.2	Very low	99 Å²	99	128.6 Å²	128.6	53%	0.529	78%	0.782	S	S	.	*			trans	-78.9	98.6	167.9	-72.7	-27.3	0	0	0	107.4	K9 H13	K9-D11 WeakPolarHBondContact CD-OD2 3.32Å; K9-D11 WeakPolarHBondContact CE-OD2 3.27Å; K9-D11 IonicContact NZ-OD2 3.08Å; K9-D11 PolarHBondContact NZ-OD2 3.01Å; K9-D11 VanDerWaalsContact NZ-OD2 3.08Å; D11-H13 PolarHBondContact O-N 3.34Å
12	G	48.7	Very low	46.2	Very low	57 Å²	57	123.9 Å²	123.9	59%	0.588	76%	0.76	S	S	*	*			trans	-73.7	86.2	-179.2	0	0	0	0	0	112.9	E10	E10-G12 PolarHBondContact O-N 3.13Å
13	H	48.5	Very low	47.4	Very low	160 Å²	160	122.8 Å²	122.8	74%	0.741	75%	0.753	S	S	*	*			trans	-96.4	113.5	164.3	-83.4	-66.2	0	0	0	110.4	D11	D11-H13 PolarHBondContact O-N 3.34Å
14	V	51.3	Low	48.6	Very low	129 Å²	129	122.9 Å²	122.9	78%	0.782	74%	0.738	S	S	*	*			trans	-95.1	112.6	168.6	-179.2	0	0	0	0	108.2
15	T	46.6	Very low	50.7	Low	131 Å²	131	128 Å²	128	80%	0.804	75%	0.748	S	S	*	*			trans	-89.8	123.2	172.1	29.3	0	0	0	0	110.8
16	V	55.3	Low	52.5	Low	95 Å²	95	129.6 Å²	129.6	58%	0.576	74%	0.741	S	S	*	*			trans	-99	140.2	169.7	-176.3	0	0	0	0	108.1	G18	V16-G18 PolarHBondContact O-N 3.44Å
17	P	45.8	Very low	54.4	Low	134 Å²	134	125.7 Å²	125.7	87%	0.87	74%	0.737	S	S	*	*	S	Bend	trans	-70.7	104.9	-178.4	26.8	-31.4	0	0	0	110.3
18	G	56.6	Low	56.6	Low	73 Å²	73	121.9 Å²	121.9	75%	0.753	72%	0.717	S	S	*	*	S	Bend	trans	143.1	50.2	-178.5	0	0	0	0	0	114.2	V16 G20	V16-G18 PolarHBondContact O-N 3.44Å; G18-G20 VanDerWaalsContact C-N 3.34Å; G18-G20 PolarHBondContact O-N 2.72Å
19	G	49.3	Very low	58.6	Low	94 Å²	94	123.5 Å²	123.5	97%	0.969	71%	0.713	S	S	*	*	S	Bend	trans	61.7	13.3	150.4	0	0	0	0	0	120.8
20	G	52.8	Low	60.8	Low	56 Å²	56	118.8 Å²	118.8	58%	0.577	70%	0.698	S	S	*	*			trans	-129.6	120.5	175.4	0	0	0	0	0	112.9	G18 I22	G18-G20 VanDerWaalsContact C-N 3.34Å; G18-G20 PolarHBondContact O-N 2.72Å; G20-I22 PolarHBondContact O-N 3.37Å
21	T	52.8	Low	62.9	Low	126 Å²	126	111.1 Å²	111.1	77%	0.773	67%	0.669	S	S	*	*			trans	-76.6	111.3	172.3	39.8	0	0	0	0	110.1	Q23	T21-Q23 PolarHBondContact O-N 3.14Å; T21-Q23 VanDerWaalsContact O-N 3.16Å
22	I	58.8	Low	65	Low	142 Å²	142	113.9 Å²	113.9	73%	0.728	68%	0.677	S	S	*	*			trans	-72.8	108.7	168.5	-58.1	176.9	0	0	0	107	G20 N24	G20-I22 PolarHBondContact O-N 3.37Å; I22-N24 PolarHBondContact O-N 3.41Å
23	Q	59.9	Low	66.8	Low	171 Å²	171	117.1 Å²	117.1	80%	0.799	68%	0.675	S	S	*	*			trans	-64.3	107.7	171.3	-82.8	-172.7	-6	0	0	109	T21 K25	T21-Q23 PolarHBondContact O-N 3.14Å; T21-Q23 VanDerWaalsContact O-N 3.16Å; Q23-K25 PolarHBondContact O-N 2.97Å; Q23-K25 VanDerWaalsContact O-N 3.11Å
24	N	64.3	Low	68.8	Low	111 Å²	111	112.3 Å²	112.3	59%	0.594	65%	0.653	S	S	*	*			trans	-65.3	110.1	172.1	-169.6	-1	0	0	0	108.3	I22 K26	I22-N24 PolarHBondContact O-N 3.41Å; N24-K26 PolarHBondContact O-N 3.44Å; N24-K26 WeakPolarHBondContact OD1-CB 3.24Å; N24-K26 PolarHBondContact OD1-N 2.97Å
25	K	79.2	Confident	70.6	Confident	201 Å²	201	114.9 Å²	114.9	87%	0.874	66%	0.656	S	S	*	*			trans	-75.2	4.1	177.4	-65.8	-176.9	-179.8	179	0	112.8	Q23	Q23-K25 PolarHBondContact O-N 2.97Å; Q23-K25 VanDerWaalsContact O-N 3.11Å
26	K	78.6	Confident	72.7	Confident	145 Å²	145	117.1 Å²	117.1	63%	0.63	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.2	179	-168.6	176.1	-177.3	-179.8	0	109.3	N24	N24-K26 PolarHBondContact O-N 3.44Å; N24-K26 WeakPolarHBondContact OD1-CB 3.24Å; N24-K26 PolarHBondContact OD1-N 2.97Å
27	P	80.3	Confident	74.6	Confident	92 Å²	92	116.7 Å²	116.7	60%	0.597	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-64.4	143.5	176.8	25.1	-32.3	0	0	0	110.8	N29	P27-N29 PolarHBondContact O-N 3.25Å
28	D	84.9	Confident	76.8	Confident	86 Å²	86	116 Å²	116	46%	0.46	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-55.2	130.2	-178.2	-54.6	-14	0	0	0	111.5	T30 K33 Q34	D28-T30 HydrophobicContact CB-CG2 4.47Å; D28-T30 PolarHBondContact O-N 3.05Å; D28-K33 HydrophobicContact CB-CD 3.76Å; D28-K33 IonicContact OD2-NZ 3.31Å; D28-K33 PolarHBondContact OD2-NZ 3Å; D28-Q34 PolarHBondContact O-NE2 2.04Å
29	N	84.9	Confident	78.5	Confident	124 Å²	124	115.9 Å²	115.9	66%	0.663	63%	0.631	S	S	*	*			trans	-85.7	58.4	-177.7	-168.6	22.8	0	0	0	111.4	P27	P27-N29 PolarHBondContact O-N 3.25Å
30	T	88.6	Confident	80.6	Confident	67 Å²	67	122.3 Å²	122.3	41%	0.411	63%	0.626	S	S	.	*			trans	-102.6	147.7	175.3	59.6	0	0	0	0	110.9	D28 F32 K33 Q34	D28-T30 HydrophobicContact CB-CG2 4.47Å; D28-T30 PolarHBondContact O-N 3.05Å; T30-F32 PolarHBondContact O-N 3.47Å; T30-F32 VanDerWaalsContact O-N 3.13Å; T30-K33 PolarHBondContact O-N 3.36Å; T30-K33 VanDerWaalsContact O-N 3.14Å; T30-K33 WeakPolarHBondContact OG1-CB 3.47Å; T30-K33 WeakPolarHBondContact OG1-CG 3.25Å; T30-K33 PolarHBondContact OG1-N 3.21Å; T30-Q34 WeakPolarHBondContact O-CB 3.46Å; T30-Q34 VanDerWaalsContact O-CG 3.31Å; T30-Q34 WeakPolarHBondContact O-CG 2.98Å; T30-Q34 PolarHBondContact O-N 2.92Å
31	A	87.3	Confident	82.3	Confident	40 Å²	40	127.4 Å²	127.4	33%	0.331	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55	-34	-179.2	0	0	0	0	0	113.2	Q35 R36 L37	A31-Q35 PolarHBondContact O-N 2.98Å; A31-R36 PolarHBondContact O-N 3.29Å; A31-L37 HydrophobicContact CB-CD2 4.26Å; A31-L37 PolarHBondContact O-N 2.87Å
32	F	89.8	Confident	84.1	Confident	158 Å²	158	124.7 Å²	124.7	69%	0.693	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-54.2	174.9	-177.8	-101.5	0	0	0	112.3	T30 Q34 Q35 L37	T30-F32 PolarHBondContact O-N 3.47Å; T30-F32 VanDerWaalsContact O-N 3.13Å; F32-Q34 VanDerWaalsContact C-N 3.28Å; F32-Q34 PolarHBondContact O-N 3Å; F32-Q35 PolarHBondContact O-N 3.36Å; F32-Q35 VanDerWaalsContact O-N 3.17Å; F32-L37 HydrophobicContact CD2-CD1 4.09Å
33	K	87.3	Confident	85.5	Confident	125 Å²	125	124.6 Å²	124.6	54%	0.543	62%	0.619	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-26.6	-176.8	-70	178.6	170.7	-170.7	0	113.1	D28 T30	D28-K33 HydrophobicContact CB-CD 3.76Å; D28-K33 IonicContact OD2-NZ 3.31Å; D28-K33 PolarHBondContact OD2-NZ 3Å; T30-K33 PolarHBondContact O-N 3.36Å; T30-K33 VanDerWaalsContact O-N 3.14Å; T30-K33 WeakPolarHBondContact OG1-CB 3.47Å; T30-K33 WeakPolarHBondContact OG1-CG 3.25Å; T30-K33 PolarHBondContact OG1-N 3.21Å
34	Q	90.6	Very high	86.8	Confident	59 Å²	59	123.1 Å²	123.1	28%	0.276	62%	0.616	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.7	2	176.9	-59.1	-62.3	-35.2	0	0	113.3	D28 T30 F32 R36	D28-Q34 PolarHBondContact O-NE2 2.04Å; T30-Q34 WeakPolarHBondContact O-CB 3.46Å; T30-Q34 VanDerWaalsContact O-CG 3.31Å; T30-Q34 WeakPolarHBondContact O-CG 2.98Å; T30-Q34 PolarHBondContact O-N 2.92Å; F32-Q34 VanDerWaalsContact C-N 3.28Å; F32-Q34 PolarHBondContact O-N 3Å; Q34-R36 VanDerWaalsContact C-N 3.28Å; Q34-R36 HydrophobicContact CB-CG 4.21Å; Q34-R36 WeakPolarHBondContact O-CG 3.35Å; Q34-R36 PolarHBondContact O-N 2.67Å
35	Q	89.3	Confident	87.7	Confident	183 Å²	183	121.1 Å²	121.1	86%	0.855	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.4	37.3	-178.7	-54.9	-179.5	4.7	0	0	113.9	A31 F32	A31-Q35 PolarHBondContact O-N 2.98Å; F32-Q35 PolarHBondContact O-N 3.36Å; F32-Q35 VanDerWaalsContact O-N 3.17Å
36	R	91.1	Very high	87.7	Confident	178 Å²	178	113.9 Å²	113.9	67%	0.672	59%	0.585	S	S	*	*			trans	-112	29.6	179.1	-58.3	179.6	-170.1	-178.9	0.3	112	A31 Q34	A31-R36 PolarHBondContact O-N 3.29Å; Q34-R36 VanDerWaalsContact C-N 3.28Å; Q34-R36 HydrophobicContact CB-CG 4.21Å; Q34-R36 WeakPolarHBondContact O-CG 3.35Å; Q34-R36 PolarHBondContact O-N 2.67Å
37	L	93.6	Very high	87.8	Confident	86 Å²	86	109 Å²	109	45%	0.45	58%	0.577	S	S	.	*			trans	-62.5	141.6	173.3	-74.2	178.9	0	0	0	109.7	A31 F32 A39	A31-L37 HydrophobicContact CB-CD2 4.26Å; A31-L37 PolarHBondContact O-N 2.87Å; F32-L37 HydrophobicContact CD2-CD1 4.09Å; L37-A39 PolarHBondContact O-N 3.07Å; L37-A39 VanDerWaalsContact O-N 3.1Å
38	P	92.1	Very high	87.9	Confident	118 Å²	118	108.7 Å²	108.7	77%	0.766	57%	0.573	S	S	*	*			trans	-60.4	118.6	171.9	26.6	-33	0	0	0	108.5
39	A	93	Very high	88.1	Confident	71 Å²	71	106.5 Å²	106.5	59%	0.587	56%	0.563	S	S	*	*			trans	-127.1	139	-179.3	0	0	0	0	0	109.6	L37 Q41	L37-A39 PolarHBondContact O-N 3.07Å; L37-A39 VanDerWaalsContact O-N 3.1Å; A39-Q41 HydrophobicContact CB-CG 4.39Å
40	W	92.8	Very high	88.3	Confident	229 Å²	229	102 Å²	102	87%	0.867	54%	0.538	S	S	*	.			trans	-83.9	118.3	166.8	179.9	48.6	0	0	0	108.6	P42	W40-P42 VanDerWaalsContact C-CD 3.48Å; W40-P42 HydrophobicContact CD2-CB 4.44Å; W40-P42 HydrophobicContact CD2-CG 4.15Å; W40-P42 HydrophobicContact CE3-CG 4.21Å; W40-P42 HydrophobicContact CH2-CB 4.2Å; W40-P42 HydrophobicContact CH2-CG 4.13Å; W40-P42 HydrophobicContact CZ2-CB 3.73Å; W40-P42 HydrophobicContact CZ2-CG 4.06Å; W40-P42 HydrophobicContact CZ3-CG 4.2Å; W40-P42 VanDerWaalsContact O-CD 3.23Å; W40-P42 WeakPolarHBondContact O-CD 3.03Å
41	Q	89.9	Confident	88.5	Confident	164 Å²	164	102 Å²	102	77%	0.766	54%	0.54	S	S	*	.			trans	-115.5	77.6	-177.8	-65.9	-179.7	-32.5	0	0	109.8	A39 I43	A39-Q41 HydrophobicContact CB-CG 4.39Å; Q41-I43 PolarHBondContact O-N 3.11Å
42	P	89	Confident	88.8	Confident	69 Å²	69	102.4 Å²	102.4	45%	0.448	54%	0.543	S	S	.	.			trans	-69.6	117.9	-178.8	27.7	-32.8	0	0	0	110.6	W40	W40-P42 VanDerWaalsContact C-CD 3.48Å; W40-P42 HydrophobicContact CD2-CB 4.44Å; W40-P42 HydrophobicContact CD2-CG 4.15Å; W40-P42 HydrophobicContact CE3-CG 4.21Å; W40-P42 HydrophobicContact CH2-CB 4.2Å; W40-P42 HydrophobicContact CH2-CG 4.13Å; W40-P42 HydrophobicContact CZ2-CB 3.73Å; W40-P42 HydrophobicContact CZ2-CG 4.06Å; W40-P42 HydrophobicContact CZ3-CG 4.2Å; W40-P42 VanDerWaalsContact O-CD 3.23Å; W40-P42 WeakPolarHBondContact O-CD 3.03Å
43	I	88.7	Confident	89.1	Confident	139 Å²	139	97.4 Å²	97.4	71%	0.713	52%	0.521	S	S	*	.			trans	-88.5	110.8	171.4	-55.6	173.5	0	0	0	107.6	Q41 T45 T48	Q41-I43 PolarHBondContact O-N 3.11Å; I43-T45 HydrophobicContact CG2-CG2 3.95Å; I43-T45 PolarHBondContact O-N 2.8Å; I43-T45 VanDerWaalsContact O-N 3.08Å; I43-T48 PolarHBondContact O-OG1 2.91Å
44	L	87.1	Confident	89.5	Confident	140 Å²	140	93.4 Å²	93.4	73%	0.733	50%	0.504	S	S	*	.			trans	-77.8	91.4	179.2	-62	179.8	0	0	0	109.6	V49	L44-V49 HydrophobicContact CB-CG2 3.83Å; L44-V49 HydrophobicContact CD2-CG2 4.05Å; L44-V49 HydrophobicContact CG-CG2 4.43Å
45	T	84.5	Confident	89.7	Confident	69 Å²	69	94.5 Å²	94.5	42%	0.423	51%	0.514	S	S	.	.			trans	-94.6	161	172.4	65.6	0	0	0	0	109.9	I43 G47 T48 V49	I43-T45 HydrophobicContact CG2-CG2 3.95Å; I43-T45 PolarHBondContact O-N 2.8Å; I43-T45 VanDerWaalsContact O-N 3.08Å; T45-G47 PolarHBondContact O-N 2.83Å; T45-T48 PolarHBondContact N-OG1 3.1Å; T45-T48 PolarHBondContact O-N 3.29Å; T45-T48 PolarHBondContact O-OG1 3.45Å; T45-T48 VanDerWaalsContact O-OG1 3.05Å; T45-T48 PolarHBondContact OG1-N 3.3Å; T45-T48 PolarHBondContact OG1-OG1 3.33Å; T45-V49 WeakPolarHBondContact O-CG2 3.26Å; T45-V49 PolarHBondContact O-N 2.96Å
46	A	79	Confident	90.1	Very high	49 Å²	49	88.9 Å²	88.9	41%	0.405	49%	0.489	S	S	.	.	H	α-helix	trans	-54.7	-39.1	175.8	0	0	0	0	0	111.7	T48 V49 L50 H350	A46-T48 VanDerWaalsContact C-N 3.33Å; A46-T48 PolarHBondContact O-N 2.87Å; A46-V49 PolarHBondContact O-N 3.31Å; A46-L50 WeakPolarHBondContact O-CB 3.27Å; A46-L50 PolarHBondContact O-N 2.04Å; A46-H350 HydrophobicContact CB-CB 4.45Å; A46-H350 VanDerWaalsContact CB-CD2 3.45Å; A46-H350 WeakPolarHBondContact CB-CD2 3.31Å
47	G	79	Confident	90.3	Very high	44 Å²	44	80.4 Å²	80.4	45%	0.454	46%	0.458	S	S	.	.	H	α-helix	trans	-64.1	-30.4	176.5	0	0	0	0	0	114.7	T45 P51	T45-G47 PolarHBondContact O-N 2.83Å; G47-P51 VanDerWaalsContact O-CD 3.23Å; G47-P51 WeakPolarHBondContact O-CD 3.12Å
48	T	83.7	Confident	90.5	Very high	84 Å²	84	81.7 Å²	81.7	52%	0.515	46%	0.464	S	S	.	.	H	α-helix	trans	-87.9	-31.8	178.5	57.9	0	0	0	0	113	I43 T45 A46	I43-T48 PolarHBondContact O-OG1 2.91Å; T45-T48 PolarHBondContact N-OG1 3.1Å; T45-T48 PolarHBondContact O-N 3.29Å; T45-T48 PolarHBondContact O-OG1 3.45Å; T45-T48 VanDerWaalsContact O-OG1 3.05Å; T45-T48 PolarHBondContact OG1-N 3.3Å; T45-T48 PolarHBondContact OG1-OG1 3.33Å; A46-T48 VanDerWaalsContact C-N 3.33Å; A46-T48 PolarHBondContact O-N 2.87Å
49	V	88.1	Confident	90.8	Very high	40 Å²	40	80 Å²	80	24%	0.242	45%	0.448	C	S	.	.	H	α-helix	trans	-84.3	-32.5	-177.7	176.4	0	0	0	0	112.3	L44 T45 A46 A52 F53	L44-V49 HydrophobicContact CB-CG2 3.83Å; L44-V49 HydrophobicContact CD2-CG2 4.05Å; L44-V49 HydrophobicContact CG-CG2 4.43Å; T45-V49 WeakPolarHBondContact O-CG2 3.26Å; T45-V49 PolarHBondContact O-N 2.96Å; A46-V49 PolarHBondContact O-N 3.31Å; V49-A52 WeakPolarHBondContact O-CB 3.23Å; V49-A52 PolarHBondContact O-N 2.69Å; V49-A52 VanDerWaalsContact O-N 3.1Å; V49-F53 HydrophobicContact CG1-CD2 3.74Å; V49-F53 HydrophobicContact CG1-CE2 3.41Å; V49-F53 VanDerWaalsContact CG1-CE2 3.41Å; V49-F53 PolarHBondContact O-N 2.77Å
50	L	90.3	Very high	91	Very high	30 Å²	30	79.8 Å²	79.8	16%	0.157	43%	0.434	C	S	.	.	H	α-helix	trans	-60.6	-45.8	-174.6	-176.5	117.1	0	0	0	113.9	A46 A52 F53 F54 G343 L346 L347	A46-L50 WeakPolarHBondContact O-CB 3.27Å; A46-L50 PolarHBondContact O-N 2.04Å; L50-A52 PolarHBondContact O-N 3.49Å; L50-F53 PolarHBondContact O-N 2.83Å; L50-F54 HydrophobicContact CD1-CE2 4.41Å; L50-F54 HydrophobicContact CD2-CD2 4.32Å; L50-F54 HydrophobicContact CD2-CE2 3.96Å; L50-F54 HydrophobicContact CG-CD2 4.26Å; L50-F54 HydrophobicContact CG-CE2 3.91Å; L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 PolarHBondContact O-N 2.81Å; L50-G343 WeakPolarHBondContact CD1-O 3.2Å; L50-L346 HydrophobicContact CD1-CB 3.97Å; L50-L347 VanDerWaalsContact CD1-CA 3.46Å; L50-L347 HydrophobicContact CD1-CB 3.75Å; L50-L347 HydrophobicContact CD1-CG 4.46Å; L50-L347 VanDerWaalsContact CD1-N 3.29Å; L50-L347 HydrophobicContact CD2-CD1 4.04Å; L50-L347 HydrophobicContact CD2-CG 4.48Å
51	P	93.2	Very high	91.3	Very high	68 Å²	68	71.1 Å²	71.1	44%	0.442	40%	0.404	S	S	.	.	H	α-helix	trans	-58.2	-34.9	174.2	-24.7	35.2	0	0	0	112.9	G47 F53 F54 V55	G47-P51 VanDerWaalsContact O-CD 3.23Å; G47-P51 WeakPolarHBondContact O-CD 3.12Å; P51-F53 PolarHBondContact O-N 2.84Å; P51-F54 PolarHBondContact O-N 3.38Å; P51-V55 WeakPolarHBondContact O-CB 3.05Å; P51-V55 VanDerWaalsContact O-CG2 3.25Å; P51-V55 WeakPolarHBondContact O-CG2 3.48Å; P51-V55 PolarHBondContact O-N 2.83Å
52	A	93.1	Very high	91.6	Very high	48 Å²	48	66.8 Å²	66.8	40%	0.397	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-40.3	-180	0	0	0	0	0	112.1	V49 L50 F54 V55 I56	V49-A52 WeakPolarHBondContact O-CB 3.23Å; V49-A52 PolarHBondContact O-N 2.69Å; V49-A52 VanDerWaalsContact O-N 3.1Å; L50-A52 PolarHBondContact O-N 3.49Å; A52-F54 PolarHBondContact O-N 3.03Å; A52-V55 PolarHBondContact O-N 2.98Å; A52-I56 WeakPolarHBondContact O-CB 3.09Å; A52-I56 WeakPolarHBondContact O-CD1 3.39Å; A52-I56 WeakPolarHBondContact O-CG1 3.44Å; A52-I56 PolarHBondContact O-N 2.68Å
53	F	94.7	Very high	92.1	Very high	52 Å²	52	67.1 Å²	67.1	23%	0.228	39%	0.387	C	S	.	.	H	α-helix	trans	-61.3	-44.1	176.2	-84.3	-77.6	0	0	0	112.6	V49 L50 P51 G57 C339 L342 L346	V49-F53 HydrophobicContact CG1-CD2 3.74Å; V49-F53 HydrophobicContact CG1-CE2 3.41Å; V49-F53 VanDerWaalsContact CG1-CE2 3.41Å; V49-F53 PolarHBondContact O-N 2.77Å; L50-F53 PolarHBondContact O-N 2.83Å; P51-F53 PolarHBondContact O-N 2.84Å; F53-G57 PolarHBondContact O-N 3.32Å; F53-C339 HydrophobicContact CD1-CB 4.11Å; F53-C339 WeakPolarHBondContact CD1-O 3.5Å; F53-L342 HydrophobicContact CD1-CB 4.38Å; F53-L342 HydrophobicContact CE1-CB 4.31Å; F53-L342 HydrophobicContact CE1-CD1 4.41Å; F53-L346 HydrophobicContact CD2-CD1 4.15Å; F53-L346 HydrophobicContact CE2-CD1 3.86Å; F53-L346 HydrophobicContact CZ-CD1 4.43Å
54	F	95.9	Very high	92.5	Very high	42 Å²	42	60.5 Å²	60.5	18%	0.184	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-43.9	177	-74.6	-71.7	0	0	0	112	L50 P51 A52 G57 L58 F340 G343 V344 L347	L50-F54 HydrophobicContact CD1-CE2 4.41Å; L50-F54 HydrophobicContact CD2-CD2 4.32Å; L50-F54 HydrophobicContact CD2-CE2 3.96Å; L50-F54 HydrophobicContact CG-CD2 4.26Å; L50-F54 HydrophobicContact CG-CE2 3.91Å; L50-F54 WeakPolarHBondContact O-CD2 3.37Å; L50-F54 PolarHBondContact O-N 2.81Å; P51-F54 PolarHBondContact O-N 3.38Å; A52-F54 PolarHBondContact O-N 3.03Å; F54-G57 PolarHBondContact O-N 3.09Å; F54-L58 WeakPolarHBondContact O-CB 3.23Å; F54-L58 VanDerWaalsContact O-CG 3.26Å; F54-L58 WeakPolarHBondContact O-CG 3.23Å; F54-L58 PolarHBondContact O-N 3.25Å; F54-F340 AromaticContact CD1-CD2 3.77Å; F54-F340 HydrophobicContact CD1-CD2 3.77Å; F54-F340 AromaticContact CD1-CE2 3.56Å; F54-F340 HydrophobicContact CD1-CE2 3.56Å; F54-F340 HydrophobicContact CD1-CG 4.49Å; F54-F340 HydrophobicContact CD1-CZ 4.1Å; F54-F340 HydrophobicContact CE1-CD2 4.26Å; F54-F340 HydrophobicContact CE1-CE1 4.41Å; F54-F340 AromaticContact CE1-CE2 3.94Å; F54-F340 HydrophobicContact CE1-CE2 3.94Å; F54-F340 HydrophobicContact CE1-CZ 4.01Å; F54-G343 VanDerWaalsContact CZ-C 3.49Å; F54-V344 HydrophobicContact CE1-CG2 3.84Å; F54-V344 HydrophobicContact CZ-CG2 4.01Å; F54-L347 HydrophobicContact CE2-CD1 4.06Å; F54-L347 HydrophobicContact CZ-CD1 4.16Å
55	V	96.4	Very high	93	Very high	81 Å²	81	58 Å²	58	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-46.8	177.7	169.9	0	0	0	0	110.9	P51 A52 G57 L58 I59	P51-V55 WeakPolarHBondContact O-CB 3.05Å; P51-V55 VanDerWaalsContact O-CG2 3.25Å; P51-V55 WeakPolarHBondContact O-CG2 3.48Å; P51-V55 PolarHBondContact O-N 2.83Å; A52-V55 PolarHBondContact O-N 2.98Å; V55-G57 PolarHBondContact O-N 2.92Å; V55-L58 PolarHBondContact O-N 2.99Å; V55-I59 HydrophobicContact CG1-CD1 3.64Å; V55-I59 HydrophobicContact CG1-CG1 4.48Å; V55-I59 WeakPolarHBondContact O-CB 3.47Å; V55-I59 VanDerWaalsContact O-CG1 3.26Å; V55-I59 WeakPolarHBondContact O-CG1 3.48Å; V55-I59 PolarHBondContact O-N 2.68Å
56	I	96.1	Very high	93.6	Very high	66 Å²	66	56.4 Å²	56.4	34%	0.338	34%	0.337	S	S	.	.	H	α-helix	trans	-60.2	-47.1	177.2	-69.2	165.7	0	0	0	110.3	A52 I59 F60 C339	A52-I56 WeakPolarHBondContact O-CB 3.09Å; A52-I56 WeakPolarHBondContact O-CD1 3.39Å; A52-I56 WeakPolarHBondContact O-CG1 3.44Å; A52-I56 PolarHBondContact O-N 2.68Å; I56-I59 PolarHBondContact O-N 3.15Å; I56-F60 HydrophobicContact CG2-CD1 4.27Å; I56-F60 HydrophobicContact CG2-CD2 3.95Å; I56-F60 HydrophobicContact CG2-CE1 4.31Å; I56-F60 HydrophobicContact CG2-CE2 3.99Å; I56-F60 HydrophobicContact CG2-CG 4.1Å; I56-F60 HydrophobicContact CG2-CZ 4.18Å; I56-F60 VanDerWaalsContact O-CB 3.24Å; I56-F60 WeakPolarHBondContact O-CB 3.05Å; I56-F60 WeakPolarHBondContact O-CD1 3.39Å; I56-F60 WeakPolarHBondContact O-CG 3.37Å; I56-F60 PolarHBondContact O-N 2.88Å; I56-C339 HydrophobicContact CG2-CB 4.27Å
57	G	96.3	Very high	94.5	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.2	-49.1	178.3	0	0	0	0	0	113	F53 F54 V55 I59 F60 I61 G336	F53-G57 PolarHBondContact O-N 3.32Å; F54-G57 PolarHBondContact O-N 3.09Å; V55-G57 PolarHBondContact O-N 2.92Å; G57-I59 VanDerWaalsContact C-N 3.26Å; G57-I59 PolarHBondContact O-N 3.39Å; G57-F60 PolarHBondContact O-N 2.88Å; G57-I61 WeakPolarHBondContact O-CB 3.16Å; G57-I61 WeakPolarHBondContact O-CD1 3.4Å; G57-I61 VanDerWaalsContact O-CG1 3.22Å; G57-I61 WeakPolarHBondContact O-CG1 3.41Å; G57-I61 PolarHBondContact O-N 3.22Å; G57-I61 VanDerWaalsContact O-N 3.07Å; G57-G336 WeakPolarHBondContact CA-O 3.34Å
58	L	97	Very high	95.4	Very high	112 Å²	112	57.3 Å²	57.3	59%	0.586	32%	0.318	S	S	*	.	H	α-helix	trans	-66.3	-25.2	-179.2	-71.4	174.8	0	0	0	113.4	F54 V55 P62 F340	F54-L58 WeakPolarHBondContact O-CB 3.23Å; F54-L58 VanDerWaalsContact O-CG 3.26Å; F54-L58 WeakPolarHBondContact O-CG 3.23Å; F54-L58 PolarHBondContact O-N 3.25Å; V55-L58 PolarHBondContact O-N 2.99Å; L58-P62 WeakPolarHBondContact O-CD 3.32Å; L58-P62 WeakPolarHBondContact O-CG 3.31Å; L58-F340 HydrophobicContact CD2-CE2 4.16Å; L58-F340 HydrophobicContact CG-CE2 4.38Å
59	I	98.1	Very high	96	Very high	84 Å²	84	56.5 Å²	56.5	43%	0.431	31%	0.313	S	S	.	.	H	α-helix	trans	-86.1	-45	174.7	-67.8	172.7	0	0	0	110.8	V55 I56 G57 P62 I63	V55-I59 HydrophobicContact CG1-CD1 3.64Å; V55-I59 HydrophobicContact CG1-CG1 4.48Å; V55-I59 WeakPolarHBondContact O-CB 3.47Å; V55-I59 VanDerWaalsContact O-CG1 3.26Å; V55-I59 WeakPolarHBondContact O-CG1 3.48Å; V55-I59 PolarHBondContact O-N 2.68Å; I56-I59 PolarHBondContact O-N 3.15Å; G57-I59 VanDerWaalsContact C-N 3.26Å; G57-I59 PolarHBondContact O-N 3.39Å; I59-P62 WeakPolarHBondContact O-CD 3.21Å; I59-P62 WeakPolarHBondContact O-CG 3.49Å; I59-I63 HydrophobicContact CG2-CD1 3.54Å; I59-I63 HydrophobicContact CG2-CG1 4.48Å; I59-I63 WeakPolarHBondContact O-CB 3.1Å; I59-I63 WeakPolarHBondContact O-CD1 3.44Å; I59-I63 VanDerWaalsContact O-CG1 3.24Å; I59-I63 WeakPolarHBondContact O-CG1 3.5Å; I59-I63 PolarHBondContact O-N 2.83Å
60	F	98.3	Very high	96.3	Very high	65 Å²	65	56.6 Å²	56.6	29%	0.285	31%	0.314	S	S	.	.	H	α-helix	trans	-72.2	-34.5	-172.1	-80.4	22.5	0	0	0	112.7	I56 G57 G64 Y332 V335	I56-F60 HydrophobicContact CG2-CD1 4.27Å; I56-F60 HydrophobicContact CG2-CD2 3.95Å; I56-F60 HydrophobicContact CG2-CE1 4.31Å; I56-F60 HydrophobicContact CG2-CE2 3.99Å; I56-F60 HydrophobicContact CG2-CG 4.1Å; I56-F60 HydrophobicContact CG2-CZ 4.18Å; I56-F60 VanDerWaalsContact O-CB 3.24Å; I56-F60 WeakPolarHBondContact O-CB 3.05Å; I56-F60 WeakPolarHBondContact O-CD1 3.39Å; I56-F60 WeakPolarHBondContact O-CG 3.37Å; I56-F60 PolarHBondContact O-N 2.88Å; G57-F60 PolarHBondContact O-N 2.88Å; F60-G64 PolarHBondContact O-N 3.43Å; F60-Y332 HydrophobicContact CB-CD1 4.16Å; F60-Y332 HydrophobicContact CD1-CD1 4.28Å; F60-Y332 HydrophobicContact CD1-CE1 4.3Å; F60-Y332 HydrophobicContact CD2-CD1 4.1Å; F60-Y332 HydrophobicContact CD2-CE1 4.43Å; F60-Y332 HydrophobicContact CE1-CE1 4.36Å; F60-Y332 HydrophobicContact CE2-CE1 4.49Å; F60-Y332 AromaticContact CG-CD1 3.93Å; F60-Y332 HydrophobicContact CG-CD1 3.93Å; F60-Y332 HydrophobicContact CG-CE1 4.33Å; F60-Y332 HydrophobicContact CZ-CE1 4.46Å; F60-V335 HydrophobicContact CD2-CG1 4.15Å; F60-V335 HydrophobicContact CE2-CG1 4.3Å
61	I	98	Very high	96.6	Very high	47 Å²	47	55.1 Å²	55.1	24%	0.241	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-56	178.4	-66.7	167.4	0	0	0	112	G57 I63 G64 I65	G57-I61 WeakPolarHBondContact O-CB 3.16Å; G57-I61 WeakPolarHBondContact O-CD1 3.4Å; G57-I61 VanDerWaalsContact O-CG1 3.22Å; G57-I61 WeakPolarHBondContact O-CG1 3.41Å; G57-I61 PolarHBondContact O-N 3.22Å; G57-I61 VanDerWaalsContact O-N 3.07Å; I61-I63 VanDerWaalsContact C-N 3.35Å; I61-I63 PolarHBondContact O-N 2.76Å; I61-G64 PolarHBondContact O-N 3.28Å; I61-I65 HydrophobicContact CG2-CD1 3.9Å; I61-I65 WeakPolarHBondContact O-CG1 3.48Å; I61-I65 PolarHBondContact O-N 3.39Å
62	P	98.1	Very high	96.7	Very high	74 Å²	74	54.6 Å²	54.6	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-65.2	-36.4	179.8	24.5	-33.6	0	0	0	112.6	L58 I59 I65 G66	L58-P62 WeakPolarHBondContact O-CD 3.32Å; L58-P62 WeakPolarHBondContact O-CG 3.31Å; I59-P62 WeakPolarHBondContact O-CD 3.21Å; I59-P62 WeakPolarHBondContact O-CG 3.49Å; P62-I65 PolarHBondContact O-N 3.39Å; P62-G66 PolarHBondContact O-N 2.82Å
63	I	97.9	Very high	96.7	Very high	75 Å²	75	57.5 Å²	57.5	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-59.7	-49.9	172	-69	175.2	0	0	0	109.7	I59 I61 I65 G66 L67 Y332	I59-I63 HydrophobicContact CG2-CD1 3.54Å; I59-I63 HydrophobicContact CG2-CG1 4.48Å; I59-I63 WeakPolarHBondContact O-CB 3.1Å; I59-I63 WeakPolarHBondContact O-CD1 3.44Å; I59-I63 VanDerWaalsContact O-CG1 3.24Å; I59-I63 WeakPolarHBondContact O-CG1 3.5Å; I59-I63 PolarHBondContact O-N 2.83Å; I61-I63 VanDerWaalsContact C-N 3.35Å; I61-I63 PolarHBondContact O-N 2.76Å; I63-I65 VanDerWaalsContact C-N 3.33Å; I63-I65 PolarHBondContact O-N 2.75Å; I63-G66 PolarHBondContact O-N 2.69Å; I63-G66 VanDerWaalsContact O-N 3.12Å; I63-L67 HydrophobicContact CG2-CD1 3.77Å; I63-L67 HydrophobicContact CG2-CG 4.18Å; I63-L67 VanDerWaalsContact O-CG 3.27Å; I63-L67 WeakPolarHBondContact O-CG 3.4Å; I63-L67 PolarHBondContact O-N 3.11Å; I63-Y332 HydrophobicContact CB-CD1 4.41Å; I63-Y332 HydrophobicContact CG2-CD1 3.91Å; I63-Y332 HydrophobicContact CG2-CE1 4.02Å
64	G	98.1	Very high	96.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.7	-40.8	179.7	0	0	0	0	0	113.1	F60 I61 L67 Y68 G329	F60-G64 PolarHBondContact O-N 3.43Å; I61-G64 PolarHBondContact O-N 3.28Å; G64-L67 PolarHBondContact O-N 2.93Å; G64-Y68 VanDerWaalsContact O-CB 3.24Å; G64-Y68 WeakPolarHBondContact O-CB 3.44Å; G64-Y68 PolarHBondContact O-N 2.75Å; G64-G329 VanDerWaalsContact O-CA 3.32Å; G64-G329 WeakPolarHBondContact O-CA 3.41Å
65	I	97.9	Very high	96.7	Very high	88 Å²	88	56.9 Å²	56.9	45%	0.451	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-47.5	173.1	-67.1	166.9	0	0	0	110.6	I61 P62 I63 L67 Y68 V69 I333	I61-I65 HydrophobicContact CG2-CD1 3.9Å; I61-I65 WeakPolarHBondContact O-CG1 3.48Å; I61-I65 PolarHBondContact O-N 3.39Å; P62-I65 PolarHBondContact O-N 3.39Å; I63-I65 VanDerWaalsContact C-N 3.33Å; I63-I65 PolarHBondContact O-N 2.75Å; I65-L67 PolarHBondContact O-N 3.41Å; I65-Y68 PolarHBondContact O-N 2.88Å; I65-V69 HydrophobicContact CG2-CG2 4.34Å; I65-V69 WeakPolarHBondContact O-CG2 3.42Å; I65-V69 PolarHBondContact O-N 2.84Å; I65-I333 HydrophobicContact CG1-CD1 4.05Å; I65-I333 HydrophobicContact CG1-CG1 4.3Å
66	G	97.1	Very high	96.7	Very high	35 Å²	35	55.7 Å²	55.7	36%	0.361	30%	0.295	S	S	.	.	H	α-helix	trans	-59.5	-43.8	178.1	0	0	0	0	0	112.8	P62 I63 T70	P62-G66 PolarHBondContact O-N 2.82Å; I63-G66 PolarHBondContact O-N 2.69Å; I63-G66 VanDerWaalsContact O-N 3.12Å; G66-T70 VanDerWaalsContact O-CB 3.31Å; G66-T70 WeakPolarHBondContact O-CB 3.49Å; G66-T70 PolarHBondContact O-N 2.83Å; G66-T70 PolarHBondContact O-OG1 3.18Å
67	L	96.9	Very high	96.8	Very high	18 Å²	18	54.9 Å²	54.9	9%	0.094	29%	0.289	C	S	.	.	H	α-helix	trans	-65.7	-42.1	176.7	-62.5	172.7	0	0	0	111.5	I63 G64 I65 S71 W320 M321 L328 Y332	I63-L67 HydrophobicContact CG2-CD1 3.77Å; I63-L67 HydrophobicContact CG2-CG 4.18Å; I63-L67 VanDerWaalsContact O-CG 3.27Å; I63-L67 WeakPolarHBondContact O-CG 3.4Å; I63-L67 PolarHBondContact O-N 3.11Å; G64-L67 PolarHBondContact O-N 2.93Å; I65-L67 PolarHBondContact O-N 3.41Å; L67-S71 WeakPolarHBondContact O-CB 3.44Å; L67-S71 PolarHBondContact O-N 2.83Å; L67-W320 HydrophobicContact CD2-CH2 4.02Å; L67-W320 HydrophobicContact CD2-CZ2 3.94Å; L67-M321 HydrophobicContact CB-CE 4.28Å; L67-M321 HydrophobicContact CD2-CE 4.16Å; L67-M321 HydrophobicContact CD2-SD 3.53Å; L67-M321 VanDerWaalsContact CD2-SD 3.53Å; L67-M321 HydrophobicContact CG-SD 4.48Å; L67-L328 HydrophobicContact CD1-CD2 4.01Å; L67-L328 HydrophobicContact CD1-CG 4.12Å; L67-Y332 HydrophobicContact CD1-CD2 4.08Å; L67-Y332 HydrophobicContact CD1-CE2 4.29Å; L67-Y332 HydrophobicContact CD1-CG 4.34Å
68	Y	97.5	Very high	96.8	Very high	94 Å²	94	59.2 Å²	59.2	37%	0.369	31%	0.309	S	S	.	.	H	α-helix	trans	-62.6	-48.9	178.4	179.5	-101.3	0	0	0	111.9	G64 I65 S71 N72 P326 I330	G64-Y68 VanDerWaalsContact O-CB 3.24Å; G64-Y68 WeakPolarHBondContact O-CB 3.44Å; G64-Y68 PolarHBondContact O-N 2.75Å; I65-Y68 PolarHBondContact O-N 2.88Å; Y68-S71 PolarHBondContact O-N 2.8Å; Y68-N72 WeakPolarHBondContact CE1-ND2 3.44Å; Y68-N72 WeakPolarHBondContact O-CB 3.37Å; Y68-N72 PolarHBondContact O-N 2.7Å; Y68-N72 PolarHBondContact OH-ND2 2.83Å; Y68-N72 VanDerWaalsContact OH-ND2 3.16Å; Y68-P326 HydrophobicContact CD2-CB 3.91Å; Y68-P326 HydrophobicContact CE2-CB 3.95Å; Y68-I330 HydrophobicContact CD2-CG1 4.04Å; Y68-I330 HydrophobicContact CE2-CD1 4.36Å; Y68-I330 HydrophobicContact CE2-CG1 4.14Å
69	V	96.8	Very high	96.8	Very high	68 Å²	68	55.3 Å²	55.3	41%	0.412	29%	0.288	S	S	.	.	H	α-helix	trans	-63.9	-45.3	178.2	172.5	0	0	0	0	110.9	I65 S71 N72 N73	I65-V69 HydrophobicContact CG2-CG2 4.34Å; I65-V69 WeakPolarHBondContact O-CG2 3.42Å; I65-V69 PolarHBondContact O-N 2.84Å; V69-S71 VanDerWaalsContact C-N 3.29Å; V69-S71 PolarHBondContact O-N 2.93Å; V69-N72 PolarHBondContact O-N 3.05Å; V69-N72 VanDerWaalsContact O-N 3.16Å; V69-N73 WeakPolarHBondContact O-CB 3.4Å; V69-N73 VanDerWaalsContact O-CG 3.29Å; V69-N73 PolarHBondContact O-N 3.25Å; V69-N73 PolarHBondContact O-ND2 2.93Å
70	T	95.8	Very high	96.8	Very high	41 Å²	41	54.4 Å²	54.4	25%	0.252	28%	0.284	S	S	.	.	H	α-helix	trans	-58.1	-43.3	177.5	-58.8	0	0	0	0	111.2	G66	G66-T70 VanDerWaalsContact O-CB 3.31Å; G66-T70 WeakPolarHBondContact O-CB 3.49Å; G66-T70 PolarHBondContact O-N 2.83Å; G66-T70 PolarHBondContact O-OG1 3.18Å
71	S	95.8	Very high	96.8	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-41.4	176.2	175.3	0	0	0	0	112.6	L67 Y68 V69 N73 I74 N325	L67-S71 WeakPolarHBondContact O-CB 3.44Å; L67-S71 PolarHBondContact O-N 2.83Å; Y68-S71 PolarHBondContact O-N 2.8Å; V69-S71 VanDerWaalsContact C-N 3.29Å; V69-S71 PolarHBondContact O-N 2.93Å; S71-N73 VanDerWaalsContact C-N 3.34Å; S71-N73 PolarHBondContact O-N 3.33Å; S71-I74 WeakPolarHBondContact O-CB 3.16Å; S71-I74 PolarHBondContact O-N 3.45Å; S71-N325 PolarHBondContact OG-N 3.26Å; S71-N325 PolarHBondContact OG-O 3.13Å
72	N	94.6	Very high	96.7	Very high	57 Å²	57	49 Å²	49	31%	0.305	26%	0.259	S	S	.	.	H	α-helix	trans	-74.4	-23.4	-177.2	-81.3	-3.2	0	0	0	113.9	Y68 V69 I74	Y68-N72 WeakPolarHBondContact CE1-ND2 3.44Å; Y68-N72 WeakPolarHBondContact O-CB 3.37Å; Y68-N72 PolarHBondContact O-N 2.7Å; Y68-N72 PolarHBondContact OH-ND2 2.83Å; Y68-N72 VanDerWaalsContact OH-ND2 3.16Å; V69-N72 PolarHBondContact O-N 3.05Å; V69-N72 VanDerWaalsContact O-N 3.16Å; N72-I74 PolarHBondContact O-N 2.88Å
73	N	94.3	Very high	96.5	Very high	108 Å²	108	45.6 Å²	45.6	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.6	173.4	-74.1	-18.7	0	0	0	112.9	V69 S71 K75	V69-N73 WeakPolarHBondContact O-CB 3.4Å; V69-N73 VanDerWaalsContact O-CG 3.29Å; V69-N73 PolarHBondContact O-N 3.25Å; V69-N73 PolarHBondContact O-ND2 2.93Å; S71-N73 VanDerWaalsContact C-N 3.34Å; S71-N73 PolarHBondContact O-N 3.33Å; N73-K75 PolarHBondContact O-N 3.42Å
74	I	95.4	Very high	96.2	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.036	23%	0.232	C	C	.	.	S	Bend	trans	-66.3	129.1	174.8	-63.5	170.4	0	0	0	109.6	S71 N72 T317 G322 G323 K324	S71-I74 WeakPolarHBondContact O-CB 3.16Å; S71-I74 PolarHBondContact O-N 3.45Å; N72-I74 PolarHBondContact O-N 2.88Å; I74-T317 WeakPolarHBondContact CG2-O 3.34Å; I74-G322 VanDerWaalsContact CD1-O 3.3Å; I74-G322 WeakPolarHBondContact CD1-O 3.4Å; I74-G323 VanDerWaalsContact CD1-C 3.41Å; I74-G323 WeakPolarHBondContact CD1-O 3.21Å; I74-K324 HydrophobicContact CB-CB 4.16Å; I74-K324 HydrophobicContact CG2-CB 3.95Å
75	K	95.1	Very high	95.9	Very high	75 Å²	75	48.9 Å²	48.9	33%	0.326	26%	0.257	S	S	.	.			trans	-91.6	124.3	175.7	-54.9	-56.2	176.5	-179.4	0	108.1	N73 Q115 F117 S316 T317	N73-K75 PolarHBondContact O-N 3.42Å; K75-Q115 VanDerWaalsContact CE-OE1 3.23Å; K75-F117 HydrophobicContact CB-CD1 4.18Å; K75-F117 HydrophobicContact CB-CE1 3.9Å; K75-F117 HydrophobicContact CB-CE2 4.39Å; K75-F117 HydrophobicContact CB-CZ 4.01Å; K75-F117 WeakPolarHBondContact O-CE1 3.48Å; K75-S316 WeakPolarHBondContact O-CA 3.3Å; K75-T317 PolarHBondContact N-OG1 3.29Å; K75-T317 PolarHBondContact O-N 2.89Å
76	E	96.4	Very high	95.6	Very high	55 Å²	55	52.5 Å²	52.5	26%	0.257	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.2	179.2	-175	168.5	104.8	0	0	108.2	R273 I314 L315 K324	E76-R273 IonicContact OE1-CZ 2.76Å; E76-R273 IonicContact OE1-NH1 3.34Å; E76-R273 IonicContact OE1-NH2 3.77Å; E76-R273 PolarHBondContact OE1-NH2 2.94Å; E76-R273 IonicContact OE2-CZ 3.55Å; E76-R273 IonicContact OE2-NH1 3.97Å; E76-R273 PolarHBondContact OE2-NH1 3.38Å; E76-R273 IonicContact OE2-NH2 3.71Å; E76-I314 HydrophobicContact CG-CG2 3.65Å; E76-L315 CarbonylContact C-O 3.23Å; E76-L315 VanDerWaalsContact CA-O 3.3Å; E76-L315 WeakPolarHBondContact CA-O 3.4Å; E76-K324 HydrophobicContact CB-CD 4.21Å
77	F	97.4	Very high	95.3	Very high	49 Å²	49	56.1 Å²	56.1	22%	0.215	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	133.4	172.7	176	-95.7	0	0	0	108.4	I79 F111 L113 F117 I314 L315	F77-I79 HydrophobicContact CE1-CB 3.88Å; F77-I79 HydrophobicContact CE1-CG2 4.01Å; F77-I79 HydrophobicContact CZ-CB 4.2Å; F77-F111 HydrophobicContact CD1-CD2 4.06Å; F77-F111 AromaticContact CD1-CE2 3.92Å; F77-F111 HydrophobicContact CD1-CE2 3.92Å; F77-F111 HydrophobicContact CE1-CB 4.32Å; F77-F111 HydrophobicContact CE1-CD1 4.46Å; F77-F111 AromaticContact CE1-CD2 3.27Å; F77-F111 HydrophobicContact CE1-CD2 3.27Å; F77-F111 AromaticContact CE1-CE2 3.51Å; F77-F111 HydrophobicContact CE1-CE2 3.51Å; F77-F111 AromaticContact CE1-CG 3.79Å; F77-F111 HydrophobicContact CE1-CG 3.79Å; F77-F111 HydrophobicContact CE1-CZ 4.2Å; F77-F111 HydrophobicContact CE2-CD2 4.19Å; F77-F111 HydrophobicContact CZ-CB 3.82Å; F77-F111 AromaticContact CZ-CD2 3.37Å; F77-F111 HydrophobicContact CZ-CD2 3.37Å; F77-F111 HydrophobicContact CZ-CE2 4.08Å; F77-F111 AromaticContact CZ-CG 3.77Å; F77-F111 HydrophobicContact CZ-CG 3.77Å; F77-L113 HydrophobicContact CB-CD2 3.82Å; F77-L113 HydrophobicContact CD1-CD2 3.94Å; F77-L113 HydrophobicContact CD2-CD2 3.83Å; F77-L113 HydrophobicContact CE2-CD2 4.41Å; F77-L113 HydrophobicContact CG-CD2 3.56Å; F77-F117 HydrophobicContact CB-CZ 4.09Å; F77-I314 CarbonylContact O-C 3.59Å; F77-I314 VanDerWaalsContact O-CA 3.32Å; F77-I314 WeakPolarHBondContact O-CA 3.29Å; F77-L315 HydrophobicContact CD1-CD1 4.48Å; F77-L315 PolarHBondContact N-O 3.4Å; F77-L315 PolarHBondContact O-N 2.94Å
78	E	97.5	Very high	95.2	Very high	92 Å²	92	56.5 Å²	56.5	43%	0.43	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.4	-178.2	179.2	173	144.1	0	0	109.7	R312 V313 I314	E78-R312 HydrophobicContact CG-CB 4.26Å; E78-R312 WeakPolarHBondContact OE1-CD 3.41Å; E78-R312 IonicContact OE1-NE 3.53Å; E78-R312 IonicContact OE1-NH1 2.82Å; E78-R312 IonicContact OE2-NE 3.9Å; E78-V313 WeakPolarHBondContact CA-O 3.46Å; E78-I314 HydrophobicContact CB-CG1 4.22Å; E78-I314 HydrophobicContact CG-CG1 3.88Å
79	I	97.1	Very high	95	Very high	29 Å²	29	55.4 Å²	55.4	15%	0.149	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	127.4	175.4	-173.2	167.7	0	0	0	110.5	F77 L109 F111 L296 R312 V313	F77-I79 HydrophobicContact CE1-CB 3.88Å; F77-I79 HydrophobicContact CE1-CG2 4.01Å; F77-I79 HydrophobicContact CZ-CB 4.2Å; I79-L109 HydrophobicContact CD1-CB 4.05Å; I79-L109 HydrophobicContact CD1-CD2 4.24Å; I79-L109 HydrophobicContact CG1-CD2 4.49Å; I79-F111 HydrophobicContact CD1-CB 4.04Å; I79-F111 HydrophobicContact CD1-CD1 4.29Å; I79-F111 HydrophobicContact CD1-CG 4.4Å; I79-L296 HydrophobicContact CG2-CD2 4.15Å; I79-R312 CarbonylContact O-C 3.59Å; I79-R312 WeakPolarHBondContact O-CA 3.37Å; I79-R312 WeakPolarHBondContact O-CB 3.42Å; I79-V313 HydrophobicContact CG2-CB 4.09Å; I79-V313 PolarHBondContact N-O 3.37Å; I79-V313 PolarHBondContact O-N 2.99Å
80	D	97.5	Very high	94.9	Very high	65 Å²	65	52.1 Å²	52.1	35%	0.348	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	130.6	172	-171.3	-57.5	0	0	0	109.6	T82 K311	D80-T82 VanDerWaalsContact CG-OG1 3.31Å; D80-T82 WeakPolarHBondContact OD1-CA 3.33Å; D80-T82 WeakPolarHBondContact OD1-CB 3.28Å; D80-T82 PolarHBondContact OD1-N 2.87Å; D80-T82 PolarHBondContact OD1-OG1 2.89Å; D80-T82 PolarHBondContact OD2-OG1 2.95Å; D80-K311 WeakPolarHBondContact CA-O 3.45Å
81	Y	96.9	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.278	C	S	.	.			trans	-123.5	18.1	177.7	69	-87.6	0	0	0	112.5	G83 F182 D184 L186 V298 K311 R312 V313	Y81-G83 PolarHBondContact O-N 2.8Å; Y81-F182 WeakPolarHBondContact OH-CZ 3.41Å; Y81-D184 PolarHBondContact OH-OD2 3.09Å; Y81-L186 HydrophobicContact CE1-CD2 4.35Å; Y81-L186 HydrophobicContact CE2-CD2 4.26Å; Y81-V298 HydrophobicContact CD2-CB 4.46Å; Y81-V298 HydrophobicContact CD2-CG1 3.76Å; Y81-V298 HydrophobicContact CD2-CG2 4.06Å; Y81-V298 HydrophobicContact CE2-CG1 3.77Å; Y81-V298 HydrophobicContact CG-CG2 4.27Å; Y81-K311 HydrophobicContact CD1-CB 4.32Å; Y81-K311 HydrophobicContact CD2-CB 4.32Å; Y81-K311 HydrophobicContact CE1-CB 3.8Å; Y81-K311 HydrophobicContact CE2-CB 3.8Å; Y81-K311 HydrophobicContact CE2-CD 3.98Å; Y81-K311 PolarHBondContact N-O 2.86Å; Y81-R312 VanDerWaalsContact CE1-C 3.42Å; Y81-V313 HydrophobicContact CD1-CG2 3.84Å; Y81-V313 HydrophobicContact CE1-CG2 3.58Å
82	T	96.2	Very high	94.7	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.307	C	S	.	.	S	Bend	trans	-60.7	-34	179.3	-45.3	0	0	0	0	111.8	D80 T84 S94 Y300 V304 R310 K311	D80-T82 VanDerWaalsContact CG-OG1 3.31Å; D80-T82 WeakPolarHBondContact OD1-CA 3.33Å; D80-T82 WeakPolarHBondContact OD1-CB 3.28Å; D80-T82 PolarHBondContact OD1-N 2.87Å; D80-T82 PolarHBondContact OD1-OG1 2.89Å; D80-T82 PolarHBondContact OD2-OG1 2.95Å; T82-T84 HydrophobicContact CG2-CG2 3.97Å; T82-S94 WeakPolarHBondContact O-CB 3.33Å; T82-Y300 PolarHBondContact O-OH 3.39Å; T82-V304 HydrophobicContact CG2-CG2 3.75Å; T82-R310 WeakPolarHBondContact OG1-CA 3.22Å; T82-K311 PolarHBondContact OG1-N 3.18Å; T82-K311 PolarHBondContact OG1-O 3.42Å
83	G	94.4	Very high	94.6	Very high	2 Å²	2	54.7 Å²	54.7	2%	0.021	29%	0.294	C	S	.	.			trans	75.5	40.6	-178.4	0	0	0	0	0	113.8	Y81 F91 S94 R305	Y81-G83 PolarHBondContact O-N 2.8Å; G83-F91 WeakPolarHBondContact O-CA 3.4Å; G83-F91 WeakPolarHBondContact O-CD2 3.18Å; G83-S94 PolarHBondContact O-OG 2.99Å; G83-R305 PolarHBondContact O-NH2 2.87Å
84	T	91.6	Very high	94.4	Very high	44 Å²	44	50 Å²	50	27%	0.27	27%	0.269	S	S	.	.			trans	-72.3	-33.1	178.1	55	0	0	0	0	113.5	T82 R310	T82-T84 HydrophobicContact CG2-CG2 3.97Å; T84-R310 PolarHBondContact OG1-NH1 2.78Å
85	D	92	Very high	94.1	Very high	99 Å²	99	55.8 Å²	55.8	53%	0.529	30%	0.296	S	S	.	.	S	Bend	trans	-92.9	141.9	-173.7	-49.3	-27.2	0	0	0	109.6	S87 S88 F91	D85-S87 PolarHBondContact O-N 3.45Å; D85-S87 VanDerWaalsContact O-N 3.13Å; D85-S88 VanDerWaalsContact O-CB 3.24Å; D85-S88 WeakPolarHBondContact O-CB 3.43Å; D85-S88 PolarHBondContact O-N 2.67Å; D85-F91 VanDerWaalsContact C-CD2 3.5Å; D85-F91 WeakPolarHBondContact O-CB 2.86Å; D85-F91 VanDerWaalsContact O-CD2 3.27Å; D85-F91 WeakPolarHBondContact O-CD2 3.4Å
86	M	90.6	Very high	93.6	Very high	165 Å²	165	56.1 Å²	56.1	81%	0.813	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-23.5	-179.1	-66	172.8	70	0	0	113	S88 F91	M86-S88 VanDerWaalsContact C-N 3.3Å; M86-F91 HydrophobicContact CG-CD2 4.43Å; M86-F91 HydrophobicContact CG-CE1 4.21Å; M86-F91 HydrophobicContact CG-CE2 3.86Å; M86-F91 HydrophobicContact CG-CZ 3.74Å
87	S	91.8	Very high	93.1	Very high	110 Å²	110	54.3 Å²	54.3	77%	0.769	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-13.9	175.3	55.9	0	0	0	0	113.5	D85	D85-S87 PolarHBondContact O-N 3.45Å; D85-S87 VanDerWaalsContact O-N 3.13Å
88	S	93.8	Very high	92.4	Very high	26 Å²	26	54.4 Å²	54.4	18%	0.182	31%	0.306	C	S	.	.	S	Bend	trans	-74.1	134.1	-177.1	-176.4	0	0	0	0	111.1	D85 M86 C90 F91	D85-S88 VanDerWaalsContact O-CB 3.24Å; D85-S88 WeakPolarHBondContact O-CB 3.43Å; D85-S88 PolarHBondContact O-N 2.67Å; M86-S88 VanDerWaalsContact C-N 3.3Å; S88-C90 PolarHBondContact O-N 3.27Å; S88-C90 PolarHBondContact OG-N 3.05Å; S88-F91 VanDerWaalsContact O-CB 3.25Å; S88-F91 WeakPolarHBondContact O-CB 3.38Å; S88-F91 PolarHBondContact O-N 3.36Å
89	P	94.4	Very high	91.5	Very high	71 Å²	71	54.5 Å²	54.5	46%	0.461	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-24.9	174.5	-25.3	34.1	0	0	0	114	A108	P89-A108 VanDerWaalsContact CB-O 3.23Å; P89-A108 WeakPolarHBondContact CB-O 3.4Å
90	C	95	Very high	90.7	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	3	179.6	-60.4	0	0	0	0	114	S88 N92 C93 S94 C107 L109	S88-C90 PolarHBondContact O-N 3.27Å; S88-C90 PolarHBondContact OG-N 3.05Å; C90-N92 PolarHBondContact O-N 2.92Å; C90-C93 PolarHBondContact O-N 2.99Å; C90-S94 PolarHBondContact O-N 3.11Å; C90-S94 PolarHBondContact O-OG 3.14Å; C90-C107 HydrophobicContact CB-CB 3.86Å; C90-C107 WeakPolarHBondContact CB-SG 3.39Å; C90-C107 WeakPolarHBondContact SG-CB 3.35Å; C90-C107 CovalentContact SG-SG 2.04Å; C90-C107 PolarHBondContact SG-SG 3.19Å; C90-L109 VanDerWaalsContact SG-CD1 3.53Å
91	F	94.3	Very high	89.9	Confident	32 Å²	32	58.4 Å²	58.4	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-56.4	-49.4	-177.9	-178.2	-98.2	0	0	0	112.2	G83 D85 M86 S88 C93 S94 Q95 R305	G83-F91 WeakPolarHBondContact O-CA 3.4Å; G83-F91 WeakPolarHBondContact O-CD2 3.18Å; D85-F91 VanDerWaalsContact C-CD2 3.5Å; D85-F91 WeakPolarHBondContact O-CB 2.86Å; D85-F91 VanDerWaalsContact O-CD2 3.27Å; D85-F91 WeakPolarHBondContact O-CD2 3.4Å; M86-F91 HydrophobicContact CG-CD2 4.43Å; M86-F91 HydrophobicContact CG-CE1 4.21Å; M86-F91 HydrophobicContact CG-CE2 3.86Å; M86-F91 HydrophobicContact CG-CZ 3.74Å; S88-F91 VanDerWaalsContact O-CB 3.25Å; S88-F91 WeakPolarHBondContact O-CB 3.38Å; S88-F91 PolarHBondContact O-N 3.36Å; F91-C93 VanDerWaalsContact C-N 3.34Å; F91-C93 PolarHBondContact O-N 3.22Å; F91-S94 PolarHBondContact O-N 3.43Å; F91-S94 VanDerWaalsContact O-N 3.14Å; F91-S94 PolarHBondContact O-OG 3.46Å; F91-Q95 PolarHBondContact O-N 3.07Å; F91-R305 VanDerWaalsContact CD2-NH2 3.3Å; F91-R305 VanDerWaalsContact CE2-NH2 3.29Å
92	N	92.2	Very high	88.8	Confident	116 Å²	116	64.6 Å²	64.6	62%	0.62	36%	0.364	S	S	*	.	H	α-helix	trans	-59.3	-42.9	179.4	-70.6	-17.8	0	0	0	112.3	C90 Q95 S96	C90-N92 PolarHBondContact O-N 2.92Å; N92-Q95 PolarHBondContact O-N 3.01Å; N92-S96 WeakPolarHBondContact O-CB 3.47Å; N92-S96 PolarHBondContact O-N 2.93Å; N92-S96 PolarHBondContact O-OG 3.25Å
93	C	92.5	Very high	88.2	Confident	4 Å²	4	74.5 Å²	74.5	3%	0.027	40%	0.401	C	S	.	.	H	α-helix	trans	-63.8	-44.3	176.2	-68.4	0	0	0	0	111.4	C90 F91 Q95 F97 C105 Y300	C90-C93 PolarHBondContact O-N 2.99Å; F91-C93 VanDerWaalsContact C-N 3.34Å; F91-C93 PolarHBondContact O-N 3.22Å; C93-Q95 VanDerWaalsContact C-N 3.29Å; C93-Q95 PolarHBondContact O-N 2.88Å; C93-F97 WeakPolarHBondContact O-CB 3.26Å; C93-F97 PolarHBondContact O-N 3.06Å; C93-C105 WeakPolarHBondContact CA-SG 3.43Å; C93-C105 HydrophobicContact CB-CB 3.78Å; C93-C105 WeakPolarHBondContact CB-SG 3.29Å; C93-C105 WeakPolarHBondContact SG-CB 3.41Å; C93-C105 CovalentContact SG-SG 2.04Å; C93-C105 PolarHBondContact SG-SG 2.76Å; C93-Y300 HydrophobicContact CB-CD1 4.38Å; C93-Y300 HydrophobicContact CB-CD2 4.19Å; C93-Y300 HydrophobicContact CB-CG 3.94Å
94	S	91	Very high	87.8	Confident	8 Å²	8	78.4 Å²	78.4	6%	0.056	43%	0.427	C	S	.	.	H	α-helix	trans	-67.4	-28.1	-178.4	73.8	0	0	0	0	113.7	T82 G83 C90 F91 R305	T82-S94 WeakPolarHBondContact O-CB 3.33Å; G83-S94 PolarHBondContact O-OG 2.99Å; C90-S94 PolarHBondContact O-N 3.11Å; C90-S94 PolarHBondContact O-OG 3.14Å; F91-S94 PolarHBondContact O-N 3.43Å; F91-S94 VanDerWaalsContact O-N 3.14Å; F91-S94 PolarHBondContact O-OG 3.46Å; S94-R305 VanDerWaalsContact CB-NE 3.34Å; S94-R305 VanDerWaalsContact O-CD 3.23Å; S94-R305 WeakPolarHBondContact O-CD 3.49Å; S94-R305 PolarHBondContact O-NE 3.26Å; S94-R305 PolarHBondContact OG-NE 3.4Å; S94-R305 PolarHBondContact OG-NH2 3.32Å
95	Q	88.6	Confident	87.9	Confident	129 Å²	129	77.7 Å²	77.7	60%	0.603	42%	0.423	S	S	*	.	H	α-helix	trans	-83.3	-40	177.3	-170.7	174.1	41	0	0	112.9	F91 N92 C93	F91-Q95 PolarHBondContact O-N 3.07Å; N92-Q95 PolarHBondContact O-N 3.01Å; C93-Q95 VanDerWaalsContact C-N 3.29Å; C93-Q95 PolarHBondContact O-N 2.88Å
96	S	85	Confident	88	Confident	83 Å²	83	77 Å²	77	58%	0.58	42%	0.422	S	S	*	.	H	α-helix	trans	-90.1	-24.3	-173.9	62.4	0	0	0	0	114.1	N92	N92-S96 WeakPolarHBondContact O-CB 3.47Å; N92-S96 PolarHBondContact O-N 2.93Å; N92-S96 PolarHBondContact O-OG 3.25Å
97	F	86.1	Confident	88.3	Confident	16 Å²	16	69.6 Å²	69.6	7%	0.07	39%	0.387	C	S	.	.			trans	-85	129.7	-173.5	-167	-86.2	0	0	0	112.2	C93 C105 R240 Y300 N301 P303	C93-F97 WeakPolarHBondContact O-CB 3.26Å; C93-F97 PolarHBondContact O-N 3.06Å; F97-C105 HydrophobicContact CD2-CB 4.3Å; F97-R240 VanDerWaalsContact CZ-NH2 3.31Å; F97-Y300 HydrophobicContact CB-CD1 4.33Å; F97-Y300 HydrophobicContact CD1-CD1 4.39Å; F97-Y300 WeakPolarHBondContact CD2-O 3.42Å; F97-Y300 WeakPolarHBondContact CE2-O 3.44Å; F97-Y300 HydrophobicContact CG-CD1 4.4Å; F97-N301 VanDerWaalsContact CE1-C 3.46Å; F97-N301 WeakPolarHBondContact CE1-O 3.27Å; F97-N301 HydrophobicContact CZ-CB 4.35Å; F97-P303 HydrophobicContact CD1-CB 4.32Å; F97-P303 HydrophobicContact CD1-CG 4.42Å
98	S	82.7	Confident	88.5	Confident	52 Å²	52	66.6 Å²	66.6	36%	0.364	37%	0.368	S	S	.	.			trans	-131.5	168.4	174.3	74	0	0	0	0	110.3	N100 S101	S98-N100 PolarHBondContact O-N 3.33Å; S98-N100 VanDerWaalsContact O-N 3.1Å; S98-N100 PolarHBondContact OG-N 3.18Å; S98-S101 PolarHBondContact N-OG 3.16Å; S98-S101 VanDerWaalsContact O-CB 3.26Å; S98-S101 WeakPolarHBondContact O-CB 3.35Å; S98-S101 PolarHBondContact O-N 3.11Å; S98-S101 PolarHBondContact O-OG 3.42Å; S98-S101 PolarHBondContact OG-OG 3.42Å
99	W	78.1	Confident	88.6	Confident	93 Å²	93	65.8 Å²	65.8	35%	0.352	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-24.1	174.9	-70.5	106.8	0	0	0	113.7	N238 Y302 P303	W99-N238 HydrophobicContact CE3-CB 4.02Å; W99-N238 HydrophobicContact CZ3-CB 3.98Å; W99-Y302 AromaticContact CH2-CD2 3.62Å; W99-Y302 HydrophobicContact CH2-CD2 3.62Å; W99-Y302 AromaticContact CH2-CE2 3.57Å; W99-Y302 HydrophobicContact CH2-CE2 3.57Å; W99-Y302 HydrophobicContact CZ2-CD2 4.24Å; W99-Y302 HydrophobicContact CZ2-CE2 4.09Å; W99-P303 HydrophobicContact CD2-CG 3.85Å; W99-P303 HydrophobicContact CG-CG 3.91Å; W99-P303 HydrophobicContact CZ2-CG 4.09Å
100	N	79.8	Confident	88.7	Confident	148 Å²	148	67 Å²	67	79%	0.791	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-3.9	178.8	-66	-19.3	0	0	0	113.3	S98 T102	S98-N100 PolarHBondContact O-N 3.33Å; S98-N100 VanDerWaalsContact O-N 3.1Å; S98-N100 PolarHBondContact OG-N 3.18Å; N100-T102 PolarHBondContact O-N 2.76Å
101	S	80.6	Confident	88.8	Confident	29 Å²	29	68.1 Å²	68.1	20%	0.203	38%	0.375	C	S	.	.			trans	-72.5	122.7	-177.6	-62.2	0	0	0	0	110.6	S98 R240	S98-S101 PolarHBondContact N-OG 3.16Å; S98-S101 VanDerWaalsContact O-CB 3.26Å; S98-S101 WeakPolarHBondContact O-CB 3.35Å; S98-S101 PolarHBondContact O-N 3.11Å; S98-S101 PolarHBondContact O-OG 3.42Å; S98-S101 PolarHBondContact OG-OG 3.42Å; S101-R240 PolarHBondContact O-NH2 3.4Å
102	T	74.6	Confident	89	Confident	129 Å²	129	69.6 Å²	69.6	79%	0.791	39%	0.39	S	S	*	.			trans	-85.1	-28	-179.3	51.1	0	0	0	0	113.1	N100	N100-T102 PolarHBondContact O-N 2.76Å
103	R	83.3	Confident	89.2	Confident	208 Å²	208	64.3 Å²	64.3	79%	0.785	36%	0.361	S	S	*	.	S	Bend	trans	-88.8	133.1	178.7	-65.6	-175.4	179.1	176	0.1	110.9
104	P	85.8	Confident	89.3	Confident	85 Å²	85	71.6 Å²	71.6	55%	0.552	40%	0.395	S	S	*	.			trans	-67	140.4	172	29	-32.8	0	0	0	109.8	T299	P104-T299 HydrophobicContact CB-CG2 3.98Å
105	C	92.9	Very high	89.4	Confident	28 Å²	28	75.7 Å²	75.7	19%	0.189	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.5	169.7	-165.7	0	0	0	0	108.8	C93 F97 Y300	C93-C105 WeakPolarHBondContact CA-SG 3.43Å; C93-C105 HydrophobicContact CB-CB 3.78Å; C93-C105 WeakPolarHBondContact CB-SG 3.29Å; C93-C105 WeakPolarHBondContact SG-CB 3.41Å; C93-C105 CovalentContact SG-SG 2.04Å; C93-C105 PolarHBondContact SG-SG 2.76Å; F97-C105 HydrophobicContact CD2-CB 4.3Å; C105-Y300 WeakPolarHBondContact O-CB 3.34Å; C105-Y300 PolarHBondContact O-N 3.48Å
106	T	95.2	Very high	89.8	Confident	85 Å²	85	71.9 Å²	71.9	52%	0.521	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	142.2	177.8	54.5	0	0	0	0	110.6	V298 T299	T106-V298 CarbonylContact C-O 3.57Å; T106-V298 VanDerWaalsContact CA-O 3.23Å; T106-V298 WeakPolarHBondContact CA-O 3.41Å; T106-T299 HydrophobicContact CG2-CG2 4.33Å
107	C	96.1	Very high	90.3	Very high	9 Å²	9	68.2 Å²	68.2	6%	0.061	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	150.3	171.9	57.4	0	0	0	0	110.1	C90 V298	C90-C107 HydrophobicContact CB-CB 3.86Å; C90-C107 WeakPolarHBondContact CB-SG 3.39Å; C90-C107 WeakPolarHBondContact SG-CB 3.35Å; C90-C107 CovalentContact SG-SG 2.04Å; C90-C107 PolarHBondContact SG-SG 3.19Å; C107-V298 PolarHBondContact N-O 2.74Å; C107-V298 PolarHBondContact O-N 3.12Å
108	A	96.8	Very high	90.6	Very high	47 Å²	47	72.1 Å²	72.1	39%	0.388	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	126.8	-179.4	0	0	0	0	0	109.9	P89 T295 L296	P89-A108 VanDerWaalsContact CB-O 3.23Å; P89-A108 WeakPolarHBondContact CB-O 3.4Å; A108-T295 HydrophobicContact CB-CG2 3.94Å; A108-L296 CarbonylContact C-O 3.6Å; A108-L296 WeakPolarHBondContact CA-O 3.38Å
109	L	96.6	Very high	91.1	Very high	9 Å²	9	72 Å²	72	5%	0.047	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	108.9	177.9	-56.9	97.8	0	0	0	109.7	I79 C90 T295 L296 V298	I79-L109 HydrophobicContact CD1-CB 4.05Å; I79-L109 HydrophobicContact CD1-CD2 4.24Å; I79-L109 HydrophobicContact CG1-CD2 4.49Å; C90-L109 VanDerWaalsContact SG-CD1 3.53Å; L109-T295 WeakPolarHBondContact O-CA 3.34Å; L109-L296 HydrophobicContact CB-CB 4.46Å; L109-L296 HydrophobicContact CD1-CD2 4.26Å; L109-L296 HydrophobicContact CD1-CG 4.48Å; L109-L296 PolarHBondContact N-O 3.3Å; L109-L296 PolarHBondContact O-N 3.04Å; L109-V298 HydrophobicContact CD1-CG2 3.78Å
110	P	96.6	Very high	91.9	Very high	98 Å²	98	70.9 Å²	70.9	64%	0.636	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	139.6	170.7	30.8	-32.7	0	0	0	110.1	Y294	P110-Y294 WeakPolarHBondContact CA-O 3.41Å
111	F	97.1	Very high	92.8	Very high	22 Å²	22	63.8 Å²	63.8	10%	0.096	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	162.5	173.4	68.2	-87.2	0	0	0	111.1	F77 I79 L113 L188 Y294 L296 L315	F77-F111 HydrophobicContact CD1-CD2 4.06Å; F77-F111 AromaticContact CD1-CE2 3.92Å; F77-F111 HydrophobicContact CD1-CE2 3.92Å; F77-F111 HydrophobicContact CE1-CB 4.32Å; F77-F111 HydrophobicContact CE1-CD1 4.46Å; F77-F111 AromaticContact CE1-CD2 3.27Å; F77-F111 HydrophobicContact CE1-CD2 3.27Å; F77-F111 AromaticContact CE1-CE2 3.51Å; F77-F111 HydrophobicContact CE1-CE2 3.51Å; F77-F111 AromaticContact CE1-CG 3.79Å; F77-F111 HydrophobicContact CE1-CG 3.79Å; F77-F111 HydrophobicContact CE1-CZ 4.2Å; F77-F111 HydrophobicContact CE2-CD2 4.19Å; F77-F111 HydrophobicContact CZ-CB 3.82Å; F77-F111 AromaticContact CZ-CD2 3.37Å; F77-F111 HydrophobicContact CZ-CD2 3.37Å; F77-F111 HydrophobicContact CZ-CE2 4.08Å; F77-F111 AromaticContact CZ-CG 3.77Å; F77-F111 HydrophobicContact CZ-CG 3.77Å; I79-F111 HydrophobicContact CD1-CB 4.04Å; I79-F111 HydrophobicContact CD1-CD1 4.29Å; I79-F111 HydrophobicContact CD1-CG 4.4Å; F111-L113 HydrophobicContact CD2-CD2 4.15Å; F111-L113 HydrophobicContact CD2-CG 4.4Å; F111-L113 HydrophobicContact CE2-CD2 3.78Å; F111-L113 HydrophobicContact CE2-CG 3.95Å; F111-L188 HydrophobicContact CE1-CD1 3.84Å; F111-L188 HydrophobicContact CZ-CD1 3.61Å; F111-Y294 HydrophobicContact CE2-CD2 4.31Å; F111-Y294 HydrophobicContact CE2-CG 4.11Å; F111-Y294 VanDerWaalsContact CZ-CB 3.41Å; F111-Y294 HydrophobicContact CZ-CG 4.09Å; F111-Y294 PolarHBondContact N-O 3.3Å; F111-Y294 PolarHBondContact O-N 3.19Å; F111-Y294 VanDerWaalsContact O-O 3.12Å; F111-L296 HydrophobicContact CD1-CB 4.45Å; F111-L296 HydrophobicContact CE1-CB 4Å; F111-L315 HydrophobicContact CE2-CD1 4.39Å; F111-L315 HydrophobicContact CZ-CD1 4.2Å
112	S	96.9	Very high	93.6	Very high	64 Å²	64	63.8 Å²	63.8	45%	0.448	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.3	177.8	59.7	0	0	0	0	111.3	G292 N293	S112-G292 CarbonylContact C-O 3.58Å; S112-G292 VanDerWaalsContact CA-O 3.31Å; S112-G292 WeakPolarHBondContact CA-O 3.18Å; S112-N293 WeakPolarHBondContact CB-OD1 3.32Å
113	L	96.9	Very high	94.7	Very high	5 Å²	5	57.6 Å²	57.6	3%	0.026	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	117.3	169.7	-64.2	-177.4	0	0	0	108.9	F77 F111 F117 L289 R291 G292 Y294	F77-L113 HydrophobicContact CB-CD2 3.82Å; F77-L113 HydrophobicContact CD1-CD2 3.94Å; F77-L113 HydrophobicContact CD2-CD2 3.83Å; F77-L113 HydrophobicContact CE2-CD2 4.41Å; F77-L113 HydrophobicContact CG-CD2 3.56Å; F111-L113 HydrophobicContact CD2-CD2 4.15Å; F111-L113 HydrophobicContact CD2-CG 4.4Å; F111-L113 HydrophobicContact CE2-CD2 3.78Å; F111-L113 HydrophobicContact CE2-CG 3.95Å; L113-F117 HydrophobicContact CD1-CD2 4.13Å; L113-F117 HydrophobicContact CD1-CE2 4.01Å; L113-F117 HydrophobicContact CD2-CE2 4.09Å; L113-L289 HydrophobicContact CD1-CB 4.07Å; L113-L289 HydrophobicContact CD1-CD1 4.21Å; L113-R291 WeakPolarHBondContact O-CA 3.44Å; L113-R291 VanDerWaalsContact O-CG 3.26Å; L113-R291 WeakPolarHBondContact O-CG 3.33Å; L113-G292 PolarHBondContact N-O 3.21Å; L113-G292 PolarHBondContact O-N 3.05Å; L113-Y294 HydrophobicContact CB-CD2 4.34Å; L113-Y294 HydrophobicContact CB-CE2 4.06Å; L113-Y294 HydrophobicContact CD1-CD2 3.93Å; L113-Y294 HydrophobicContact CD1-CE2 3.52Å; L113-Y294 HydrophobicContact CG-CD2 3.82Å; L113-Y294 HydrophobicContact CG-CE2 3.78Å
114	E	94.7	Very high	95.4	Very high	156 Å²	156	49.6 Å²	49.6	73%	0.729	28%	0.282	S	S	*	.	S	Bend	trans	-72.1	-32.5	179.4	-64.1	-178.3	177.3	0	0	112.9	R291	E114-R291 VanDerWaalsContact O-CD 3.29Å; E114-R291 WeakPolarHBondContact O-CD 3.36Å; E114-R291 WeakPolarHBondContact O-CG 3.47Å
115	Q	94.1	Very high	96.1	Very high	95 Å²	95	45.8 Å²	45.8	44%	0.444	26%	0.257	S	S	.	.	S	Bend	trans	-123.3	143.4	-176.1	-62	-178.8	12	0	0	110.1	K75	K75-Q115 VanDerWaalsContact CE-OE1 3.23Å
116	P	95.3	Very high	96.3	Very high	48 Å²	48	44.5 Å²	44.5	31%	0.312	25%	0.248	S	C	.	.			trans	-71.7	150.8	176.5	30.8	-34.6	0	0	0	111.7	E118 P287 L289	P116-E118 WeakPolarHBondContact CG-OE1 3.2Å; P116-P287 HydrophobicContact CB-CB 3.81Å; P116-P287 HydrophobicContact CB-CG 4.1Å; P116-L289 CarbonylContact C-O 3.48Å; P116-L289 WeakPolarHBondContact CA-O 3.36Å
117	F	96.1	Very high	96.5	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.031	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-102.3	107.2	172.4	-70.5	-122.5	0	0	0	108.7	K75 F77 L113 V121 T288 L289 L315 T317	K75-F117 HydrophobicContact CB-CD1 4.18Å; K75-F117 HydrophobicContact CB-CE1 3.9Å; K75-F117 HydrophobicContact CB-CE2 4.39Å; K75-F117 HydrophobicContact CB-CZ 4.01Å; K75-F117 WeakPolarHBondContact O-CE1 3.48Å; F77-F117 HydrophobicContact CB-CZ 4.09Å; L113-F117 HydrophobicContact CD1-CD2 4.13Å; L113-F117 HydrophobicContact CD1-CE2 4.01Å; L113-F117 HydrophobicContact CD2-CE2 4.09Å; F117-V121 HydrophobicContact CB-CG2 3.49Å; F117-V121 VanDerWaalsContact CB-CG2 3.49Å; F117-V121 HydrophobicContact CD1-CG1 3.98Å; F117-V121 HydrophobicContact CD1-CG2 3.79Å; F117-V121 HydrophobicContact CE1-CG1 4.43Å; F117-V121 HydrophobicContact CG-CG2 4.01Å; F117-T288 WeakPolarHBondContact O-CB 3.5Å; F117-T288 PolarHBondContact O-N 2.87Å; F117-L289 HydrophobicContact CB-CB 4.07Å; F117-L289 HydrophobicContact CD2-CB 4.43Å; F117-L289 HydrophobicContact CG-CB 4.45Å; F117-L289 PolarHBondContact N-O 3Å; F117-L289 PolarHBondContact O-N 3.36Å; F117-L315 HydrophobicContact CE1-CB 4.43Å; F117-T317 HydrophobicContact CB-CG2 4.22Å; F117-T317 HydrophobicContact CD1-CG2 3.66Å; F117-T317 HydrophobicContact CE1-CG2 4.48Å; F117-T317 HydrophobicContact CG-CG2 4.34Å
118	E	92.9	Very high	96.5	Very high	98 Å²	98	40.9 Å²	40.9	46%	0.458	23%	0.226	S	C	.	.			trans	-82.3	-21.6	-169.6	-64.6	-60.9	160.9	0	0	115.1	P116 K281	P116-E118 WeakPolarHBondContact CG-OE1 3.2Å; E118-K281 VanDerWaalsContact O-CD 3.26Å; E118-K281 WeakPolarHBondContact O-CD 3.47Å; E118-K281 WeakPolarHBondContact O-CE 3.37Å; E118-K281 PolarHBondContact O-NZ 2.98Å
119	S	92.8	Very high	96.6	Very high	49 Å²	49	41.2 Å²	41.2	34%	0.343	22%	0.221	S	C	.	.	S	Bend	trans	-112.5	-175.8	-176.4	61.5	0	0	0	0	111.4	V121 T288 T317	S119-V121 WeakPolarHBondContact O-CG2 3.4Å; S119-V121 PolarHBondContact O-N 2.82Å; S119-T288 VanDerWaalsContact O-CB 3.24Å; S119-T288 WeakPolarHBondContact O-CB 3.29Å; S119-T288 PolarHBondContact O-OG1 3.02Å; S119-T317 WeakPolarHBondContact OG-CB 3.4Å; S119-T317 WeakPolarHBondContact OG-CG2 3.48Å
120	N	95.6	Very high	96.6	Very high	69 Å²	69	42 Å²	42	37%	0.369	22%	0.224	S	C	.	.			trans	-53.2	131.3	171.3	-68.6	-23.5	0	0	0	109.9	F122 K281	N120-F122 HydrophobicContact CB-CE2 4.01Å; N120-F122 HydrophobicContact CB-CZ 4.37Å; N120-K281 WeakPolarHBondContact OD1-CB 3.39Å; N120-K281 PolarHBondContact OD1-N 2.82Å
121	V	97.3	Very high	96.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	133.5	179.5	-174.1	0	0	0	0	109.1	F117 S119 I279 T288 L289 L315	F117-V121 HydrophobicContact CB-CG2 3.49Å; F117-V121 VanDerWaalsContact CB-CG2 3.49Å; F117-V121 HydrophobicContact CD1-CG1 3.98Å; F117-V121 HydrophobicContact CD1-CG2 3.79Å; F117-V121 HydrophobicContact CE1-CG1 4.43Å; F117-V121 HydrophobicContact CG-CG2 4.01Å; S119-V121 WeakPolarHBondContact O-CG2 3.4Å; S119-V121 PolarHBondContact O-N 2.82Å; V121-I279 HydrophobicContact CB-CB 4.18Å; V121-I279 HydrophobicContact CB-CD1 4.37Å; V121-I279 HydrophobicContact CG1-CD1 4.45Å; V121-I279 PolarHBondContact N-O 2.83Å; V121-I279 PolarHBondContact O-N 2.93Å; V121-T288 HydrophobicContact CG2-CG2 3.95Å; V121-L289 HydrophobicContact CB-CD1 4.22Å; V121-L289 HydrophobicContact CG1-CD1 3.9Å; V121-L289 HydrophobicContact CG2-CD1 4.01Å; V121-L289 HydrophobicContact CG2-CG 4.1Å; V121-L315 HydrophobicContact CG1-CB 4.12Å; V121-L315 HydrophobicContact CG1-CD2 4.46Å
122	F	98	Very high	96.7	Very high	28 Å²	28	42.4 Å²	42.4	12%	0.123	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.6	178.9	-63.5	-96.3	0	0	0	108	N120 Y124 L275 I278 S316 I318	N120-F122 HydrophobicContact CB-CE2 4.01Å; N120-F122 HydrophobicContact CB-CZ 4.37Å; F122-Y124 HydrophobicContact CB-CD2 4.31Å; F122-Y124 HydrophobicContact CB-CE2 3.39Å; F122-Y124 WeakPolarHBondContact CB-OH 3.22Å; F122-Y124 WeakPolarHBondContact O-CD2 3.46Å; F122-Y124 WeakPolarHBondContact O-CE2 3.47Å; F122-L275 HydrophobicContact CB-CD1 3.87Å; F122-L275 HydrophobicContact CD1-CD1 3.87Å; F122-L275 HydrophobicContact CD1-CD2 4.24Å; F122-L275 HydrophobicContact CG-CD1 4.38Å; F122-I278 HydrophobicContact CD1-CD1 4.49Å; F122-I278 HydrophobicContact CD1-CG1 3.88Å; F122-I278 HydrophobicContact CE1-CD1 4.15Å; F122-I278 HydrophobicContact CE1-CG1 3.95Å; F122-I278 HydrophobicContact CE1-CG2 4.38Å; F122-S316 PolarHBondContact N-O 2.89Å; F122-S316 PolarHBondContact O-N 3.25Å; F122-I318 HydrophobicContact CD2-CB 4.48Å; F122-I318 HydrophobicContact CD2-CD1 4.26Å; F122-I318 HydrophobicContact CD2-CG1 4.14Å; F122-I318 HydrophobicContact CD2-CG2 3.72Å; F122-I318 HydrophobicContact CE1-CD1 4.37Å; F122-I318 HydrophobicContact CE2-CB 4.33Å; F122-I318 HydrophobicContact CE2-CD1 3.46Å; F122-I318 VanDerWaalsContact CE2-CD1 3.46Å; F122-I318 HydrophobicContact CE2-CG1 3.53Å; F122-I318 HydrophobicContact CE2-CG2 3.99Å; F122-I318 HydrophobicContact CG-CG2 4.32Å; F122-I318 HydrophobicContact CZ-CD1 3.51Å; F122-I318 HydrophobicContact CZ-CG1 4.12Å
123	M	98.3	Very high	96.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	120.3	177.4	-177.6	-179.4	-174.8	0	0	108.6	L186 L202 Y276 R277 L296 V313 I314 L315	M123-L186 HydrophobicContact CE-CB 3.53Å; M123-L186 HydrophobicContact CE-CD1 4.19Å; M123-L186 HydrophobicContact CE-CG 4.49Å; M123-L202 HydrophobicContact SD-CD1 4.06Å; M123-L202 HydrophobicContact SD-CD2 4.27Å; M123-Y276 HydrophobicContact CE-CD1 4.22Å; M123-Y276 HydrophobicContact CG-CD1 4.43Å; M123-Y276 WeakPolarHBondContact O-CA 3.2Å; M123-Y276 VanDerWaalsContact O-CB 3.32Å; M123-Y276 WeakPolarHBondContact O-CB 3.32Å; M123-Y276 PolarHBondContact O-N 2.9Å; M123-Y276 HydrophobicContact SD-CD1 3.97Å; M123-R277 HydrophobicContact CB-CB 4.34Å; M123-R277 PolarHBondContact N-O 3.35Å; M123-R277 PolarHBondContact O-N 2.71Å; M123-R277 VanDerWaalsContact O-N 3.11Å; M123-L296 HydrophobicContact CE-CD1 3.95Å; M123-V313 HydrophobicContact CE-CG1 3.69Å; M123-V313 HydrophobicContact CE-CG2 4.44Å; M123-V313 HydrophobicContact CG-CG1 4.11Å; M123-I314 CarbonylContact C-O 3.51Å; M123-I314 WeakPolarHBondContact CA-O 3.36Å; M123-L315 HydrophobicContact CB-CD2 3.79Å; M123-L315 HydrophobicContact CG-CD2 3.74Å; M123-L315 HydrophobicContact SD-CD2 4.48Å
124	Y	98.6	Very high	96.7	Very high	39 Å²	39	47.7 Å²	47.7	15%	0.153	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	146.4	177.4	-54.8	-97.4	0	0	0	110.1	F122 R273 K274 L275 V313 I314	F122-Y124 HydrophobicContact CB-CD2 4.31Å; F122-Y124 HydrophobicContact CB-CE2 3.39Å; F122-Y124 WeakPolarHBondContact CB-OH 3.22Å; F122-Y124 WeakPolarHBondContact O-CD2 3.46Å; F122-Y124 WeakPolarHBondContact O-CE2 3.47Å; Y124-R273 HydrophobicContact CD1-CG 4.25Å; Y124-R273 HydrophobicContact CG-CG 4.5Å; Y124-K274 WeakPolarHBondContact CA-O 3.38Å; Y124-K274 WeakPolarHBondContact CB-O 3.48Å; Y124-L275 HydrophobicContact CD1-CB 4.09Å; Y124-L275 HydrophobicContact CD1-CD1 4.21Å; Y124-L275 HydrophobicContact CE1-CB 3.93Å; Y124-L275 HydrophobicContact CE1-CD1 3.86Å; Y124-L275 HydrophobicContact CE1-CG 4.47Å; Y124-V313 WeakPolarHBondContact O-CA 3.48Å; Y124-I314 PolarHBondContact N-O 2.84Å; Y124-I314 PolarHBondContact O-N 2.81Å
125	Y	98.4	Very high	96.8	Very high	6 Å²	6	49.2 Å²	49.2	2%	0.024	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	138.8	156.4	62	-95.9	0	0	0	108.8	F182 W263 R273 K274 Y276 R312	Y125-F182 AromaticContact CD1-CD1 3.81Å; Y125-F182 HydrophobicContact CD1-CD1 3.81Å; Y125-F182 AromaticContact CD1-CE1 3.72Å; Y125-F182 HydrophobicContact CD1-CE1 3.72Å; Y125-F182 HydrophobicContact CD1-CZ 4.41Å; Y125-F182 HydrophobicContact CD2-CD1 4.01Å; Y125-F182 HydrophobicContact CD2-CD2 4.16Å; Y125-F182 HydrophobicContact CD2-CE1 4.12Å; Y125-F182 HydrophobicContact CD2-CE2 4.26Å; Y125-F182 HydrophobicContact CD2-CG 4Å; Y125-F182 HydrophobicContact CD2-CZ 4.22Å; Y125-F182 AromaticContact CE1-CD1 3.8Å; Y125-F182 HydrophobicContact CE1-CD1 3.8Å; Y125-F182 HydrophobicContact CE1-CE1 4.18Å; Y125-F182 HydrophobicContact CE1-CG 4.45Å; Y125-F182 HydrophobicContact CE2-CB 3.97Å; Y125-F182 AromaticContact CE2-CD1 3.95Å; Y125-F182 HydrophobicContact CE2-CD1 3.95Å; Y125-F182 HydrophobicContact CE2-CD2 4.29Å; Y125-F182 AromaticContact CE2-CG 3.8Å; Y125-F182 HydrophobicContact CE2-CG 3.8Å; Y125-F182 AromaticContact CG-CD1 3.95Å; Y125-F182 HydrophobicContact CG-CD1 3.95Å; Y125-F182 AromaticContact CG-CE1 3.71Å; Y125-F182 HydrophobicContact CG-CE1 3.71Å; Y125-F182 HydrophobicContact CG-CE2 4.45Å; Y125-F182 HydrophobicContact CG-CG 4.4Å; Y125-F182 AromaticContact CG-CZ 3.95Å; Y125-F182 HydrophobicContact CG-CZ 3.95Å; Y125-F182 AromaticContact CZ-CD1 3.85Å; Y125-W263 HydrophobicContact CE2-CE3 4.36Å; Y125-W263 HydrophobicContact CE2-CZ3 4.32Å; Y125-R273 CarbonylContact O-C 3.47Å; Y125-R273 VanDerWaalsContact O-CA 3.28Å; Y125-R273 WeakPolarHBondContact O-CA 3.32Å; Y125-K274 HydrophobicContact CD2-CB 4.29Å; Y125-K274 HydrophobicContact CE1-CB 3.92Å; Y125-K274 HydrophobicContact CE2-CB 3.63Å; Y125-K274 HydrophobicContact CE2-CD 3.81Å; Y125-K274 HydrophobicContact CE2-CG 4.23Å; Y125-K274 VanDerWaalsContact CZ-CB 3.41Å; Y125-K274 PolarHBondContact N-O 3.34Å; Y125-K274 PolarHBondContact O-N 3.06Å; Y125-K274 WeakPolarHBondContact OH-CB 3.4Å; Y125-K274 WeakPolarHBondContact OH-CD 3.37Å; Y125-Y276 AromaticContact CD1-CD2 3.94Å; Y125-Y276 HydrophobicContact CD1-CD2 3.94Å; Y125-Y276 HydrophobicContact CD1-CG 4.16Å; Y125-Y276 HydrophobicContact CE1-CD2 4.18Å; Y125-R312 CarbonylContact C-O 3.58Å; Y125-R312 WeakPolarHBondContact CA-O 3.48Å
126	G	98.3	Very high	96.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136	174.2	0	0	0	0	0	110.9	F272 K311 R312	G126-F272 CarbonylContact C-O 3.57Å; G126-F272 VanDerWaalsContact CA-O 3.22Å; G126-F272 WeakPolarHBondContact CA-O 3.46Å; G126-K311 WeakPolarHBondContact O-CA 3.05Å; G126-R312 PolarHBondContact N-O 3.47Å; G126-R312 PolarHBondContact O-N 3.33Å
127	L	98.3	Very high	97	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.6	171	-65.1	178.9	0	0	0	108.7	F130 F182 W263 T271 F272 Y302 V304 R310 K311	L127-F130 HydrophobicContact CB-CB 4.37Å; L127-F182 HydrophobicContact CD1-CD2 4.34Å; L127-F182 HydrophobicContact CD2-CD2 4.37Å; L127-F182 HydrophobicContact CD2-CE2 4.34Å; L127-W263 HydrophobicContact CD1-CH2 4.04Å; L127-W263 HydrophobicContact CD1-CZ3 3.88Å; L127-T271 WeakPolarHBondContact O-CA 3.47Å; L127-F272 HydrophobicContact CB-CE1 4.14Å; L127-F272 HydrophobicContact CB-CE2 4.15Å; L127-F272 HydrophobicContact CB-CZ 3.82Å; L127-F272 HydrophobicContact CD1-CE2 4.19Å; L127-F272 HydrophobicContact CD1-CZ 3.84Å; L127-F272 HydrophobicContact CG-CE2 4.44Å; L127-F272 HydrophobicContact CG-CZ 4.31Å; L127-F272 PolarHBondContact N-O 2.88Å; L127-F272 PolarHBondContact O-N 3.01Å; L127-Y302 HydrophobicContact CD1-CE1 4.09Å; L127-V304 HydrophobicContact CD2-CG1 4.49Å; L127-R310 WeakPolarHBondContact CA-O 2.98Å; L127-K311 HydrophobicContact CD2-CB 4.44Å; L127-K311 HydrophobicContact CD2-CD 4.28Å; L127-K311 HydrophobicContact CD2-CG 3.74Å
128	S	97.9	Very high	97	Very high	16 Å²	16	55.2 Å²	55.2	11%	0.112	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	153.3	172.7	-45.3	0	0	0	0	110.1	F130 G309 R310 R312	S128-F130 VanDerWaalsContact C-N 3.25Å; S128-F130 PolarHBondContact O-N 2.9Å; S128-G309 VanDerWaalsContact O-CA 3.28Å; S128-G309 WeakPolarHBondContact O-CA 3.33Å; S128-R310 PolarHBondContact N-O 2.93Å; S128-R310 PolarHBondContact O-N 2.88Å; S128-R312 PolarHBondContact OG-NH1 2.8Å; S128-R312 PolarHBondContact OG-NH2 2.98Å
129	N	97.3	Very high	97.2	Very high	54 Å²	54	55 Å²	55	29%	0.289	25%	0.247	S	C	.	.	S	Bend	trans	58.9	34.5	-175.6	-150.2	21.7	0	0	0	113.3	Y131 P270 F307	N129-Y131 VanDerWaalsContact OD1-CE2 3.22Å; N129-Y131 WeakPolarHBondContact OD1-CE2 3.39Å; N129-Y131 PolarHBondContact OD1-OH 3.08Å; N129-P270 PolarHBondContact N-O 2.86Å; N129-F307 PolarHBondContact ND2-O 2.88Å; N129-F307 WeakPolarHBondContact O-CD2 3.3Å
130	F	97.6	Very high	97.5	Very high	25 Å²	25	52.8 Å²	52.8	11%	0.11	23%	0.232	C	C	.	.			trans	-123.4	104.1	177.9	-169.7	-88.3	0	0	0	110.7	L127 S128 Q132 Y137 W263 P270 F272 Y302 F307	L127-F130 HydrophobicContact CB-CB 4.37Å; S128-F130 VanDerWaalsContact C-N 3.25Å; S128-F130 PolarHBondContact O-N 2.9Å; F130-Q132 HydrophobicContact CD1-CG 3.55Å; F130-Q132 HydrophobicContact CE1-CG 3.51Å; F130-Q132 PolarHBondContact O-N 3.28Å; F130-Y137 HydrophobicContact CE1-CE2 4.47Å; F130-Y137 HydrophobicContact CZ-CE2 4.36Å; F130-W263 HydrophobicContact CD1-CH2 4.39Å; F130-W263 AromaticContact CE1-CH2 3.71Å; F130-W263 HydrophobicContact CE1-CH2 3.71Å; F130-W263 AromaticContact CE1-CZ2 3.91Å; F130-W263 HydrophobicContact CE1-CZ2 3.91Å; F130-W263 AromaticContact CZ-CH2 3.97Å; F130-W263 HydrophobicContact CZ-CH2 3.97Å; F130-W263 HydrophobicContact CZ-CZ2 4.01Å; F130-P270 PolarHBondContact N-O 3.48Å; F130-P270 WeakPolarHBondContact O-CA 3.41Å; F130-F272 HydrophobicContact CB-CE1 4.04Å; F130-F272 AromaticContact CD1-CE1 3.8Å; F130-F272 HydrophobicContact CD1-CE1 3.8Å; F130-F272 AromaticContact CD1-CZ 3.85Å; F130-F272 HydrophobicContact CD1-CZ 3.85Å; F130-F272 HydrophobicContact CG-CE1 4.37Å; F130-F272 WeakPolarHBondContact O-CE1 3.19Å; F130-Y302 WeakPolarHBondContact CE2-OH 3.45Å; F130-Y302 WeakPolarHBondContact CZ-OH 3.5Å; F130-F307 HydrophobicContact CB-CE2 4.49Å; F130-F307 AromaticContact CD2-CE2 3.99Å; F130-F307 HydrophobicContact CD2-CE2 3.99Å; F130-F307 AromaticContact CD2-CZ 3.84Å; F130-F307 HydrophobicContact CD2-CZ 3.84Å; F130-F307 HydrophobicContact CE2-CZ 4.44Å
131	Y	97.3	Very high	97.5	Very high	129 Å²	129	52.1 Å²	52.1	51%	0.506	22%	0.224	S	C	.	.			trans	-85.8	74	-168.2	-63.1	-94.7	0	0	0	113.2	N129 N133 H134 P270	N129-Y131 VanDerWaalsContact OD1-CE2 3.22Å; N129-Y131 WeakPolarHBondContact OD1-CE2 3.39Å; N129-Y131 PolarHBondContact OD1-OH 3.08Å; Y131-N133 PolarHBondContact O-N 2.76Å; Y131-H134 PolarHBondContact O-N 3.35Å; Y131-P270 HydrophobicContact CD1-CB 3.65Å; Y131-P270 HydrophobicContact CD1-CG 4.27Å; Y131-P270 HydrophobicContact CD2-CB 4.43Å; Y131-P270 HydrophobicContact CE1-CB 3.52Å; Y131-P270 HydrophobicContact CE1-CG 3.86Å; Y131-P270 HydrophobicContact CE2-CB 4.32Å; Y131-P270 HydrophobicContact CG-CB 4.1Å
132	Q	97.6	Very high	97.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-21.3	174.2	-68	-162.1	-19.5	0	0	113.7	F130 H134 Y137 V138 W263 A267 F272	F130-Q132 HydrophobicContact CD1-CG 3.55Å; F130-Q132 HydrophobicContact CE1-CG 3.51Å; F130-Q132 PolarHBondContact O-N 3.28Å; Q132-H134 VanDerWaalsContact C-N 3.28Å; Q132-H134 PolarHBondContact O-N 2.95Å; Q132-Y137 HydrophobicContact CB-CD1 4.32Å; Q132-Y137 HydrophobicContact CB-CE1 3.92Å; Q132-Y137 HydrophobicContact CG-CE1 3.88Å; Q132-Y137 WeakPolarHBondContact O-CD1 2.97Å; Q132-V138 WeakPolarHBondContact O-CG2 3.15Å; Q132-W263 VanDerWaalsContact NE2-CZ2 3.35Å; Q132-A267 HydrophobicContact CB-CB 4.4Å; Q132-F272 HydrophobicContact CG-CE1 3.9Å; Q132-F272 HydrophobicContact CG-CZ 3.99Å
133	N	97.1	Very high	97.5	Very high	74 Å²	74	55 Å²	55	40%	0.396	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.5	-178.2	64.1	-12	0	0	0	113.8	Y131 R135 A268	Y131-N133 PolarHBondContact O-N 2.76Å; N133-R135 PolarHBondContact O-N 3.03Å; N133-A268 WeakPolarHBondContact CB-O 3.35Å; N133-A268 PolarHBondContact ND2-O 3.43Å
134	H	97.4	Very high	97.5	Very high	107 Å²	107	58 Å²	58	50%	0.495	26%	0.261	S	S	.	.			trans	-63.5	129.8	177.3	-173.8	-91.7	0	0	0	110.9	Y131 Q132 R136 Y137 V138	Y131-H134 PolarHBondContact O-N 3.35Å; Q132-H134 VanDerWaalsContact C-N 3.28Å; Q132-H134 PolarHBondContact O-N 2.95Å; H134-R136 VanDerWaalsContact C-N 3.34Å; H134-R136 PolarHBondContact ND1-N 2.73Å; H134-R136 PolarHBondContact O-N 2.78Å; H134-R136 VanDerWaalsContact O-N 3.17Å; H134-Y137 WeakPolarHBondContact O-CA 3.48Å; H134-Y137 WeakPolarHBondContact O-CB 3.35Å; H134-Y137 PolarHBondContact O-N 3.38Å; H134-V138 PolarHBondContact O-N 3.24Å
135	R	96.4	Very high	97.4	Very high	188 Å²	188	56.1 Å²	56.1	71%	0.709	25%	0.254	S	S	*	.	H	α-helix	trans	-50.4	-47.3	-172.1	180	-179.5	175.9	-133.1	1.7	113.8	N133 Y137 K139	N133-R135 PolarHBondContact O-N 3.03Å; R135-Y137 VanDerWaalsContact C-N 3.31Å; R135-Y137 PolarHBondContact O-N 3.44Å; R135-K139 HydrophobicContact CG-CD 4.31Å; R135-K139 WeakPolarHBondContact O-CB 3.18Å; R135-K139 WeakPolarHBondContact O-CG 3.28Å; R135-K139 PolarHBondContact O-N 3.49Å; R135-K139 VanDerWaalsContact O-N 3.14Å
136	R	96.3	Very high	97.3	Very high	206 Å²	206	56 Å²	56	78%	0.777	25%	0.254	S	S	*	.	H	α-helix	trans	-66.7	-32.9	178.8	-73.4	-175.4	166.7	176.4	-4	112.5	H134 S140	H134-R136 VanDerWaalsContact C-N 3.34Å; H134-R136 PolarHBondContact ND1-N 2.73Å; H134-R136 PolarHBondContact O-N 2.78Å; H134-R136 VanDerWaalsContact O-N 3.17Å; R136-S140 VanDerWaalsContact O-CB 3.29Å; R136-S140 WeakPolarHBondContact O-CB 3.46Å; R136-S140 PolarHBondContact O-N 2.88Å
137	Y	97.3	Very high	97.2	Very high	29 Å²	29	59.5 Å²	59.5	11%	0.114	27%	0.273	C	S	.	.	H	α-helix	trans	-70.6	-50.5	177.8	-176.8	-86.3	0	0	0	110.3	F130 Q132 H134 R135 K139 S140 A176 I177 S180 W263 T266	F130-Y137 HydrophobicContact CE1-CE2 4.47Å; F130-Y137 HydrophobicContact CZ-CE2 4.36Å; Q132-Y137 HydrophobicContact CB-CD1 4.32Å; Q132-Y137 HydrophobicContact CB-CE1 3.92Å; Q132-Y137 HydrophobicContact CG-CE1 3.88Å; Q132-Y137 WeakPolarHBondContact O-CD1 2.97Å; H134-Y137 WeakPolarHBondContact O-CA 3.48Å; H134-Y137 WeakPolarHBondContact O-CB 3.35Å; H134-Y137 PolarHBondContact O-N 3.38Å; R135-Y137 VanDerWaalsContact C-N 3.31Å; R135-Y137 PolarHBondContact O-N 3.44Å; Y137-K139 VanDerWaalsContact C-N 3.28Å; Y137-K139 PolarHBondContact O-N 2.79Å; Y137-S140 PolarHBondContact O-N 3.11Å; Y137-S140 VanDerWaalsContact O-N 3.08Å; Y137-A176 HydrophobicContact CD2-CB 4.05Å; Y137-A176 HydrophobicContact CE2-CB 4.42Å; Y137-I177 HydrophobicContact CD1-CG1 3.85Å; Y137-I177 HydrophobicContact CE1-CB 4.21Å; Y137-I177 HydrophobicContact CE1-CG1 3.64Å; Y137-I177 HydrophobicContact CE1-CG2 4.21Å; Y137-I177 WeakPolarHBondContact O-CD1 3.42Å; Y137-I177 WeakPolarHBondContact O-CG1 3.45Å; Y137-S180 WeakPolarHBondContact CE2-OG 3.44Å; Y137-S180 PolarHBondContact OH-OG 2.87Å; Y137-W263 WeakPolarHBondContact OH-CZ2 3.48Å; Y137-T266 HydrophobicContact CE1-CG2 4.39Å
138	V	97.3	Very high	97	Very high	41 Å²	41	60 Å²	60	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-59.6	-38.5	-179.7	178.5	0	0	0	0	112.4	Q132 H134 S140 T266	Q132-V138 WeakPolarHBondContact O-CG2 3.15Å; H134-V138 PolarHBondContact O-N 3.24Å; V138-S140 VanDerWaalsContact C-N 3.33Å; V138-T266 HydrophobicContact CG2-CG2 4.38Å
139	K	96.8	Very high	96.9	Very high	92 Å²	92	62 Å²	62	40%	0.4	29%	0.287	S	S	.	.	H	α-helix	trans	-72.5	-24.6	178.2	-76.8	-175.1	157.4	-138.6	0	113.8	R135 Y137 R141	R135-K139 HydrophobicContact CG-CD 4.31Å; R135-K139 WeakPolarHBondContact O-CB 3.18Å; R135-K139 WeakPolarHBondContact O-CG 3.28Å; R135-K139 PolarHBondContact O-N 3.49Å; R135-K139 VanDerWaalsContact O-N 3.14Å; Y137-K139 VanDerWaalsContact C-N 3.28Å; Y137-K139 PolarHBondContact O-N 2.79Å; K139-R141 VanDerWaalsContact C-N 3.28Å; K139-R141 PolarHBondContact O-N 2.98Å
140	S	97.9	Very high	96.6	Very high	4 Å²	4	63.3 Å²	63.3	3%	0.028	30%	0.298	C	S	.	.			trans	-79.8	75	-172.4	-166.8	0	0	0	0	112.2	R136 Y137 V138 E159 G175 A176	R136-S140 VanDerWaalsContact O-CB 3.29Å; R136-S140 WeakPolarHBondContact O-CB 3.46Å; R136-S140 PolarHBondContact O-N 2.88Å; Y137-S140 PolarHBondContact O-N 3.11Å; Y137-S140 VanDerWaalsContact O-N 3.08Å; V138-S140 VanDerWaalsContact C-N 3.33Å; S140-E159 VanDerWaalsContact CA-O 3.29Å; S140-E159 WeakPolarHBondContact CA-O 3.43Å; S140-E159 PolarHBondContact OG-O 3.29Å; S140-G175 CarbonylContact O-C 3.55Å; S140-G175 VanDerWaalsContact O-CA 3.24Å; S140-G175 WeakPolarHBondContact O-CA 3.12Å; S140-G175 WeakPolarHBondContact OG-CA 3.34Å; S140-A176 PolarHBondContact O-N 3.42Å; S140-A176 PolarHBondContact OG-N 2.86Å
141	R	97.1	Very high	96.4	Very high	55 Å²	55	66.5 Å²	66.5	21%	0.208	32%	0.319	C	S	.	.			trans	-159.9	164.2	171.5	62.3	174.3	179.6	-134.6	-10.5	110.2	K139 D143 L146 C160 I177 M264	K139-R141 VanDerWaalsContact C-N 3.28Å; K139-R141 PolarHBondContact O-N 2.98Å; R141-D143 WeakPolarHBondContact CD-OD1 3.41Å; R141-D143 IonicContact NE-OD1 2.7Å; R141-D143 PolarHBondContact NE-OD1 3.13Å; R141-D143 IonicContact NE-OD2 2.6Å; R141-D143 PolarHBondContact NE-OD2 3.4Å; R141-L146 HydrophobicContact CB-CD1 4.41Å; R141-C160 VanDerWaalsContact CA-SG 3.59Å; R141-I177 HydrophobicContact CB-CD1 4.16Å; R141-I177 HydrophobicContact CG-CD1 4.17Å; R141-M264 HydrophobicContact CB-CE 4.19Å
142	D	97.9	Very high	96.3	Very high	11 Å²	11	61.1 Å²	61.1	6%	0.059	30%	0.3	C	S	.	.			trans	-121.8	104.6	171.5	-174.1	-27.4	0	0	0	109.7	S144 Q145 L146 P156 S157 C174	D142-S144 VanDerWaalsContact C-N 3.28Å; D142-S144 PolarHBondContact O-N 3.26Å; D142-S144 WeakPolarHBondContact OD1-CA 3.4Å; D142-S144 WeakPolarHBondContact OD1-CB 3.47Å; D142-S144 PolarHBondContact OD1-N 2.97Å; D142-Q145 HydrophobicContact CB-CB 3.82Å; D142-Q145 PolarHBondContact O-N 3.3Å; D142-Q145 PolarHBondContact OD1-N 2.99Å; D142-L146 WeakPolarHBondContact O-CG 3.42Å; D142-L146 PolarHBondContact O-N 3.21Å; D142-P156 WeakPolarHBondContact OD2-CA 3.24Å; D142-S157 WeakPolarHBondContact OD2-CB 3.44Å; D142-S157 PolarHBondContact OD2-N 3.19Å; D142-C174 VanDerWaalsContact CB-SG 3.54Å
143	D	97.3	Very high	96.1	Very high	76 Å²	76	61.4 Å²	61.4	41%	0.406	30%	0.302	S	S	.	.	H	α-helix	trans	-69	-25.8	-177.8	-69.3	-45.7	0	0	0	112.4	R141 N147	R141-D143 WeakPolarHBondContact CD-OD1 3.41Å; R141-D143 IonicContact NE-OD1 2.7Å; R141-D143 PolarHBondContact NE-OD1 3.13Å; R141-D143 IonicContact NE-OD2 2.6Å; R141-D143 PolarHBondContact NE-OD2 3.4Å; D143-N147 VanDerWaalsContact O-CB 3.31Å; D143-N147 WeakPolarHBondContact O-CB 3.24Å; D143-N147 PolarHBondContact O-N 2.7Å
144	S	97	Very high	96	Very high	63 Å²	63	61.8 Å²	61.8	44%	0.441	30%	0.303	S	S	.	.	H	α-helix	trans	-71.6	-42.4	174.6	-63.3	0	0	0	0	111	D142 N147 G148 D149 S152	D142-S144 VanDerWaalsContact C-N 3.28Å; D142-S144 PolarHBondContact O-N 3.26Å; D142-S144 WeakPolarHBondContact OD1-CA 3.4Å; D142-S144 WeakPolarHBondContact OD1-CB 3.47Å; D142-S144 PolarHBondContact OD1-N 2.97Å; S144-N147 PolarHBondContact O-N 3.19Å; S144-G148 PolarHBondContact O-N 2.9Å; S144-D149 WeakPolarHBondContact O-CB 3.48Å; S144-D149 PolarHBondContact O-N 3.18Å; S144-D149 VanDerWaalsContact O-N 3.11Å; S144-S152 WeakPolarHBondContact CB-OG 3.47Å
145	Q	96.7	Very high	95.9	Very high	1 Å²	1	62 Å²	62	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-59.4	-47.2	172.5	-176.3	-173.7	70.2	0	0	110.9	D142 N147 G148 L153 I171 F255	D142-Q145 HydrophobicContact CB-CB 3.82Å; D142-Q145 PolarHBondContact O-N 3.3Å; D142-Q145 PolarHBondContact OD1-N 2.99Å; Q145-N147 PolarHBondContact O-N 3.28Å; Q145-G148 PolarHBondContact O-N 2.98Å; Q145-L153 HydrophobicContact CG-CD1 4.04Å; Q145-I171 PolarHBondContact NE2-O 2.87Å; Q145-F255 HydrophobicContact CG-CE2 4.28Å; Q145-F255 HydrophobicContact CG-CZ 4.16Å; Q145-F255 WeakPolarHBondContact O-CE2 3.45Å
146	L	97.1	Very high	95.8	Very high	3 Å²	3	54 Å²	54	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-23	-179.2	-65.1	168.5	0	0	0	113.2	R141 D142 P173 F217 R218 F255 F260 M264	R141-L146 HydrophobicContact CB-CD1 4.41Å; D142-L146 WeakPolarHBondContact O-CG 3.42Å; D142-L146 PolarHBondContact O-N 3.21Å; L146-P173 HydrophobicContact CD2-CB 3.93Å; L146-F217 HydrophobicContact CB-CD1 3.97Å; L146-F217 HydrophobicContact CB-CE1 4Å; L146-F217 HydrophobicContact CD1-CE1 3.98Å; L146-F217 HydrophobicContact CD2-CD1 4.4Å; L146-F217 HydrophobicContact CD2-CE1 4.13Å; L146-F217 HydrophobicContact CG-CE1 4.25Å; L146-F217 WeakPolarHBondContact O-CA 3.32Å; L146-R218 PolarHBondContact O-N 3.3Å; L146-F255 HydrophobicContact CD2-CD1 4.25Å; L146-F255 HydrophobicContact CD2-CE1 4.39Å; L146-F260 HydrophobicContact CD2-CE1 3.83Å; L146-F260 HydrophobicContact CD2-CZ 3.69Å; L146-M264 HydrophobicContact CD1-CE 3.49Å; L146-M264 VanDerWaalsContact CD1-CE 3.49Å; L146-M264 HydrophobicContact CD2-CE 4.3Å
147	N	96.3	Very high	95.7	Very high	74 Å²	74	46.3 Å²	46.3	40%	0.396	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	8.8	171.3	-166.5	36.6	0	0	0	113.1	D143 S144 Q145 V215	D143-N147 VanDerWaalsContact O-CB 3.31Å; D143-N147 WeakPolarHBondContact O-CB 3.24Å; D143-N147 PolarHBondContact O-N 2.7Å; S144-N147 PolarHBondContact O-N 3.19Å; Q145-N147 PolarHBondContact O-N 3.28Å; N147-V215 PolarHBondContact OD1-O 2.99Å
148	G	93.9	Very high	95.6	Very high	13 Å²	13	53.2 Å²	53.2	13%	0.134	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	17.5	172.6	0	0	0	0	0	115.1	S144 Q145 T150 R218 P220	S144-G148 PolarHBondContact O-N 2.9Å; Q145-G148 PolarHBondContact O-N 2.98Å; G148-T150 PolarHBondContact O-N 3.27Å; G148-R218 WeakPolarHBondContact CA-O 3.35Å; G148-R218 PolarHBondContact N-O 3.2Å; G148-P220 WeakPolarHBondContact O-CA 3.4Å
149	D	94.8	Very high	95.6	Very high	56 Å²	56	55.8 Å²	55.8	30%	0.299	30%	0.298	S	S	.	.			trans	-67.2	124.1	174	175.5	45.4	0	0	0	111.1	S144 T151 S152 L153	S144-D149 WeakPolarHBondContact O-CB 3.48Å; S144-D149 PolarHBondContact O-N 3.18Å; S144-D149 VanDerWaalsContact O-N 3.11Å; D149-T151 VanDerWaalsContact C-N 3.31Å; D149-T151 PolarHBondContact O-N 2.8Å; D149-T151 PolarHBondContact OD1-N 2.78Å; D149-T151 PolarHBondContact OD2-OG1 2.69Å; D149-S152 PolarHBondContact O-N 3.44Å; D149-S152 WeakPolarHBondContact OD2-CB 3.15Å; D149-S152 PolarHBondContact OD2-N 3.18Å; D149-S152 PolarHBondContact OD2-OG 3.29Å; D149-L153 WeakPolarHBondContact O-CB 3.37Å; D149-L153 PolarHBondContact O-N 3.35Å
150	T	92.1	Very high	95.6	Very high	82 Å²	82	51.4 Å²	51.4	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-71	-27.5	-175.4	54.6	0	0	0	0	112.3	G148	G148-T150 PolarHBondContact O-N 3.27Å
151	T	93.8	Very high	95.4	Very high	92 Å²	92	57.6 Å²	57.6	56%	0.564	31%	0.307	S	S	*	.	H	α-helix	trans	-72.4	-45.6	177.5	75.3	0	0	0	0	111.2	D149 L153 M154 N155	D149-T151 VanDerWaalsContact C-N 3.31Å; D149-T151 PolarHBondContact O-N 2.8Å; D149-T151 PolarHBondContact OD1-N 2.78Å; D149-T151 PolarHBondContact OD2-OG1 2.69Å; T151-L153 VanDerWaalsContact C-N 3.26Å; T151-L153 PolarHBondContact O-N 3Å; T151-M154 PolarHBondContact O-N 3.21Å; T151-N155 PolarHBondContact O-N 2.62Å
152	S	94.6	Very high	95.3	Very high	16 Å²	16	59.8 Å²	59.8	11%	0.112	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-24.3	176.1	-53.6	0	0	0	0	112.5	S144 D149 N155 P156	S144-S152 WeakPolarHBondContact CB-OG 3.47Å; D149-S152 PolarHBondContact O-N 3.44Å; D149-S152 WeakPolarHBondContact OD2-CB 3.15Å; D149-S152 PolarHBondContact OD2-N 3.18Å; D149-S152 PolarHBondContact OD2-OG 3.29Å; S152-N155 CarbonylContact O-C 3.44Å; S152-P156 WeakPolarHBondContact O-CA 3.47Å
153	L	94.1	Very high	95.3	Very high	6 Å²	6	62.7 Å²	62.7	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-63.1	-41.1	173.2	-168.8	67.4	0	0	0	112.5	Q145 D149 T151 A172 P220 F230 T233 F255	Q145-L153 HydrophobicContact CG-CD1 4.04Å; D149-L153 WeakPolarHBondContact O-CB 3.37Å; D149-L153 PolarHBondContact O-N 3.35Å; T151-L153 VanDerWaalsContact C-N 3.26Å; T151-L153 PolarHBondContact O-N 3Å; L153-A172 HydrophobicContact CD1-CB 3.74Å; L153-P220 HydrophobicContact CD2-CB 4.07Å; L153-P220 HydrophobicContact CD2-CG 3.95Å; L153-F230 HydrophobicContact CD1-CD1 4.07Å; L153-F230 HydrophobicContact CD1-CE1 4.03Å; L153-T233 HydrophobicContact CD1-CG2 3.96Å; L153-T233 HydrophobicContact CD2-CG2 4.22Å; L153-T233 HydrophobicContact CG-CG2 3.69Å; L153-F255 HydrophobicContact CD1-CE2 4.35Å; L153-F255 HydrophobicContact CD1-CZ 4.29Å
154	M	93.8	Very high	95.3	Very high	83 Å²	83	59.6 Å²	59.6	41%	0.409	32%	0.324	S	S	.	.	H	α-helix	trans	-87.9	-30.3	-179.8	-66.3	-65	-178.6	0	0	113.2	T151 R165 P170 Q231	T151-M154 PolarHBondContact O-N 3.21Å; M154-R165 PolarHBondContact O-NH2 3.45Å; M154-P170 HydrophobicContact SD-CG 4.46Å; M154-Q231 WeakPolarHBondContact CE-O 3.5Å
155	N	94.9	Very high	95.2	Very high	112 Å²	112	61.7 Å²	61.7	60%	0.599	32%	0.322	S	S	*	.	S	Bend	trans	-126.8	75.5	-178.6	-65.2	-45.3	0	0	0	110.3	T151 S152 R165	T151-N155 PolarHBondContact O-N 2.62Å; S152-N155 CarbonylContact O-C 3.44Å; N155-R165 PolarHBondContact OD1-NH2 3.17Å
156	P	94.3	Very high	95	Very high	18 Å²	18	64.7 Å²	64.7	12%	0.117	34%	0.338	C	S	.	.			trans	-64.8	153	-178.9	24.7	-32.9	0	0	0	112.1	D142 S152 A164 P170 C174	D142-P156 WeakPolarHBondContact OD2-CA 3.24Å; S152-P156 WeakPolarHBondContact O-CA 3.47Å; P156-A164 HydrophobicContact CG-CB 4.2Å; P156-A164 WeakPolarHBondContact CG-O 3.4Å; P156-P170 HydrophobicContact CG-CB 4.22Å; P156-C174 HydrophobicContact CB-CB 4.11Å; P156-C174 VanDerWaalsContact CB-SG 3.55Å
157	S	95.3	Very high	94.6	Very high	46 Å²	46	73.3 Å²	73.3	32%	0.322	38%	0.378	S	S	.	.			trans	-54.8	146.7	177	178.1	0	0	0	0	113.1	D142 E159 C160	D142-S157 WeakPolarHBondContact OD2-CB 3.44Å; D142-S157 PolarHBondContact OD2-N 3.19Å; S157-E159 PolarHBondContact O-N 2.99Å; S157-E159 PolarHBondContact OG-N 3.11Å; S157-C160 WeakPolarHBondContact O-CB 3.43Å; S157-C160 PolarHBondContact O-N 3.25Å; S157-C160 VanDerWaalsContact O-N 3.09Å
158	K	95.3	Very high	94.3	Very high	174 Å²	174	78.6 Å²	78.6	76%	0.757	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-62.2	-23.5	174.6	-63.9	-177	179.6	-178.6	0	113	C160 E161	K158-C160 PolarHBondContact O-N 3.33Å; K158-E161 WeakPolarHBondContact O-CB 3.42Å; K158-E161 WeakPolarHBondContact O-CG 3.42Å; K158-E161 PolarHBondContact O-N 3.47Å; K158-E161 VanDerWaalsContact O-N 3.08Å
159	E	96.5	Very high	94.3	Very high	95 Å²	95	82 Å²	82	44%	0.444	41%	0.411	S	S	.	.	G	3₁₀ helix	trans	-63.3	-22.5	176.3	-63.1	-73.1	163.9	0	0	111.8	S140 S157 E161	S140-E159 VanDerWaalsContact CA-O 3.29Å; S140-E159 WeakPolarHBondContact CA-O 3.43Å; S140-E159 PolarHBondContact OG-O 3.29Å; S157-E159 PolarHBondContact O-N 2.99Å; S157-E159 PolarHBondContact OG-N 3.11Å; E159-E161 PolarHBondContact O-N 3.44Å
160	C	96.3	Very high	94.4	Very high	0 Å²	0	79.7 Å²	79.7	0%	0	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-72.2	-10	174.7	-84.7	0	0	0	0	114.1	R141 S157 K158 Y163 A164 C174	R141-C160 VanDerWaalsContact CA-SG 3.59Å; S157-C160 WeakPolarHBondContact O-CB 3.43Å; S157-C160 PolarHBondContact O-N 3.25Å; S157-C160 VanDerWaalsContact O-N 3.09Å; K158-C160 PolarHBondContact O-N 3.33Å; C160-Y163 CarbonylContact O-C 3.51Å; C160-Y163 VanDerWaalsContact O-C 3.23Å; C160-Y163 VanDerWaalsContact O-CA 3.24Å; C160-Y163 WeakPolarHBondContact O-CA 3.29Å; C160-Y163 WeakPolarHBondContact O-CB 3.41Å; C160-Y163 PolarHBondContact O-N 2.94Å; C160-A164 HydrophobicContact CB-CB 3.91Å; C160-A164 PolarHBondContact O-N 3.34Å; C160-C174 HydrophobicContact CB-CB 3.64Å; C160-C174 WeakPolarHBondContact CB-SG 2.85Å; C160-C174 WeakPolarHBondContact SG-CB 3.37Å; C160-C174 CovalentContact SG-SG 2.05Å; C160-C174 PolarHBondContact SG-SG 3.31Å
161	E	94.7	Very high	94.7	Very high	134 Å²	134	75.9 Å²	75.9	63%	0.626	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	139.4	-179.8	-73.9	179.9	-171.9	0	0	112.5	K158 E159 A164	K158-E161 WeakPolarHBondContact O-CB 3.42Å; K158-E161 WeakPolarHBondContact O-CG 3.42Å; K158-E161 PolarHBondContact O-N 3.47Å; K158-E161 VanDerWaalsContact O-N 3.08Å; E159-E161 PolarHBondContact O-N 3.44Å; E161-A164 HydrophobicContact CG-CB 4.43Å
162	P	95.6	Very high	94.8	Very high	100 Å²	100	71.6 Å²	71.6	65%	0.649	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	cis	-84.2	0.4	2.3	34.9	-36.9	0	0	0	114.6	A164	P162-A164 VanDerWaalsContact C-N 3.27Å; P162-A164 PolarHBondContact O-N 3.23Å
163	Y	96.9	Very high	95	Very high	73 Å²	73	70.8 Å²	70.8	29%	0.286	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	27.2	-175.1	-51.3	-75	0	0	0	113.9	C160 C174 G175 A176 N179 I237	C160-Y163 CarbonylContact O-C 3.51Å; C160-Y163 VanDerWaalsContact O-C 3.23Å; C160-Y163 VanDerWaalsContact O-CA 3.24Å; C160-Y163 WeakPolarHBondContact O-CA 3.29Å; C160-Y163 WeakPolarHBondContact O-CB 3.41Å; C160-Y163 PolarHBondContact O-N 2.94Å; Y163-C174 WeakPolarHBondContact O-CA 3.29Å; Y163-C174 WeakPolarHBondContact O-CB 3.33Å; Y163-G175 PolarHBondContact O-N 2.97Å; Y163-G175 VanDerWaalsContact O-N 3.13Å; Y163-A176 HydrophobicContact CD2-CB 3.67Å; Y163-A176 HydrophobicContact CE2-CB 3.53Å; Y163-N179 HydrophobicContact CD1-CB 4.17Å; Y163-N179 HydrophobicContact CE1-CB 4.5Å; Y163-N179 WeakPolarHBondContact CE1-ND2 3.38Å; Y163-N179 HydrophobicContact CG-CB 4.47Å; Y163-I237 HydrophobicContact CD1-CD1 4.16Å; Y163-I237 HydrophobicContact CE1-CD1 4.44Å
164	A	96.5	Very high	95.2	Very high	11 Å²	11	70.6 Å²	70.6	9%	0.091	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-37.6	177.7	0	0	0	0	0	111.9	P156 C160 E161 P162 I171	P156-A164 HydrophobicContact CG-CB 4.2Å; P156-A164 WeakPolarHBondContact CG-O 3.4Å; C160-A164 HydrophobicContact CB-CB 3.91Å; C160-A164 PolarHBondContact O-N 3.34Å; E161-A164 HydrophobicContact CG-CB 4.43Å; P162-A164 VanDerWaalsContact C-N 3.27Å; P162-A164 PolarHBondContact O-N 3.23Å; A164-I171 PolarHBondContact O-N 2.89Å
165	R	95.3	Very high	95.4	Very high	107 Å²	107	66.6 Å²	66.6	40%	0.404	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	145.8	-176.6	-66.5	-177.2	174.1	-89.5	-7.2	110	M154 N155 K168 M169	M154-R165 PolarHBondContact O-NH2 3.45Å; N155-R165 PolarHBondContact OD1-NH2 3.17Å; R165-K168 PolarHBondContact NH1-O 3.37Å; R165-M169 VanDerWaalsContact CA-O 3.32Å; R165-M169 WeakPolarHBondContact CA-O 3.33Å
166	N	94	Very high	95.5	Very high	64 Å²	64	62 Å²	62	34%	0.342	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.8	164.3	-171.4	14.4	0	0	0	107.2	K168 M169 I171 T234	N166-K168 PolarHBondContact O-N 3.49Å; N166-M169 PolarHBondContact N-O 3.14Å; N166-M169 PolarHBondContact O-N 2.94Å; N166-I171 HydrophobicContact CB-CD1 4.04Å; N166-I171 HydrophobicContact CB-CG1 4.03Å; N166-T234 HydrophobicContact CB-CG2 3.88Å
167	E	88.6	Confident	95.7	Very high	183 Å²	183	61.1 Å²	61.1	86%	0.855	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	-106.2	-167.5	-55.7	176.7	172	0	0	111.3
168	K	89.2	Confident	95.8	Very high	186 Å²	186	58.9 Å²	58.9	81%	0.809	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-11.6	178.4	-64.4	178.3	-178.4	176.5	0	113.1	R165 N166	R165-K168 PolarHBondContact NH1-O 3.37Å; N166-K168 PolarHBondContact O-N 3.49Å
169	M	94.4	Very high	95.9	Very high	83 Å²	83	51 Å²	51	41%	0.409	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133	-173.8	-66.1	-71	-76.6	0	0	111.1	R165 N166 G232 T234	R165-M169 VanDerWaalsContact CA-O 3.32Å; R165-M169 WeakPolarHBondContact CA-O 3.33Å; N166-M169 PolarHBondContact N-O 3.14Å; N166-M169 PolarHBondContact O-N 2.94Å; M169-G232 WeakPolarHBondContact CE-O 3.29Å; M169-T234 HydrophobicContact CB-CG2 3.89Å
170	P	96.8	Very high	95.9	Very high	8 Å²	8	47.3 Å²	47.3	5%	0.052	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	138.1	173.6	28.4	-33.4	0	0	0	111	M154 P156 G232 T233 T234	M154-P170 HydrophobicContact SD-CG 4.46Å; P156-P170 HydrophobicContact CG-CB 4.22Å; P170-G232 WeakPolarHBondContact CD-O 3.28Å; P170-T233 HydrophobicContact CG-CG2 4.37Å; P170-T233 CarbonylContact O-C 3.57Å; P170-T233 WeakPolarHBondContact O-CA 3.36Å; P170-T234 PolarHBondContact O-N 3.5Å
171	I	97.8	Very high	95.9	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.015	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-84.4	133.5	177.5	-64.6	170.9	0	0	0	109.1	Q145 A164 N166 P173 C174 T234 P236 I237	Q145-I171 PolarHBondContact NE2-O 2.87Å; A164-I171 PolarHBondContact O-N 2.89Å; N166-I171 HydrophobicContact CB-CD1 4.04Å; N166-I171 HydrophobicContact CB-CG1 4.03Å; I171-P173 WeakPolarHBondContact CG2-O 3.27Å; I171-C174 WeakPolarHBondContact O-CB 3.28Å; I171-C174 PolarHBondContact O-N 3.45Å; I171-T234 WeakPolarHBondContact CA-O 3.19Å; I171-T234 HydrophobicContact CG1-CG2 3.9Å; I171-P236 HydrophobicContact CG2-CB 4.13Å; I171-P236 HydrophobicContact CG2-CG 3.9Å; I171-I237 HydrophobicContact CD1-CG1 4.39Å
172	A	96.9	Very high	96	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	21%	0.208	C	C	.	.	S	Bend	trans	-129.4	114.9	172.2	0	0	0	0	0	110	L153 F230 T233 T234 F255	L153-A172 HydrophobicContact CD1-CB 3.74Å; A172-F230 HydrophobicContact CB-CD1 4.07Å; A172-F230 HydrophobicContact CB-CE1 4.27Å; A172-T233 HydrophobicContact CB-CG2 3.89Å; A172-T234 PolarHBondContact N-O 2.96Å; A172-F255 HydrophobicContact CB-CZ 4.23Å
173	P	97.9	Very high	96	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.19	C	C	.	.	S	Bend	cis	-76.8	137.7	-5.4	28.7	-33.6	0	0	0	113.9	L146 I171 A178 P236 W239 F255 F260	L146-P173 HydrophobicContact CD2-CB 3.93Å; I171-P173 WeakPolarHBondContact CG2-O 3.27Å; P173-A178 HydrophobicContact CB-CB 3.83Å; P173-A178 HydrophobicContact CG-CB 3.63Å; P173-P236 HydrophobicContact CG-CG 4.23Å; P173-P236 WeakPolarHBondContact O-CG 3.26Å; P173-W239 HydrophobicContact CG-CH2 3.65Å; P173-W239 HydrophobicContact CG-CZ2 3.97Å; P173-W239 HydrophobicContact CG-CZ3 4.29Å; P173-F255 HydrophobicContact CB-CD1 4.36Å; P173-F255 HydrophobicContact CB-CE1 3.66Å; P173-F255 HydrophobicContact CB-CZ 4.39Å; P173-F255 HydrophobicContact CG-CE1 4.15Å; P173-F260 HydrophobicContact CB-CE2 4.25Å; P173-F260 HydrophobicContact CB-CZ 3.78Å; P173-F260 HydrophobicContact CG-CE2 3.68Å; P173-F260 HydrophobicContact CG-CZ 3.68Å
174	C	97.6	Very high	96	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.007	18%	0.177	C	C	.	.			trans	-77.7	159.3	176.6	76.5	0	0	0	0	113.3	D142 P156 C160 Y163 I171	D142-C174 VanDerWaalsContact CB-SG 3.54Å; P156-C174 HydrophobicContact CB-CB 4.11Å; P156-C174 VanDerWaalsContact CB-SG 3.55Å; C160-C174 HydrophobicContact CB-CB 3.64Å; C160-C174 WeakPolarHBondContact CB-SG 2.85Å; C160-C174 WeakPolarHBondContact SG-CB 3.37Å; C160-C174 CovalentContact SG-SG 2.05Å; C160-C174 PolarHBondContact SG-SG 3.31Å; Y163-C174 WeakPolarHBondContact O-CA 3.29Å; Y163-C174 WeakPolarHBondContact O-CB 3.33Å; I171-C174 WeakPolarHBondContact O-CB 3.28Å; I171-C174 PolarHBondContact O-N 3.45Å
175	G	97.9	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	103.8	160.1	168.7	0	0	0	0	0	115.7	S140 Y163 I177 A178 N179	S140-G175 CarbonylContact O-C 3.55Å; S140-G175 VanDerWaalsContact O-CA 3.24Å; S140-G175 WeakPolarHBondContact O-CA 3.12Å; S140-G175 WeakPolarHBondContact OG-CA 3.34Å; Y163-G175 PolarHBondContact O-N 2.97Å; Y163-G175 VanDerWaalsContact O-N 3.13Å; G175-I177 VanDerWaalsContact C-N 3.3Å; G175-I177 PolarHBondContact O-N 3.18Å; G175-A178 PolarHBondContact O-N 2.69Å; G175-N179 WeakPolarHBondContact O-CB 3.49Å; G175-N179 PolarHBondContact O-N 2.97Å
176	A	97.6	Very high	96.1	Very high	14 Å²	14	33.9 Å²	33.9	12%	0.116	17%	0.169	C	C	.	.	H	α-helix	trans	-64.6	-33.9	-175.6	0	0	0	0	0	112.7	Y137 S140 Y163 S180	Y137-A176 HydrophobicContact CD2-CB 4.05Å; Y137-A176 HydrophobicContact CE2-CB 4.42Å; S140-A176 PolarHBondContact O-N 3.42Å; S140-A176 PolarHBondContact OG-N 2.86Å; Y163-A176 HydrophobicContact CD2-CB 3.67Å; Y163-A176 HydrophobicContact CE2-CB 3.53Å; A176-S180 PolarHBondContact O-N 2.8Å; A176-S180 PolarHBondContact O-OG 3.3Å
177	I	98	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.6	-56.2	179.1	-55	167.2	0	0	0	108.7	Y137 R141 G175 N179 S180 W263 M264 T266	Y137-I177 HydrophobicContact CD1-CG1 3.85Å; Y137-I177 HydrophobicContact CE1-CB 4.21Å; Y137-I177 HydrophobicContact CE1-CG1 3.64Å; Y137-I177 HydrophobicContact CE1-CG2 4.21Å; Y137-I177 WeakPolarHBondContact O-CD1 3.42Å; Y137-I177 WeakPolarHBondContact O-CG1 3.45Å; R141-I177 HydrophobicContact CB-CD1 4.16Å; R141-I177 HydrophobicContact CG-CD1 4.17Å; G175-I177 VanDerWaalsContact C-N 3.3Å; G175-I177 PolarHBondContact O-N 3.18Å; I177-N179 PolarHBondContact O-N 3.3Å; I177-S180 PolarHBondContact O-N 3.42Å; I177-S180 PolarHBondContact O-OG 3.22Å; I177-W263 PolarHBondContact O-NE1 3.08Å; I177-M264 HydrophobicContact CB-CE 4.31Å; I177-M264 HydrophobicContact CB-SD 4.06Å; I177-M264 HydrophobicContact CG2-CE 4.24Å; I177-M264 HydrophobicContact CG2-SD 3.57Å; I177-M264 VanDerWaalsContact CG2-SD 3.57Å; I177-T266 HydrophobicContact CD1-CG2 3.76Å; I177-T266 HydrophobicContact CG1-CG2 4.26Å; I177-T266 HydrophobicContact CG2-CG2 4.45Å
178	A	97.8	Very high	96.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.7	-43.5	-177.8	0	0	0	0	0	112.1	P173 G175 S180 M181 W239 F260 M264	P173-A178 HydrophobicContact CB-CB 3.83Å; P173-A178 HydrophobicContact CG-CB 3.63Å; G175-A178 PolarHBondContact O-N 2.69Å; A178-S180 PolarHBondContact O-N 3.1Å; A178-S180 VanDerWaalsContact O-N 3.14Å; A178-M181 WeakPolarHBondContact O-CB 3.41Å; A178-M181 PolarHBondContact O-N 3.2Å; A178-M181 VanDerWaalsContact O-N 3.11Å; A178-W239 WeakPolarHBondContact O-CZ2 3.27Å; A178-W239 PolarHBondContact O-NE1 3.3Å; A178-F260 HydrophobicContact CB-CE2 3.93Å; A178-F260 HydrophobicContact CB-CZ 4.41Å; A178-M264 HydrophobicContact CB-CE 4.42Å; A178-M264 HydrophobicContact CB-SD 3.91Å
179	N	97.3	Very high	97.1	Very high	8 Å²	8	16.9 Å²	16.9	4%	0.043	9%	0.091	C	C	.	.	H	α-helix	trans	-58.6	-31	-179.2	-174.8	58.3	0	0	0	113.3	Y163 G175 I177 P236 I237 N238	Y163-N179 HydrophobicContact CD1-CB 4.17Å; Y163-N179 HydrophobicContact CE1-CB 4.5Å; Y163-N179 WeakPolarHBondContact CE1-ND2 3.38Å; Y163-N179 HydrophobicContact CG-CB 4.47Å; G175-N179 WeakPolarHBondContact O-CB 3.49Å; G175-N179 PolarHBondContact O-N 2.97Å; I177-N179 PolarHBondContact O-N 3.3Å; N179-P236 HydrophobicContact CB-CB 4.24Å; N179-I237 PolarHBondContact OD1-N 2.62Å; N179-N238 PolarHBondContact ND2-ND2 2.87Å; N179-N238 WeakPolarHBondContact O-CB 3.09Å; N179-N238 PolarHBondContact OD1-N 3.16Å
180	S	96.6	Very high	97.2	Very high	17 Å²	17	14.8 Å²	14.8	12%	0.119	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	20.7	-179.1	60.3	0	0	0	0	114.4	Y137 A176 I177 A178 F182 W263 Y302	Y137-S180 WeakPolarHBondContact CE2-OG 3.44Å; Y137-S180 PolarHBondContact OH-OG 2.87Å; A176-S180 PolarHBondContact O-N 2.8Å; A176-S180 PolarHBondContact O-OG 3.3Å; I177-S180 PolarHBondContact O-N 3.42Å; I177-S180 PolarHBondContact O-OG 3.22Å; A178-S180 PolarHBondContact O-N 3.1Å; A178-S180 VanDerWaalsContact O-N 3.14Å; S180-F182 PolarHBondContact O-N 2.86Å; S180-W263 WeakPolarHBondContact O-CZ2 3.21Å; S180-Y302 VanDerWaalsContact O-CE2 3.27Å; S180-Y302 WeakPolarHBondContact O-CE2 3.44Å; S180-Y302 PolarHBondContact O-OH 2.95Å
181	M	97.4	Very high	97.2	Very high	22 Å²	22	16.5 Å²	16.5	11%	0.108	9%	0.088	C	C	.	.			trans	-51.1	131.5	179.2	-175.4	176.3	175	0	0	113.3	A178 N183 W239 D259 F260 W263 Y302	A178-M181 WeakPolarHBondContact O-CB 3.41Å; A178-M181 PolarHBondContact O-N 3.2Å; A178-M181 VanDerWaalsContact O-N 3.11Å; M181-N183 PolarHBondContact O-N 3.09Å; M181-W239 HydrophobicContact CB-CZ2 4.05Å; M181-W239 HydrophobicContact SD-CH2 4.02Å; M181-W239 HydrophobicContact SD-CZ2 3.66Å; M181-D259 HydrophobicContact CE-CB 4Å; M181-F260 HydrophobicContact CE-CB 3.94Å; M181-F260 HydrophobicContact SD-CB 4.19Å; M181-F260 HydrophobicContact SD-CD2 3.82Å; M181-W263 HydrophobicContact CB-CG 4.29Å; M181-W263 HydrophobicContact CG-CB 4.25Å; M181-W263 HydrophobicContact CG-CG 4.03Å; M181-Y302 WeakPolarHBondContact O-CE2 3.45Å
182	F	97	Very high	96.9	Very high	14 Å²	14	18.4 Å²	18.4	6%	0.061	10%	0.097	C	C	.	.			trans	-61.3	130.2	172.7	-179	-97	0	0	0	110.9	Y81 Y125 L127 S180 D184 W263 Y302 K311	Y81-F182 WeakPolarHBondContact OH-CZ 3.41Å; Y125-F182 AromaticContact CD1-CD1 3.81Å; Y125-F182 HydrophobicContact CD1-CD1 3.81Å; Y125-F182 AromaticContact CD1-CE1 3.72Å; Y125-F182 HydrophobicContact CD1-CE1 3.72Å; Y125-F182 HydrophobicContact CD1-CZ 4.41Å; Y125-F182 HydrophobicContact CD2-CD1 4.01Å; Y125-F182 HydrophobicContact CD2-CD2 4.16Å; Y125-F182 HydrophobicContact CD2-CE1 4.12Å; Y125-F182 HydrophobicContact CD2-CE2 4.26Å; Y125-F182 HydrophobicContact CD2-CG 4Å; Y125-F182 HydrophobicContact CD2-CZ 4.22Å; Y125-F182 AromaticContact CE1-CD1 3.8Å; Y125-F182 HydrophobicContact CE1-CD1 3.8Å; Y125-F182 HydrophobicContact CE1-CE1 4.18Å; Y125-F182 HydrophobicContact CE1-CG 4.45Å; Y125-F182 HydrophobicContact CE2-CB 3.97Å; Y125-F182 AromaticContact CE2-CD1 3.95Å; Y125-F182 HydrophobicContact CE2-CD1 3.95Å; Y125-F182 HydrophobicContact CE2-CD2 4.29Å; Y125-F182 AromaticContact CE2-CG 3.8Å; Y125-F182 HydrophobicContact CE2-CG 3.8Å; Y125-F182 AromaticContact CG-CD1 3.95Å; Y125-F182 HydrophobicContact CG-CD1 3.95Å; Y125-F182 AromaticContact CG-CE1 3.71Å; Y125-F182 HydrophobicContact CG-CE1 3.71Å; Y125-F182 HydrophobicContact CG-CE2 4.45Å; Y125-F182 HydrophobicContact CG-CG 4.4Å; Y125-F182 AromaticContact CG-CZ 3.95Å; Y125-F182 HydrophobicContact CG-CZ 3.95Å; Y125-F182 AromaticContact CZ-CD1 3.85Å; L127-F182 HydrophobicContact CD1-CD2 4.34Å; L127-F182 HydrophobicContact CD2-CD2 4.37Å; L127-F182 HydrophobicContact CD2-CE2 4.34Å; S180-F182 PolarHBondContact O-N 2.86Å; F182-D184 HydrophobicContact CE1-CB 3.94Å; F182-D184 HydrophobicContact CE2-CB 4.05Å; F182-D184 WeakPolarHBondContact CE2-OD2 3.05Å; F182-D184 HydrophobicContact CZ-CB 3.49Å; F182-D184 VanDerWaalsContact CZ-CB 3.49Å; F182-W263 HydrophobicContact CB-CE3 3.81Å; F182-W263 HydrophobicContact CB-CH2 4.5Å; F182-W263 HydrophobicContact CB-CZ3 3.77Å; F182-Y302 HydrophobicContact CD2-CD1 4.06Å; F182-Y302 HydrophobicContact CD2-CD2 4.35Å; F182-Y302 AromaticContact CD2-CG 3.95Å; F182-Y302 HydrophobicContact CD2-CG 3.95Å; F182-Y302 HydrophobicContact CE2-CG 4.46Å; F182-K311 HydrophobicContact CE2-CD 4.46Å
183	N	94.9	Very high	96.5	Very high	48 Å²	48	23.9 Å²	23.9	26%	0.257	13%	0.133	S	C	.	.			trans	-139.2	14.7	-169.6	67.5	-5.2	0	0	0	114.1	M181 N301 Y302	M181-N183 PolarHBondContact O-N 3.09Å; N183-N301 WeakPolarHBondContact O-CB 3.31Å; N183-N301 PolarHBondContact O-ND2 3.32Å; N183-N301 WeakPolarHBondContact OD1-CB 3.32Å; N183-N301 PolarHBondContact OD1-O 3.33Å; N183-Y302 WeakPolarHBondContact OD1-CB 3.32Å; N183-Y302 PolarHBondContact OD1-N 3.07Å
184	D	96.3	Very high	96.1	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.027	17%	0.168	C	C	.	.			trans	-67.9	147.7	167.1	-64.3	-31	0	0	0	109.7	Y81 F182 L186 T299 N301 Y302 K311	Y81-D184 PolarHBondContact OH-OD2 3.09Å; F182-D184 HydrophobicContact CE1-CB 3.94Å; F182-D184 HydrophobicContact CE2-CB 4.05Å; F182-D184 WeakPolarHBondContact CE2-OD2 3.05Å; F182-D184 HydrophobicContact CZ-CB 3.49Å; F182-D184 VanDerWaalsContact CZ-CB 3.49Å; D184-L186 HydrophobicContact CB-CD2 4.42Å; D184-T299 VanDerWaalsContact CA-O 3.3Å; D184-T299 WeakPolarHBondContact CA-O 3.3Å; D184-T299 WeakPolarHBondContact CB-O 3.28Å; D184-N301 PolarHBondContact OD1-N 2.91Å; D184-Y302 WeakPolarHBondContact OD1-CB 3.39Å; D184-Y302 PolarHBondContact OD1-N 3.39Å; D184-K311 IonicContact OD1-NZ 2.68Å; D184-K311 PolarHBondContact OD1-NZ 3.32Å; D184-K311 WeakPolarHBondContact OD2-CD 3.29Å; D184-K311 WeakPolarHBondContact OD2-CE 3.29Å; D184-K311 IonicContact OD2-NZ 3.38Å; D184-K311 PolarHBondContact OD2-NZ 3.01Å
185	T	96.5	Very high	95.7	Very high	54 Å²	54	33.1 Å²	33.1	33%	0.331	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.7	171	-49.6	0	0	0	0	108.8	V298 T299	T185-V298 CarbonylContact O-C 3.53Å; T185-V298 WeakPolarHBondContact O-CA 3.43Å; T185-T299 PolarHBondContact N-O 3.44Å; T185-T299 VanDerWaalsContact N-O 3.11Å; T185-T299 PolarHBondContact O-N 2.89Å
186	L	97.8	Very high	95.5	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	114.4	-175.4	-50.5	167.6	0	0	0	108.9	Y81 M123 D184 L202 Y276 L296 V298 V313	Y81-L186 HydrophobicContact CE1-CD2 4.35Å; Y81-L186 HydrophobicContact CE2-CD2 4.26Å; M123-L186 HydrophobicContact CE-CB 3.53Å; M123-L186 HydrophobicContact CE-CD1 4.19Å; M123-L186 HydrophobicContact CE-CG 4.49Å; D184-L186 HydrophobicContact CB-CD2 4.42Å; L186-L202 WeakPolarHBondContact O-CD1 3.44Å; L186-Y276 HydrophobicContact CB-CD1 4.13Å; L186-Y276 HydrophobicContact CB-CE1 3.64Å; L186-Y276 HydrophobicContact CD1-CD1 3.96Å; L186-Y276 HydrophobicContact CD1-CE1 4.14Å; L186-Y276 HydrophobicContact CD1-CG 4.34Å; L186-Y276 HydrophobicContact CG-CD1 4.49Å; L186-Y276 HydrophobicContact CG-CE1 4.19Å; L186-Y276 PolarHBondContact N-OH 3.27Å; L186-Y276 WeakPolarHBondContact O-CE1 3.31Å; L186-L296 HydrophobicContact CB-CD1 4.29Å; L186-V298 HydrophobicContact CD2-CB 4.37Å; L186-V298 HydrophobicContact CD2-CG1 3.93Å; L186-V298 HydrophobicContact CD2-CG2 3.89Å; L186-V313 HydrophobicContact CD1-CG2 3.77Å; L186-V313 HydrophobicContact CD2-CG2 4.03Å; L186-V313 HydrophobicContact CG-CG2 4.42Å
187	D	97.6	Very high	95.4	Very high	43 Å²	43	41.5 Å²	41.5	23%	0.23	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	136.9	179	-70.2	-56.1	0	0	0	110.5	Y189 E297	D187-Y189 HydrophobicContact CB-CE2 3.67Å; D187-E297 HydrophobicContact CB-CB 4.41Å; D187-E297 PolarHBondContact N-O 3.43Å; D187-E297 PolarHBondContact O-N 3.38Å
188	L	97.7	Very high	95.2	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	131.8	-174.5	-176	65	0	0	0	110.7	F111 I200 I279 L289 Y294 L315	F111-L188 HydrophobicContact CE1-CD1 3.84Å; F111-L188 HydrophobicContact CZ-CD1 3.61Å; L188-I200 HydrophobicContact CB-CB 4.31Å; L188-I200 HydrophobicContact CD2-CB 4.33Å; L188-I200 HydrophobicContact CD2-CG1 4.24Å; L188-I200 HydrophobicContact CD2-CG2 4.41Å; L188-I200 HydrophobicContact CG-CB 4.31Å; L188-I200 HydrophobicContact CG-CG1 4.11Å; L188-I200 PolarHBondContact O-N 3.23Å; L188-I279 HydrophobicContact CD2-CD1 4.02Å; L188-L289 HydrophobicContact CD2-CD2 4.45Å; L188-Y294 HydrophobicContact CD1-CD1 4.19Å; L188-Y294 HydrophobicContact CG-CD1 4.36Å; L188-L315 HydrophobicContact CD2-CD1 4.25Å
189	Y	97.6	Very high	95.2	Very high	32 Å²	32	50.5 Å²	50.5	13%	0.125	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.9	179.2	-62.5	-97.9	0	0	0	110.5	D187 R197 I198 Q199 Y294 T295 E297	D187-Y189 HydrophobicContact CB-CE2 3.67Å; Y189-R197 HydrophobicContact CD1-CG 3.69Å; Y189-R197 HydrophobicContact CG-CG 4.01Å; Y189-R197 VanDerWaalsContact CG-NE 3.28Å; Y189-I198 CarbonylContact C-O 3.56Å; Y189-I198 VanDerWaalsContact CA-O 3.29Å; Y189-I198 WeakPolarHBondContact CA-O 3.2Å; Y189-Q199 HydrophobicContact CD1-CB 3.81Å; Y189-Q199 HydrophobicContact CD1-CG 4.14Å; Y189-Q199 HydrophobicContact CE1-CB 3.62Å; Y189-Q199 HydrophobicContact CE1-CG 3.7Å; Y189-Y294 CarbonylContact O-C 3.54Å; Y189-Y294 WeakPolarHBondContact O-CA 3.29Å; Y189-Y294 WeakPolarHBondContact O-CB 3.49Å; Y189-Y294 WeakPolarHBondContact O-CD1 3.35Å; Y189-T295 PolarHBondContact N-O 3.42Å; Y189-T295 PolarHBondContact O-N 2.9Å; Y189-E297 HydrophobicContact CD2-CB 4.37Å; Y189-E297 HydrophobicContact CE2-CB 3.97Å; Y189-E297 WeakPolarHBondContact CE2-OE2 3.32Å
190	Y	96.7	Very high	95.1	Very high	38 Å²	38	51.1 Å²	51.1	15%	0.149	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.2	168.2	174	-109.8	0	0	0	109.6	D192 I198 P290 Y294	Y190-D192 HydrophobicContact CE1-CB 4.22Å; Y190-I198 HydrophobicContact CD1-CD1 4.26Å; Y190-I198 PolarHBondContact N-O 2.89Å; Y190-I198 PolarHBondContact O-N 3.31Å; Y190-P290 HydrophobicContact CD2-CG 4.4Å; Y190-P290 HydrophobicContact CE2-CG 3.94Å; Y190-Y294 HydrophobicContact CD2-CD1 4.22Å; Y190-Y294 HydrophobicContact CD2-CD2 4.42Å; Y190-Y294 AromaticContact CD2-CE1 3.68Å; Y190-Y294 HydrophobicContact CD2-CE1 3.68Å; Y190-Y294 AromaticContact CD2-CE2 3.88Å; Y190-Y294 HydrophobicContact CD2-CE2 3.88Å; Y190-Y294 AromaticContact CD2-CZ 3.49Å; Y190-Y294 VanDerWaalsContact CD2-CZ 3.49Å; Y190-Y294 HydrophobicContact CE2-CE2 4.34Å; Y190-Y294 HydrophobicContact CG-CE1 4.19Å
191	I	96.4	Very high	95	Very high	45 Å²	45	53.9 Å²	53.9	23%	0.231	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	107.3	176.4	-51.8	-57.3	0	0	0	107.5	R197 N293	I191-R197 HydrophobicContact CD1-CB 4.13Å; I191-R197 HydrophobicContact CD1-CG 3.88Å; I191-N293 HydrophobicContact CB-CB 4.11Å; I191-N293 PolarHBondContact N-O 2.8Å
192	D	91.6	Very high	95	Very high	42 Å²	42	54.4 Å²	54.4	23%	0.225	30%	0.301	C	S	.	.			trans	-64.3	149.2	176.6	-164.1	42.6	0	0	0	110.1	Y190 N194 G195 T196 I198	Y190-D192 HydrophobicContact CE1-CB 4.22Å; D192-N194 PolarHBondContact O-N 3.14Å; D192-N194 PolarHBondContact OD2-ND2 3.04Å; D192-G195 WeakPolarHBondContact O-CA 3.34Å; D192-G195 PolarHBondContact O-N 2.81Å; D192-T196 PolarHBondContact N-O 3.35Å; D192-I198 HydrophobicContact CB-CD1 4.31Å
193	P	89.1	Confident	94.9	Very high	116 Å²	116	57.1 Å²	57.1	75%	0.753	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.9	176.9	-27.5	38	0	0	0	113.9	G195	P193-G195 PolarHBondContact O-N 2.98Å
194	N	89.6	Confident	94.9	Very high	139 Å²	139	59.3 Å²	59.3	74%	0.743	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-2.9	173.4	-59.3	-44.7	0	0	0	113.8	D192	D192-N194 PolarHBondContact O-N 3.14Å; D192-N194 PolarHBondContact OD2-ND2 3.04Å
195	G	88.1	Confident	94.8	Very high	57 Å²	57	62.3 Å²	62.3	59%	0.588	34%	0.335	S	S	*	.	S	Bend	trans	90.6	-2.9	-178.5	0	0	0	0	0	114.9	D192 P193	D192-G195 WeakPolarHBondContact O-CA 3.34Å; D192-G195 PolarHBondContact O-N 2.81Å; P193-G195 PolarHBondContact O-N 2.98Å
196	T	93.6	Very high	94.7	Very high	79 Å²	79	62.3 Å²	62.3	49%	0.485	35%	0.345	S	S	.	.			trans	-72.9	130.6	-179	-50.5	0	0	0	0	111.4	D192 I198	D192-T196 PolarHBondContact N-O 3.35Å; T196-I198 HydrophobicContact CG2-CG1 4.29Å
197	R	95.1	Very high	94.7	Very high	111 Å²	111	62.8 Å²	62.8	42%	0.419	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	113.6	175.6	-172	-178.1	-173.1	-149.2	2.1	110.3	Y189 I191 E297	Y189-R197 HydrophobicContact CD1-CG 3.69Å; Y189-R197 HydrophobicContact CG-CG 4.01Å; Y189-R197 VanDerWaalsContact CG-NE 3.28Å; I191-R197 HydrophobicContact CD1-CB 4.13Å; I191-R197 HydrophobicContact CD1-CG 3.88Å; R197-E297 IonicContact CZ-OE2 2.69Å; R197-E297 IonicContact NH1-OE2 2.72Å; R197-E297 PolarHBondContact NH1-OE2 2.9Å; R197-E297 VanDerWaalsContact NH1-OE2 3.15Å; R197-E297 IonicContact NH2-OE2 3.73Å; R197-E297 PolarHBondContact NH2-OE2 3.43Å
198	I	95.3	Very high	94.7	Very high	79 Å²	79	61.6 Å²	61.6	41%	0.405	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.3	-177.9	-58.6	170.2	0	0	0	109.3	Y189 Y190 D192 T196	Y189-I198 CarbonylContact C-O 3.56Å; Y189-I198 VanDerWaalsContact CA-O 3.29Å; Y189-I198 WeakPolarHBondContact CA-O 3.2Å; Y190-I198 HydrophobicContact CD1-CD1 4.26Å; Y190-I198 PolarHBondContact N-O 2.89Å; Y190-I198 PolarHBondContact O-N 3.31Å; D192-I198 HydrophobicContact CB-CD1 4.31Å; T196-I198 HydrophobicContact CG2-CG1 4.29Å
199	Q	96.6	Very high	94.6	Very high	110 Å²	110	69.4 Å²	69.4	51%	0.514	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.7	177.2	-167.8	175.5	9.7	0	0	111.1	Y189	Y189-Q199 HydrophobicContact CD1-CB 3.81Å; Y189-Q199 HydrophobicContact CD1-CG 4.14Å; Y189-Q199 HydrophobicContact CE1-CB 3.62Å; Y189-Q199 HydrophobicContact CE1-CG 3.7Å
200	I	96	Very high	94.6	Very high	20 Å²	20	76.1 Å²	76.1	10%	0.103	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-81.6	124	174	-59.5	-58.9	0	0	0	108.7	L188 L202 I279 L289 Y294	L188-I200 HydrophobicContact CB-CB 4.31Å; L188-I200 HydrophobicContact CD2-CB 4.33Å; L188-I200 HydrophobicContact CD2-CG1 4.24Å; L188-I200 HydrophobicContact CD2-CG2 4.41Å; L188-I200 HydrophobicContact CG-CB 4.31Å; L188-I200 HydrophobicContact CG-CG1 4.11Å; L188-I200 PolarHBondContact O-N 3.23Å; I200-L202 HydrophobicContact CG2-CD2 4.28Å; I200-L202 PolarHBondContact O-N 2.69Å; I200-I279 HydrophobicContact CG2-CD1 4.05Å; I200-I279 HydrophobicContact CG2-CG1 4.32Å; I200-I279 HydrophobicContact CG2-CG2 3.78Å; I200-L289 HydrophobicContact CD1-CD2 4.39Å; I200-L289 HydrophobicContact CG1-CD2 4.43Å; I200-L289 HydrophobicContact CG2-CD2 4.23Å; I200-Y294 HydrophobicContact CG1-CE1 4.47Å
201	P	95.3	Very high	94.7	Very high	75 Å²	75	78 Å²	78	49%	0.487	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-68.6	121.3	178.6	27.3	-33.3	0	0	0	110.4
202	L	95.8	Very high	94.7	Very high	34 Å²	34	76.5 Å²	76.5	18%	0.178	41%	0.407	C	S	.	.			trans	-105.2	116.8	-179.4	-59	-176.5	0	0	0	109.9	M123 L186 I200 R277 I279	M123-L202 HydrophobicContact SD-CD1 4.06Å; M123-L202 HydrophobicContact SD-CD2 4.27Å; L186-L202 WeakPolarHBondContact O-CD1 3.44Å; I200-L202 HydrophobicContact CG2-CD2 4.28Å; I200-L202 PolarHBondContact O-N 2.69Å; L202-R277 HydrophobicContact CB-CB 3.87Å; L202-R277 HydrophobicContact CB-CG 3.81Å; L202-R277 HydrophobicContact CD1-CG 4.18Å; L202-R277 HydrophobicContact CD2-CB 4.42Å; L202-R277 HydrophobicContact CG-CG 4.49Å; L202-I279 HydrophobicContact CD2-CD1 3.93Å; L202-I279 HydrophobicContact CD2-CG1 3.69Å
203	M	95.7	Very high	94.9	Very high	70 Å²	70	76.1 Å²	76.1	35%	0.345	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-78.1	128.3	176.9	-59.8	-125.8	-47.5	0	0	111.1	R277 I278 Q280	M203-R277 WeakPolarHBondContact O-CA 3.42Å; M203-R277 VanDerWaalsContact O-CD 3.29Å; M203-R277 WeakPolarHBondContact O-CD 3.37Å; M203-I278 HydrophobicContact CB-CB 4.42Å; M203-I278 VanDerWaalsContact CB-O 3.29Å; M203-I278 WeakPolarHBondContact CB-O 3.33Å; M203-I278 PolarHBondContact N-O 2.77Å; M203-I278 PolarHBondContact O-N 3.43Å; M203-Q280 HydrophobicContact CE-CG 3.86Å; M203-Q280 HydrophobicContact CG-CG 4.27Å; M203-Q280 HydrophobicContact SD-CG 4.17Å
204	K	93.8	Very high	95.2	Very high	95 Å²	95	74.9 Å²	74.9	41%	0.413	39%	0.387	S	S	.	.			trans	-88.2	-32.6	177.8	-58.8	-174.3	179.2	179.4	0	113.7	D247	K204-D247 IonicContact NZ-OD1 3.43Å
205	K	94.4	Very high	95.5	Very high	68 Å²	68	72 Å²	72	30%	0.296	37%	0.374	S	S	.	.	S	Bend	trans	-86.5	153	-178.9	-65.7	-175.1	176.8	-178.9	0	111.5	D249 E251	K205-D249 WeakPolarHBondContact CE-OD2 3.2Å; K205-D249 IonicContact NZ-OD1 3.65Å; K205-D249 IonicContact NZ-OD2 2.66Å; K205-D249 PolarHBondContact NZ-OD2 2.65Å; K205-E251 IonicContact NZ-OE2 2.99Å; K205-E251 PolarHBondContact NZ-OE2 2.05Å
206	G	95.2	Very high	95.9	Very high	53 Å²	53	73.3 Å²	73.3	55%	0.546	36%	0.364	S	S	.	.	S	Bend	trans	81.1	18.4	178.5	0	0	0	0	0	114.7	E258 I278	G206-E258 WeakPolarHBondContact CA-OE2 3.44Å; G206-E258 VanDerWaalsContact N-CD 3.28Å; G206-E258 PolarHBondContact N-OE1 3.37Å; G206-E258 PolarHBondContact N-OE2 2.82Å; G206-I278 VanDerWaalsContact O-CD1 3.3Å; G206-I278 WeakPolarHBondContact O-CD1 3.19Å
207	I	97.2	Very high	96	Very high	11 Å²	11	69.8 Å²	69.8	6%	0.056	34%	0.341	C	S	.	.			trans	-93	-24.7	175.9	65	175.1	0	0	0	112.6	E258 D259 V262 L275 Y276 I278	I207-E258 HydrophobicContact CD1-CB 4.02Å; I207-E258 HydrophobicContact CG1-CB 3.6Å; I207-E258 WeakPolarHBondContact CG1-OE2 3.2Å; I207-E258 PolarHBondContact N-OE2 2.77Å; I207-D259 WeakPolarHBondContact CD1-OD1 3.4Å; I207-V262 HydrophobicContact CB-CG2 4.49Å; I207-V262 HydrophobicContact CD1-CG2 4.17Å; I207-V262 HydrophobicContact CG1-CG2 4.01Å; I207-L275 HydrophobicContact CB-CD2 3.71Å; I207-L275 HydrophobicContact CB-CG 3.93Å; I207-L275 HydrophobicContact CG2-CD2 3.9Å; I207-L275 HydrophobicContact CG2-CG 3.96Å; I207-Y276 WeakPolarHBondContact CD1-O 3.33Å; I207-I278 HydrophobicContact CG2-CD1 4.01Å; I207-I278 HydrophobicContact CG2-CG1 4.04Å
208	A	97.4	Very high	96.1	Very high	18 Å²	18	70.6 Å²	70.6	15%	0.149	35%	0.345	C	S	.	.	S	Bend	trans	-90	157.2	176.5	0	0	0	0	0	112.1	E258 I261 V262	A208-E258 HydrophobicContact CB-CB 4.02Å; A208-E258 HydrophobicContact CB-CG 3.88Å; A208-E258 PolarHBondContact N-OE2 2.94Å; A208-I261 HydrophobicContact CB-CB 4.23Å; A208-I261 HydrophobicContact CB-CG2 3.8Å; A208-V262 HydrophobicContact CB-CG2 4.37Å
209	W	97.2	Very high	96	Very high	166 Å²	166	68.6 Å²	68.6	63%	0.629	33%	0.334	S	S	*	.			trans	-69.6	144	174.1	-72.8	75.6	0	0	0	110.8	T211 D212 K213	W209-T211 VanDerWaalsContact C-N 3.29Å; W209-T211 PolarHBondContact O-N 3.37Å; W209-D212 HydrophobicContact CB-CB 4.42Å; W209-D212 PolarHBondContact O-N 3.43Å; W209-D212 VanDerWaalsContact O-N 3.08Å; W209-K213 PolarHBondContact O-N 2.9Å
210	W	97.4	Very high	95.8	Very high	172 Å²	172	63.4 Å²	63.4	65%	0.652	31%	0.311	S	S	*	.	H	α-helix	trans	-56	-43.6	-177.7	-175.4	92.3	0	0	0	112.5	K213 H214 V215	W210-K213 PolarHBondContact O-N 2.71Å; W210-H214 AromaticContact CD1-CE1 3.46Å; W210-H214 VanDerWaalsContact CD1-CE1 3.46Å; W210-H214 AromaticContact CD1-ND1 3.37Å; W210-H214 HydrophobicContact CD2-CB 4.42Å; W210-H214 AromaticContact CD2-ND1 3.81Å; W210-H214 AromaticContact CE2-CG 3.89Å; W210-H214 AromaticContact CE2-ND1 3.67Å; W210-H214 AromaticContact CG-ND1 3.62Å; W210-H214 HydrophobicContact CH2-CB 4.33Å; W210-H214 HydrophobicContact CZ2-CB 4.09Å; W210-H214 AromaticContact NE1-CE1 3.53Å; W210-H214 AromaticContact NE1-CG 3.87Å; W210-H214 AromaticContact NE1-ND1 3.38Å; W210-H214 PolarHBondContact NE1-ND1 3.31Å; W210-H214 WeakPolarHBondContact O-CB 3.29Å; W210-H214 PolarHBondContact O-N 3.29Å; W210-H214 PolarHBondContact O-ND1 2.82Å; W210-V215 HydrophobicContact CH2-CG2 4.48Å; W210-V215 HydrophobicContact CZ3-CG2 3.98Å
211	T	97.6	Very high	94.8	Very high	77 Å²	77	64.7 Å²	64.7	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-65.9	-38	178.6	48.8	0	0	0	0	112.5	W209 V215 K216	W209-T211 VanDerWaalsContact C-N 3.29Å; W209-T211 PolarHBondContact O-N 3.37Å; T211-V215 WeakPolarHBondContact O-CA 3.46Å; T211-V215 VanDerWaalsContact O-CB 3.29Å; T211-V215 WeakPolarHBondContact O-CB 3.34Å; T211-V215 PolarHBondContact O-N 2.99Å; T211-K216 PolarHBondContact O-N 3.4Å
212	D	97.2	Very high	93.6	Very high	15 Å²	15	64.9 Å²	64.9	8%	0.08	34%	0.344	C	S	.	.	I	π-helix	trans	-63.8	-47.1	176.2	-75.9	-2.7	0	0	0	109.8	W209 F217 I261 R265	W209-D212 HydrophobicContact CB-CB 4.42Å; W209-D212 PolarHBondContact O-N 3.43Å; W209-D212 VanDerWaalsContact O-N 3.08Å; D212-F217 HydrophobicContact CB-CD2 4.27Å; D212-F217 HydrophobicContact CB-CE2 4.42Å; D212-F217 WeakPolarHBondContact O-CD2 3.48Å; D212-F217 PolarHBondContact O-N 2.94Å; D212-I261 HydrophobicContact CB-CG2 3.54Å; D212-R265 VanDerWaalsContact CG-NH2 3.35Å; D212-R265 IonicContact OD1-NH2 3.61Å; D212-R265 IonicContact OD2-CZ 2.62Å; D212-R265 IonicContact OD2-NE 3.59Å; D212-R265 PolarHBondContact OD2-NE 3.22Å; D212-R265 IonicContact OD2-NH2 3.99Å; D212-R265 PolarHBondContact OD2-NH2 3.16Å
213	K	95.4	Very high	92.3	Very high	33 Å²	33	67.4 Å²	67.4	14%	0.143	36%	0.358	C	S	.	.	I	π-helix	trans	-70.1	-39.2	-176.6	-172.9	174.1	-173.9	176.1	0	114.5	W209 W210 E258 I261	W209-K213 PolarHBondContact O-N 2.9Å; W210-K213 PolarHBondContact O-N 2.71Å; K213-E258 HydrophobicContact CD-CG 4Å; K213-E258 IonicContact NZ-OE1 3.31Å; K213-E258 PolarHBondContact NZ-OE1 3.29Å; K213-I261 HydrophobicContact CB-CD1 4.26Å; K213-I261 HydrophobicContact CG-CD1 4.47Å
214	H	94.8	Very high	91.2	Very high	91 Å²	91	70.4 Å²	70.4	42%	0.421	38%	0.382	S	S	.	.	I	π-helix	trans	-105.4	-17.7	-169.7	-57.8	89.3	0	0	0	114.2	W210 R218	W210-H214 AromaticContact CD1-CE1 3.46Å; W210-H214 VanDerWaalsContact CD1-CE1 3.46Å; W210-H214 AromaticContact CD1-ND1 3.37Å; W210-H214 HydrophobicContact CD2-CB 4.42Å; W210-H214 AromaticContact CD2-ND1 3.81Å; W210-H214 AromaticContact CE2-CG 3.89Å; W210-H214 AromaticContact CE2-ND1 3.67Å; W210-H214 AromaticContact CG-ND1 3.62Å; W210-H214 HydrophobicContact CH2-CB 4.33Å; W210-H214 HydrophobicContact CZ2-CB 4.09Å; W210-H214 AromaticContact NE1-CE1 3.53Å; W210-H214 AromaticContact NE1-CG 3.87Å; W210-H214 AromaticContact NE1-ND1 3.38Å; W210-H214 PolarHBondContact NE1-ND1 3.31Å; W210-H214 WeakPolarHBondContact O-CB 3.29Å; W210-H214 PolarHBondContact O-N 3.29Å; W210-H214 PolarHBondContact O-ND1 2.82Å; H214-R218 PolarHBondContact O-NH2 2.78Å
215	V	95.7	Very high	90.9	Very high	77 Å²	77	70.2 Å²	70.2	47%	0.467	39%	0.386	S	S	.	.	I	π-helix	trans	-117.1	-53	-176.1	-174.3	0	0	0	0	111.4	N147 W210 T211	N147-V215 PolarHBondContact OD1-O 2.99Å; W210-V215 HydrophobicContact CH2-CG2 4.48Å; W210-V215 HydrophobicContact CZ3-CG2 3.98Å; T211-V215 WeakPolarHBondContact O-CA 3.46Å; T211-V215 VanDerWaalsContact O-CB 3.29Å; T211-V215 WeakPolarHBondContact O-CB 3.34Å; T211-V215 PolarHBondContact O-N 2.99Å
216	K	96.9	Very high	90.7	Very high	86 Å²	86	68 Å²	68	37%	0.374	38%	0.377	S	S	.	.	I	π-helix	trans	-80.4	-42.2	-168.5	-173.1	178.2	175.3	-179.2	0	114.1	T211	T211-K216 PolarHBondContact O-N 3.4Å
217	F	97.1	Very high	90.4	Very high	5 Å²	5	69.4 Å²	69.4	2%	0.022	38%	0.375	C	S	.	.			trans	-106.5	133.9	-179.7	-69	-94.5	0	0	0	109.9	L146 D212 F260 I261 M264	L146-F217 HydrophobicContact CB-CD1 3.97Å; L146-F217 HydrophobicContact CB-CE1 4Å; L146-F217 HydrophobicContact CD1-CE1 3.98Å; L146-F217 HydrophobicContact CD2-CD1 4.4Å; L146-F217 HydrophobicContact CD2-CE1 4.13Å; L146-F217 HydrophobicContact CG-CE1 4.25Å; L146-F217 WeakPolarHBondContact O-CA 3.32Å; D212-F217 HydrophobicContact CB-CD2 4.27Å; D212-F217 HydrophobicContact CB-CE2 4.42Å; D212-F217 WeakPolarHBondContact O-CD2 3.48Å; D212-F217 PolarHBondContact O-N 2.94Å; F217-F260 HydrophobicContact CD1-CE1 4.22Å; F217-F260 HydrophobicContact CE1-CE1 4.07Å; F217-I261 HydrophobicContact CB-CD1 4.15Å; F217-I261 HydrophobicContact CB-CG1 4.22Å; F217-I261 HydrophobicContact CD1-CG1 4.32Å; F217-I261 HydrophobicContact CD2-CD1 4.32Å; F217-I261 HydrophobicContact CD2-CG1 3.88Å; F217-I261 HydrophobicContact CD2-CG2 4.22Å; F217-I261 HydrophobicContact CE2-CG1 4.3Å; F217-I261 HydrophobicContact CE2-CG2 4.13Å; F217-I261 HydrophobicContact CG-CD1 4.32Å; F217-I261 HydrophobicContact CG-CG1 3.89Å; F217-M264 HydrophobicContact CE1-CB 4.14Å; F217-M264 HydrophobicContact CE1-CG 4.18Å; F217-M264 HydrophobicContact CZ-CB 3.74Å; F217-M264 HydrophobicContact CZ-CG 4.3Å
218	R	95.3	Very high	90.1	Very high	128 Å²	128	71.3 Å²	71.3	48%	0.483	39%	0.39	S	S	.	.			trans	-147.7	144.9	179.6	-64.4	-175.4	172.3	-174.9	-4	111	L146 G148 H214 F255	L146-R218 PolarHBondContact O-N 3.3Å; G148-R218 WeakPolarHBondContact CA-O 3.35Å; G148-R218 PolarHBondContact N-O 3.2Å; H214-R218 PolarHBondContact O-NH2 2.78Å; R218-F255 WeakPolarHBondContact O-CD2 3.41Å
219	N	94.6	Very high	89.8	Confident	36 Å²	36	71.2 Å²	71.2	19%	0.193	39%	0.389	C	S	.	.			trans	-75	144.6	171.3	-73	-27.9	0	0	0	110.6	L226 N253 G254 F255	N219-L226 HydrophobicContact CB-CD2 3.93Å; N219-L226 WeakPolarHBondContact ND2-CD2 3.29Å; N219-N253 PolarHBondContact ND2-O 3.04Å; N219-G254 WeakPolarHBondContact OD1-CA 3.39Å; N219-F255 PolarHBondContact OD1-N 3.48Å
220	P	91.3	Very high	89.6	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.013	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-68.9	148.5	-178.2	25.8	-31.9	0	0	0	112.8	G148 L153 G222 A229 F230	G148-P220 WeakPolarHBondContact O-CA 3.4Å; L153-P220 HydrophobicContact CD2-CB 4.07Å; L153-P220 HydrophobicContact CD2-CG 3.95Å; P220-G222 VanDerWaalsContact C-N 3.28Å; P220-G222 PolarHBondContact O-N 3.27Å; P220-G222 VanDerWaalsContact O-N 3.13Å; P220-A229 HydrophobicContact CG-CB 4.16Å; P220-F230 HydrophobicContact CG-CD1 4.37Å; P220-F230 HydrophobicContact CG-CE1 3.94Å; P220-F230 HydrophobicContact CG-CE2 4.18Å; P220-F230 HydrophobicContact CG-CZ 3.84Å
221	G	76.6	Confident	89.3	Confident	47 Å²	47	62.1 Å²	62.1	49%	0.485	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	72.6	2	163.2	0	0	0	0	0	117.5	N223	G221-N223 PolarHBondContact O-N 2.87Å
222	G	69.8	Low	89.1	Confident	78 Å²	78	59.9 Å²	59.9	80%	0.804	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	59	11.2	178.7	0	0	0	0	0	114.8	P220	P220-G222 VanDerWaalsContact C-N 3.28Å; P220-G222 PolarHBondContact O-N 3.27Å; P220-G222 VanDerWaalsContact O-N 3.13Å
223	N	67.6	Low	89	Confident	88 Å²	88	60.2 Å²	60.2	47%	0.471	36%	0.355	S	S	.	.			trans	-81.7	137.6	-175.4	-80.9	-33.9	0	0	0	110.1	G221 N225	G221-N223 PolarHBondContact O-N 2.87Å; N223-N225 PolarHBondContact O-N 2.82Å
224	P	72.9	Confident	89	Confident	133 Å²	133	60.6 Å²	60.6	86%	0.864	36%	0.361	S	S	*	.	S	Bend	trans	-69.3	-22.7	176.1	26.9	-32.8	0	0	0	112.4
225	N	87.9	Confident	89.1	Confident	90 Å²	90	59.8 Å²	59.8	48%	0.481	36%	0.356	S	S	.	.			trans	-94.3	103.8	176.6	-170.2	-5.4	0	0	0	110.7	N223 T227 S228 A229	N223-N225 PolarHBondContact O-N 2.82Å; N225-T227 VanDerWaalsContact C-N 3.32Å; N225-T227 PolarHBondContact O-N 3.02Å; N225-T227 PolarHBondContact OD1-N 3.29Å; N225-S228 PolarHBondContact O-N 3.39Å; N225-S228 PolarHBondContact O-OG 2.72Å; N225-A229 PolarHBondContact O-N 3.36Å
226	L	89.5	Confident	89.1	Confident	22 Å²	22	56.1 Å²	56.1	12%	0.115	33%	0.334	C	S	.	.	H	α-helix	trans	-67.3	-31.8	-178.9	-64	176.8	0	0	0	112.6	N219 S228 A229 F230 N253	N219-L226 HydrophobicContact CB-CD2 3.93Å; N219-L226 WeakPolarHBondContact ND2-CD2 3.29Å; L226-S228 VanDerWaalsContact C-N 3.29Å; L226-S228 PolarHBondContact O-N 2.82Å; L226-A229 WeakPolarHBondContact O-CB 3.48Å; L226-A229 PolarHBondContact O-N 3.13Å; L226-A229 VanDerWaalsContact O-N 3.11Å; L226-F230 HydrophobicContact CB-CD2 4.39Å; L226-F230 HydrophobicContact CD2-CE2 4.39Å; L226-F230 VanDerWaalsContact O-CD2 3.28Å; L226-F230 WeakPolarHBondContact O-CD2 3.24Å; L226-F230 PolarHBondContact O-N 2.91Å; L226-N253 HydrophobicContact CD1-CB 3.93Å
227	T	89.8	Confident	89	Confident	82 Å²	82	56 Å²	56	50%	0.503	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-38.6	-179.5	-51	0	0	0	0	111.7	N225 Q231 Y244	N225-T227 VanDerWaalsContact C-N 3.32Å; N225-T227 PolarHBondContact O-N 3.02Å; N225-T227 PolarHBondContact OD1-N 3.29Å; T227-Q231 PolarHBondContact O-N 2.94Å; T227-Y244 HydrophobicContact CG2-CE2 4.34Å
228	S	89.8	Confident	88.8	Confident	52 Å²	52	58.3 Å²	58.3	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-75	-35.3	174.2	60.8	0	0	0	0	112	N225 L226 F230 Q231	N225-S228 PolarHBondContact O-N 3.39Å; N225-S228 PolarHBondContact O-OG 2.72Å; L226-S228 VanDerWaalsContact C-N 3.29Å; L226-S228 PolarHBondContact O-N 2.82Å; S228-F230 VanDerWaalsContact C-N 3.25Å; S228-F230 PolarHBondContact O-N 3.16Å; S228-Q231 VanDerWaalsContact O-CB 3.27Å; S228-Q231 WeakPolarHBondContact O-CB 3.46Å; S228-Q231 PolarHBondContact O-N 2.89Å
229	A	91.3	Very high	88.7	Confident	15 Å²	15	53 Å²	53	12%	0.124	33%	0.329	C	S	.	.	H	α-helix	trans	-62.8	-31.6	178.1	0	0	0	0	0	113	P220 N225 L226	P220-A229 HydrophobicContact CG-CB 4.16Å; N225-A229 PolarHBondContact O-N 3.36Å; L226-A229 WeakPolarHBondContact O-CB 3.48Å; L226-A229 PolarHBondContact O-N 3.13Å; L226-A229 VanDerWaalsContact O-N 3.11Å
230	F	93.1	Very high	88.6	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.013	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	10.5	177.7	-73.5	-76.4	0	0	0	114	L153 A172 P220 L226 S228 G232 T233 V243 Y244 F255	L153-F230 HydrophobicContact CD1-CD1 4.07Å; L153-F230 HydrophobicContact CD1-CE1 4.03Å; A172-F230 HydrophobicContact CB-CD1 4.07Å; A172-F230 HydrophobicContact CB-CE1 4.27Å; P220-F230 HydrophobicContact CG-CD1 4.37Å; P220-F230 HydrophobicContact CG-CE1 3.94Å; P220-F230 HydrophobicContact CG-CE2 4.18Å; P220-F230 HydrophobicContact CG-CZ 3.84Å; L226-F230 HydrophobicContact CB-CD2 4.39Å; L226-F230 HydrophobicContact CD2-CE2 4.39Å; L226-F230 VanDerWaalsContact O-CD2 3.28Å; L226-F230 WeakPolarHBondContact O-CD2 3.24Å; L226-F230 PolarHBondContact O-N 2.91Å; S228-F230 VanDerWaalsContact C-N 3.25Å; S228-F230 PolarHBondContact O-N 3.16Å; F230-G232 PolarHBondContact O-N 3.15Å; F230-T233 PolarHBondContact O-N 3.27Å; F230-T233 VanDerWaalsContact O-N 3.16Å; F230-T233 PolarHBondContact O-OG1 3.3Å; F230-V243 HydrophobicContact CD1-CG1 4.04Å; F230-V243 HydrophobicContact CD2-CG1 4.33Å; F230-V243 HydrophobicContact CE1-CG1 3.73Å; F230-V243 HydrophobicContact CE2-CG1 4.04Å; F230-V243 HydrophobicContact CG-CG1 4.34Å; F230-V243 HydrophobicContact CZ-CG1 3.72Å; F230-Y244 HydrophobicContact CB-CD1 3.56Å; F230-Y244 HydrophobicContact CB-CE1 3.79Å; F230-Y244 AromaticContact CD2-CD1 3.71Å; F230-Y244 HydrophobicContact CD2-CD1 3.71Å; F230-Y244 HydrophobicContact CD2-CG 4.22Å; F230-Y244 AromaticContact CG-CD1 3.77Å; F230-Y244 HydrophobicContact CG-CD1 3.77Å; F230-Y244 HydrophobicContact CG-CE1 4.44Å; F230-F255 HydrophobicContact CE1-CD2 4.31Å; F230-F255 AromaticContact CE1-CE1 3.93Å; F230-F255 HydrophobicContact CE1-CE1 3.93Å; F230-F255 AromaticContact CE1-CE2 3.67Å; F230-F255 HydrophobicContact CE1-CE2 3.67Å; F230-F255 AromaticContact CE1-CZ 3.47Å; F230-F255 HydrophobicContact CE1-CZ 3.47Å; F230-F255 VanDerWaalsContact CE1-CZ 3.47Å; F230-F255 HydrophobicContact CZ-CD1 4.36Å; F230-F255 HydrophobicContact CZ-CD2 4.09Å; F230-F255 HydrophobicContact CZ-CE1 4.17Å; F230-F255 AromaticContact CZ-CE2 3.92Å; F230-F255 HydrophobicContact CZ-CE2 3.92Å; F230-F255 HydrophobicContact CZ-CG 4.31Å; F230-F255 AromaticContact CZ-CZ 3.98Å; F230-F255 HydrophobicContact CZ-CZ 3.98Å
231	Q	91.8	Very high	88.6	Confident	144 Å²	144	62.8 Å²	62.8	67%	0.673	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	137.9	178.8	-172.6	175.8	6.7	0	0	110.9	M154 T227 S228 T233	M154-Q231 WeakPolarHBondContact CE-O 3.5Å; T227-Q231 PolarHBondContact O-N 2.94Å; S228-Q231 VanDerWaalsContact O-CB 3.27Å; S228-Q231 WeakPolarHBondContact O-CB 3.46Å; S228-Q231 PolarHBondContact O-N 2.89Å; Q231-T233 VanDerWaalsContact C-N 3.31Å
232	G	91.9	Very high	89.5	Confident	31 Å²	31	61.4 Å²	61.4	32%	0.32	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	0.6	-178.1	0	0	0	0	0	114.6	M169 P170 F230	M169-G232 WeakPolarHBondContact CE-O 3.29Å; P170-G232 WeakPolarHBondContact CD-O 3.28Å; F230-G232 PolarHBondContact O-N 3.15Å
233	T	95.1	Very high	90.8	Very high	21 Å²	21	57.8 Å²	57.8	13%	0.129	31%	0.311	C	S	.	.			trans	-108.6	168.1	172	70.6	0	0	0	0	111.8	L153 P170 A172 F230 Q231	L153-T233 HydrophobicContact CD1-CG2 3.96Å; L153-T233 HydrophobicContact CD2-CG2 4.22Å; L153-T233 HydrophobicContact CG-CG2 3.69Å; P170-T233 HydrophobicContact CG-CG2 4.37Å; P170-T233 CarbonylContact O-C 3.57Å; P170-T233 WeakPolarHBondContact O-CA 3.36Å; A172-T233 HydrophobicContact CB-CG2 3.89Å; F230-T233 PolarHBondContact O-N 3.27Å; F230-T233 VanDerWaalsContact O-N 3.16Å; F230-T233 PolarHBondContact O-OG1 3.3Å; Q231-T233 VanDerWaalsContact C-N 3.31Å
234	T	96.4	Very high	92	Very high	42 Å²	42	56.3 Å²	56.3	26%	0.258	30%	0.299	S	S	.	.	B	Isolated β-bridge	trans	-129.3	158.8	174.1	-167.7	0	0	0	0	111.6	N166 M169 P170 I171 A172	N166-T234 HydrophobicContact CB-CG2 3.88Å; M169-T234 HydrophobicContact CB-CG2 3.89Å; P170-T234 PolarHBondContact O-N 3.5Å; I171-T234 WeakPolarHBondContact CA-O 3.19Å; I171-T234 HydrophobicContact CG1-CG2 3.9Å; A172-T234 PolarHBondContact N-O 2.96Å
235	K	96.1	Very high	93.1	Very high	73 Å²	73	54.7 Å²	54.7	32%	0.317	28%	0.28	S	S	.	.			trans	-68.3	156.1	177.9	67.1	178.5	-178.4	66.6	0	111.3	W239 P242	K235-W239 WeakPolarHBondContact CD-O 3.39Å; K235-W239 WeakPolarHBondContact CE-O 3.39Å; K235-W239 PolarHBondContact NZ-O 3.46Å; K235-P242 HydrophobicContact CB-CB 4.22Å
236	P	96.8	Very high	93.3	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	27%	0.271	C	S	.	.			trans	-57.7	154.2	168.8	-23.2	34.2	0	0	0	112.2	I171 P173 N179 N238 W239	I171-P236 HydrophobicContact CG2-CB 4.13Å; I171-P236 HydrophobicContact CG2-CG 3.9Å; P173-P236 HydrophobicContact CG-CG 4.23Å; P173-P236 WeakPolarHBondContact O-CG 3.26Å; N179-P236 HydrophobicContact CB-CB 4.24Å; P236-N238 VanDerWaalsContact C-N 3.34Å; P236-N238 PolarHBondContact O-N 2.94Å; P236-W239 HydrophobicContact CB-CB 4.25Å; P236-W239 HydrophobicContact CB-CD2 4.1Å; P236-W239 HydrophobicContact CB-CG 3.73Å; P236-W239 HydrophobicContact CG-CB 4.49Å; P236-W239 HydrophobicContact CG-CD2 3.61Å; P236-W239 HydrophobicContact CG-CE3 4.07Å; P236-W239 HydrophobicContact CG-CG 3.8Å; P236-W239 HydrophobicContact CG-CZ2 4.26Å; P236-W239 PolarHBondContact O-N 3.4Å; P236-W239 VanDerWaalsContact O-N 3.13Å
237	I	93.9	Very high	93.5	Very high	83 Å²	83	53.1 Å²	53.1	43%	0.426	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-46.9	-171.2	-59.4	172.5	0	0	0	111	Y163 I171 N179 W239	Y163-I237 HydrophobicContact CD1-CD1 4.16Å; Y163-I237 HydrophobicContact CE1-CD1 4.44Å; I171-I237 HydrophobicContact CD1-CG1 4.39Å; N179-I237 PolarHBondContact OD1-N 2.62Å; I237-W239 VanDerWaalsContact C-N 3.31Å; I237-W239 PolarHBondContact O-N 3.16Å
238	N	93.1	Very high	93.6	Very high	54 Å²	54	56.2 Å²	56.2	29%	0.289	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-0.5	-176.1	-67.1	-8.3	0	0	0	113.6	W99 N179 P236	W99-N238 HydrophobicContact CE3-CB 4.02Å; W99-N238 HydrophobicContact CZ3-CB 3.98Å; N179-N238 PolarHBondContact ND2-ND2 2.87Å; N179-N238 WeakPolarHBondContact O-CB 3.09Å; N179-N238 PolarHBondContact OD1-N 3.16Å; P236-N238 VanDerWaalsContact C-N 3.34Å; P236-N238 PolarHBondContact O-N 2.94Å
239	W	94.6	Very high	93.7	Very high	17 Å²	17	56.5 Å²	56.5	6%	0.064	29%	0.288	C	S	.	.			trans	-83.6	138.5	179.3	-74.2	28	0	0	0	110.3	P173 A178 M181 K235 P236 I237 V243 L246 F260	P173-W239 HydrophobicContact CG-CH2 3.65Å; P173-W239 HydrophobicContact CG-CZ2 3.97Å; P173-W239 HydrophobicContact CG-CZ3 4.29Å; A178-W239 WeakPolarHBondContact O-CZ2 3.27Å; A178-W239 PolarHBondContact O-NE1 3.3Å; M181-W239 HydrophobicContact CB-CZ2 4.05Å; M181-W239 HydrophobicContact SD-CH2 4.02Å; M181-W239 HydrophobicContact SD-CZ2 3.66Å; K235-W239 WeakPolarHBondContact CD-O 3.39Å; K235-W239 WeakPolarHBondContact CE-O 3.39Å; K235-W239 PolarHBondContact NZ-O 3.46Å; P236-W239 HydrophobicContact CB-CB 4.25Å; P236-W239 HydrophobicContact CB-CD2 4.1Å; P236-W239 HydrophobicContact CB-CG 3.73Å; P236-W239 HydrophobicContact CG-CB 4.49Å; P236-W239 HydrophobicContact CG-CD2 3.61Å; P236-W239 HydrophobicContact CG-CE3 4.07Å; P236-W239 HydrophobicContact CG-CG 3.8Å; P236-W239 HydrophobicContact CG-CZ2 4.26Å; P236-W239 PolarHBondContact O-N 3.4Å; P236-W239 VanDerWaalsContact O-N 3.13Å; I237-W239 VanDerWaalsContact C-N 3.31Å; I237-W239 PolarHBondContact O-N 3.16Å; W239-V243 HydrophobicContact CH2-CB 4.44Å; W239-V243 HydrophobicContact CH2-CG2 4.18Å; W239-V243 HydrophobicContact CZ3-CB 3.74Å; W239-V243 HydrophobicContact CZ3-CG2 3.92Å; W239-L246 HydrophobicContact CE3-CD2 4.47Å; W239-L246 HydrophobicContact CH2-CD1 4.17Å; W239-L246 HydrophobicContact CZ3-CD1 4.03Å; W239-L246 HydrophobicContact CZ3-CD2 4.1Å; W239-L246 HydrophobicContact CZ3-CG 4.35Å; W239-F260 AromaticContact CH2-CD2 3.79Å; W239-F260 HydrophobicContact CH2-CD2 3.79Å; W239-F260 AromaticContact CH2-CE2 3.93Å; W239-F260 HydrophobicContact CH2-CE2 3.93Å; W239-F260 AromaticContact CZ2-CD2 4Å; W239-F260 HydrophobicContact CZ2-CD2 4Å; W239-F260 HydrophobicContact CZ2-CE2 4.01Å
240	R	90.6	Very high	93.5	Very high	115 Å²	115	59.4 Å²	59.4	43%	0.434	31%	0.312	S	S	.	.	S	Bend	trans	-80.5	-37	173.9	-70.8	-175.9	173.2	163.6	-2.1	112.2	F97 S101 N301	F97-R240 VanDerWaalsContact CZ-NH2 3.31Å; S101-R240 PolarHBondContact O-NH2 3.4Å; R240-N301 PolarHBondContact NH1-OD1 3.22Å
241	K	93.2	Very high	93.4	Very high	127 Å²	127	65.3 Å²	65.3	55%	0.552	34%	0.34	S	S	*	.	S	Bend	trans	-119.9	151.3	-178.4	-59.7	-176.3	-177.4	-177.5	0	109.8	E245	K241-E245 HydrophobicContact CB-CB 4.27Å
242	P	95.6	Very high	93.5	Very high	19 Å²	19	58.5 Å²	58.5	12%	0.123	31%	0.308	C	S	.	.			trans	-70	166.7	173.3	31.9	-36.4	0	0	0	111.9	K235 Y244 E245	K235-P242 HydrophobicContact CB-CB 4.22Å; P242-Y244 VanDerWaalsContact C-N 3.25Å; P242-Y244 HydrophobicContact CB-CD1 3.97Å; P242-Y244 HydrophobicContact CB-CD2 4.45Å; P242-Y244 HydrophobicContact CB-CE1 3.46Å; P242-Y244 VanDerWaalsContact CB-CE1 3.46Å; P242-Y244 HydrophobicContact CB-CE2 3.97Å; P242-Y244 HydrophobicContact CB-CG 4.44Å; P242-Y244 VanDerWaalsContact CB-CZ 3.45Å; P242-Y244 HydrophobicContact CG-CD1 4.38Å; P242-Y244 HydrophobicContact CG-CD2 3.98Å; P242-Y244 HydrophobicContact CG-CE1 3.87Å; P242-Y244 HydrophobicContact CG-CE2 3.37Å; P242-Y244 HydrophobicContact CG-CG 4.43Å; P242-Y244 WeakPolarHBondContact CG-OH 3.48Å; P242-Y244 PolarHBondContact O-N 2.66Å; P242-E245 HydrophobicContact CG-CB 4.12Å; P242-E245 HydrophobicContact CG-CG 3.89Å; P242-E245 PolarHBondContact O-N 3.31Å
243	V	95.5	Very high	93.6	Very high	1 Å²	1	57.8 Å²	57.8	1%	0.006	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-63.8	-27.7	-174.5	70.7	0	0	0	0	114.6	F230 W239 E245 L246 N253 G254 F255	F230-V243 HydrophobicContact CD1-CG1 4.04Å; F230-V243 HydrophobicContact CD2-CG1 4.33Å; F230-V243 HydrophobicContact CE1-CG1 3.73Å; F230-V243 HydrophobicContact CE2-CG1 4.04Å; F230-V243 HydrophobicContact CG-CG1 4.34Å; F230-V243 HydrophobicContact CZ-CG1 3.72Å; W239-V243 HydrophobicContact CH2-CB 4.44Å; W239-V243 HydrophobicContact CH2-CG2 4.18Å; W239-V243 HydrophobicContact CZ3-CB 3.74Å; W239-V243 HydrophobicContact CZ3-CG2 3.92Å; V243-E245 VanDerWaalsContact C-N 3.25Å; V243-E245 PolarHBondContact O-N 3.42Å; V243-L246 HydrophobicContact CG2-CD1 3.89Å; V243-L246 WeakPolarHBondContact O-CG 3.3Å; V243-N253 PolarHBondContact O-OD1 3.02Å; V243-G254 VanDerWaalsContact O-CA 3.27Å; V243-G254 WeakPolarHBondContact O-CA 3.3Å; V243-G254 PolarHBondContact O-N 3.02Å; V243-F255 HydrophobicContact CG1-CD1 4.48Å; V243-F255 HydrophobicContact CG1-CE1 4.11Å; V243-F255 HydrophobicContact CG2-CD1 3.77Å; V243-F255 HydrophobicContact CG2-CE1 4.03Å
244	Y	93.3	Very high	93.6	Very high	57 Å²	57	56.8 Å²	56.8	22%	0.224	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-84	5.9	177.1	54.2	-99	0	0	0	113.8	T227 F230 P242 N253	T227-Y244 HydrophobicContact CG2-CE2 4.34Å; F230-Y244 HydrophobicContact CB-CD1 3.56Å; F230-Y244 HydrophobicContact CB-CE1 3.79Å; F230-Y244 AromaticContact CD2-CD1 3.71Å; F230-Y244 HydrophobicContact CD2-CD1 3.71Å; F230-Y244 HydrophobicContact CD2-CG 4.22Å; F230-Y244 AromaticContact CG-CD1 3.77Å; F230-Y244 HydrophobicContact CG-CD1 3.77Å; F230-Y244 HydrophobicContact CG-CE1 4.44Å; P242-Y244 VanDerWaalsContact C-N 3.25Å; P242-Y244 HydrophobicContact CB-CD1 3.97Å; P242-Y244 HydrophobicContact CB-CD2 4.45Å; P242-Y244 HydrophobicContact CB-CE1 3.46Å; P242-Y244 VanDerWaalsContact CB-CE1 3.46Å; P242-Y244 HydrophobicContact CB-CE2 3.97Å; P242-Y244 HydrophobicContact CB-CG 4.44Å; P242-Y244 VanDerWaalsContact CB-CZ 3.45Å; P242-Y244 HydrophobicContact CG-CD1 4.38Å; P242-Y244 HydrophobicContact CG-CD2 3.98Å; P242-Y244 HydrophobicContact CG-CE1 3.87Å; P242-Y244 HydrophobicContact CG-CE2 3.37Å; P242-Y244 HydrophobicContact CG-CG 4.43Å; P242-Y244 WeakPolarHBondContact CG-OH 3.48Å; P242-Y244 PolarHBondContact O-N 2.66Å; Y244-N253 VanDerWaalsContact C-OD1 3.23Å; Y244-N253 PolarHBondContact O-ND2 3Å; Y244-N253 PolarHBondContact O-OD1 2.94Å
245	E	95.2	Very high	93.6	Very high	100 Å²	100	54.8 Å²	54.8	47%	0.467	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-122.2	20.7	174.2	-68.7	176.6	-158.3	0	0	112	K241 P242 V243	K241-E245 HydrophobicContact CB-CB 4.27Å; P242-E245 HydrophobicContact CG-CB 4.12Å; P242-E245 HydrophobicContact CG-CG 3.89Å; P242-E245 PolarHBondContact O-N 3.31Å; V243-E245 VanDerWaalsContact C-N 3.25Å; V243-E245 PolarHBondContact O-N 3.42Å
246	L	94	Very high	93.7	Very high	56 Å²	56	52.9 Å²	52.9	29%	0.293	27%	0.271	S	S	.	.	S	Bend	trans	-73.1	-33.8	-179	-72.9	179	0	0	0	112.6	W239 V243 N253 N257 F260	W239-L246 HydrophobicContact CE3-CD2 4.47Å; W239-L246 HydrophobicContact CH2-CD1 4.17Å; W239-L246 HydrophobicContact CZ3-CD1 4.03Å; W239-L246 HydrophobicContact CZ3-CD2 4.1Å; W239-L246 HydrophobicContact CZ3-CG 4.35Å; V243-L246 HydrophobicContact CG2-CD1 3.89Å; V243-L246 WeakPolarHBondContact O-CG 3.3Å; L246-N253 PolarHBondContact N-OD1 3.05Å; L246-N257 HydrophobicContact CB-CB 4.38Å; L246-N257 HydrophobicContact CD1-CB 4Å; L246-F260 HydrophobicContact CD1-CB 4.24Å
247	D	93.6	Very high	93.7	Very high	23 Å²	23	53 Å²	53	12%	0.123	27%	0.272	C	S	.	.			trans	-141.3	157.9	175.8	-148.6	-22.5	0	0	0	110.8	K204 D249 N252 N253	K204-D247 IonicContact NZ-OD1 3.43Å; D247-D249 VanDerWaalsContact C-N 3.35Å; D247-N252 VanDerWaalsContact CB-O 3.28Å; D247-N252 WeakPolarHBondContact CB-O 3.39Å; D247-N252 PolarHBondContact OD2-ND2 3.41Å; D247-N253 HydrophobicContact CB-CB 4.5Å; D247-N253 PolarHBondContact N-OD1 3.37Å; D247-N253 VanDerWaalsContact O-CG 3.23Å; D247-N253 PolarHBondContact O-ND2 3.08Å; D247-N253 VanDerWaalsContact O-ND2 3.11Å
248	T	91.7	Very high	93.9	Very high	146 Å²	146	49.2 Å²	49.2	90%	0.896	25%	0.253	S	S	*	.	S	Bend	trans	-80.1	-22.9	175	51.5	0	0	0	0	112
249	D	91	Very high	94.1	Very high	58 Å²	58	48 Å²	48	31%	0.31	25%	0.246	S	C	.	.	S	Bend	trans	-83	120.7	179.4	-170.8	-26.6	0	0	0	111	K205 D247 E251 N252 N253	K205-D249 WeakPolarHBondContact CE-OD2 3.2Å; K205-D249 IonicContact NZ-OD1 3.65Å; K205-D249 IonicContact NZ-OD2 2.66Å; K205-D249 PolarHBondContact NZ-OD2 2.65Å; D247-D249 VanDerWaalsContact C-N 3.35Å; D249-E251 PolarHBondContact O-N 3.26Å; D249-E251 PolarHBondContact OD1-N 2.95Å; D249-N252 HydrophobicContact CB-CB 4.41Å; D249-N252 CarbonylContact O-C 3.45Å; D249-N252 PolarHBondContact O-N 3.03Å; D249-N253 WeakPolarHBondContact O-CB 3.24Å; D249-N253 PolarHBondContact O-N 3.28Å
250	A	88.3	Confident	94.3	Very high	77 Å²	77	47.2 Å²	47.2	64%	0.636	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-59	-30.3	-178.6	0	0	0	0	0	113.5	N252	A250-N252 PolarHBondContact O-N 3.11Å
251	E	90.1	Very high	94.7	Very high	127 Å²	127	41.8 Å²	41.8	59%	0.593	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-78.8	-6.1	178.3	-61.9	-174.3	157	0	0	113.8	K205 D249	K205-E251 IonicContact NZ-OE2 2.99Å; K205-E251 PolarHBondContact NZ-OE2 2.05Å; D249-E251 PolarHBondContact O-N 3.26Å; D249-E251 PolarHBondContact OD1-N 2.95Å
252	N	94.3	Very high	94.9	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-131	29.5	-179.4	-164	41.8	0	0	0	112	D247 D249 A250 N257 E258	D247-N252 VanDerWaalsContact CB-O 3.28Å; D247-N252 WeakPolarHBondContact CB-O 3.39Å; D247-N252 PolarHBondContact OD2-ND2 3.41Å; D249-N252 HydrophobicContact CB-CB 4.41Å; D249-N252 CarbonylContact O-C 3.45Å; D249-N252 PolarHBondContact O-N 3.03Å; A250-N252 PolarHBondContact O-N 3.11Å; N252-N257 WeakPolarHBondContact O-CA 3.47Å; N252-N257 WeakPolarHBondContact O-CB 3.38Å; N252-N257 PolarHBondContact O-ND2 2.65Å; N252-E258 WeakPolarHBondContact OD1-CG 3.47Å; N252-E258 PolarHBondContact OD1-N 3.49Å
253	N	94.4	Very high	95.1	Very high	16 Å²	16	35.7 Å²	35.7	9%	0.086	20%	0.196	C	C	.	.			trans	-127.6	156.6	-175.6	-164.9	17	0	0	0	112.1	N219 L226 V243 Y244 L246 D247 D249 I256	N219-N253 PolarHBondContact ND2-O 3.04Å; L226-N253 HydrophobicContact CD1-CB 3.93Å; V243-N253 PolarHBondContact O-OD1 3.02Å; Y244-N253 VanDerWaalsContact C-OD1 3.23Å; Y244-N253 PolarHBondContact O-ND2 3Å; Y244-N253 PolarHBondContact O-OD1 2.94Å; L246-N253 PolarHBondContact N-OD1 3.05Å; D247-N253 HydrophobicContact CB-CB 4.5Å; D247-N253 PolarHBondContact N-OD1 3.37Å; D247-N253 VanDerWaalsContact O-CG 3.23Å; D247-N253 PolarHBondContact O-ND2 3.08Å; D247-N253 VanDerWaalsContact O-ND2 3.11Å; D249-N253 WeakPolarHBondContact O-CB 3.24Å; D249-N253 PolarHBondContact O-N 3.28Å; N253-I256 WeakPolarHBondContact O-CG1 2.95Å
254	G	95.1	Very high	95.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	76.4	-149	-171	0	0	0	0	0	112.8	N219 V243 I256 N257	N219-G254 WeakPolarHBondContact OD1-CA 3.39Å; V243-G254 VanDerWaalsContact O-CA 3.27Å; V243-G254 WeakPolarHBondContact O-CA 3.3Å; V243-G254 PolarHBondContact O-N 3.02Å; G254-I256 PolarHBondContact O-N 3.35Å; G254-N257 VanDerWaalsContact O-CB 3.29Å; G254-N257 WeakPolarHBondContact O-CB 3.14Å; G254-N257 PolarHBondContact O-N 2.91Å
255	F	96.4	Very high	95.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-67.3	-18.6	179.5	-65.5	-30	0	0	0	113.6	Q145 L146 L153 A172 P173 R218 N219 F230 V243 N257 F260	Q145-F255 HydrophobicContact CG-CE2 4.28Å; Q145-F255 HydrophobicContact CG-CZ 4.16Å; Q145-F255 WeakPolarHBondContact O-CE2 3.45Å; L146-F255 HydrophobicContact CD2-CD1 4.25Å; L146-F255 HydrophobicContact CD2-CE1 4.39Å; L153-F255 HydrophobicContact CD1-CE2 4.35Å; L153-F255 HydrophobicContact CD1-CZ 4.29Å; A172-F255 HydrophobicContact CB-CZ 4.23Å; P173-F255 HydrophobicContact CB-CD1 4.36Å; P173-F255 HydrophobicContact CB-CE1 3.66Å; P173-F255 HydrophobicContact CB-CZ 4.39Å; P173-F255 HydrophobicContact CG-CE1 4.15Å; R218-F255 WeakPolarHBondContact O-CD2 3.41Å; N219-F255 PolarHBondContact OD1-N 3.48Å; F230-F255 HydrophobicContact CE1-CD2 4.31Å; F230-F255 AromaticContact CE1-CE1 3.93Å; F230-F255 HydrophobicContact CE1-CE1 3.93Å; F230-F255 AromaticContact CE1-CE2 3.67Å; F230-F255 HydrophobicContact CE1-CE2 3.67Å; F230-F255 AromaticContact CE1-CZ 3.47Å; F230-F255 HydrophobicContact CE1-CZ 3.47Å; F230-F255 VanDerWaalsContact CE1-CZ 3.47Å; F230-F255 HydrophobicContact CZ-CD1 4.36Å; F230-F255 HydrophobicContact CZ-CD2 4.09Å; F230-F255 HydrophobicContact CZ-CE1 4.17Å; F230-F255 AromaticContact CZ-CE2 3.92Å; F230-F255 HydrophobicContact CZ-CE2 3.92Å; F230-F255 HydrophobicContact CZ-CG 4.31Å; F230-F255 AromaticContact CZ-CZ 3.98Å; F230-F255 HydrophobicContact CZ-CZ 3.98Å; V243-F255 HydrophobicContact CG1-CD1 4.48Å; V243-F255 HydrophobicContact CG1-CE1 4.11Å; V243-F255 HydrophobicContact CG2-CD1 3.77Å; V243-F255 HydrophobicContact CG2-CE1 4.03Å; F255-N257 VanDerWaalsContact C-N 3.3Å; F255-F260 HydrophobicContact CD1-CE1 4.14Å
256	I	96.3	Very high	95.5	Very high	32 Å²	32	35.2 Å²	35.2	16%	0.164	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-86.3	1.1	176.7	64.4	170.2	0	0	0	113.6	N253 G254 E258	N253-I256 WeakPolarHBondContact O-CG1 2.95Å; G254-I256 PolarHBondContact O-N 3.35Å; I256-E258 PolarHBondContact O-N 3.42Å
257	N	97.7	Very high	95.7	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	19%	0.187	C	C	.	.			trans	-58.6	124.8	174.6	174.9	-91.9	0	0	0	110.3	L246 N252 G254 F255 D259 F260 I261	L246-N257 HydrophobicContact CB-CB 4.38Å; L246-N257 HydrophobicContact CD1-CB 4Å; N252-N257 WeakPolarHBondContact O-CA 3.47Å; N252-N257 WeakPolarHBondContact O-CB 3.38Å; N252-N257 PolarHBondContact O-ND2 2.65Å; G254-N257 VanDerWaalsContact O-CB 3.29Å; G254-N257 WeakPolarHBondContact O-CB 3.14Å; G254-N257 PolarHBondContact O-N 2.91Å; F255-N257 VanDerWaalsContact C-N 3.3Å; N257-D259 PolarHBondContact O-N 3.31Å; N257-D259 WeakPolarHBondContact OD1-CB 3.44Å; N257-D259 PolarHBondContact OD1-N 3.44Å; N257-F260 HydrophobicContact CB-CB 4.11Å; N257-F260 WeakPolarHBondContact O-CB 3.29Å; N257-F260 PolarHBondContact O-N 3.27Å; N257-F260 PolarHBondContact OD1-N 3.29Å; N257-I261 WeakPolarHBondContact O-CG1 3.43Å; N257-I261 PolarHBondContact O-N 3.14Å
258	E	98	Very high	95.8	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.019	21%	0.213	C	C	.	.	H	α-helix	trans	-69.1	-32	-171.1	-69	-168.5	-144.7	0	0	113.4	G206 I207 A208 K213 N252 I256 F260 I261 V262	G206-E258 WeakPolarHBondContact CA-OE2 3.44Å; G206-E258 VanDerWaalsContact N-CD 3.28Å; G206-E258 PolarHBondContact N-OE1 3.37Å; G206-E258 PolarHBondContact N-OE2 2.82Å; I207-E258 HydrophobicContact CD1-CB 4.02Å; I207-E258 HydrophobicContact CG1-CB 3.6Å; I207-E258 WeakPolarHBondContact CG1-OE2 3.2Å; I207-E258 PolarHBondContact N-OE2 2.77Å; A208-E258 HydrophobicContact CB-CB 4.02Å; A208-E258 HydrophobicContact CB-CG 3.88Å; A208-E258 PolarHBondContact N-OE2 2.94Å; K213-E258 HydrophobicContact CD-CG 4Å; K213-E258 IonicContact NZ-OE1 3.31Å; K213-E258 PolarHBondContact NZ-OE1 3.29Å; N252-E258 WeakPolarHBondContact OD1-CG 3.47Å; N252-E258 PolarHBondContact OD1-N 3.49Å; I256-E258 PolarHBondContact O-N 3.42Å; E258-F260 VanDerWaalsContact C-N 3.33Å; E258-I261 PolarHBondContact O-N 3Å; E258-V262 WeakPolarHBondContact O-CB 3.41Å; E258-V262 VanDerWaalsContact O-CG2 3.24Å; E258-V262 WeakPolarHBondContact O-CG2 3.13Å; E258-V262 PolarHBondContact O-N 3.5Å
259	D	98	Very high	96.1	Very high	28 Å²	28	34.7 Å²	34.7	15%	0.15	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-42.7	173.5	-78.9	-38.9	0	0	0	110.9	M181 I207 N257 W263 R277	M181-D259 HydrophobicContact CE-CB 4Å; I207-D259 WeakPolarHBondContact CD1-OD1 3.4Å; N257-D259 PolarHBondContact O-N 3.31Å; N257-D259 WeakPolarHBondContact OD1-CB 3.44Å; N257-D259 PolarHBondContact OD1-N 3.44Å; D259-W263 PolarHBondContact O-N 2.97Å; D259-R277 IonicContact OD1-CZ 3.36Å; D259-R277 IonicContact OD1-NH1 3.59Å; D259-R277 PolarHBondContact OD1-NH1 3.46Å; D259-R277 IonicContact OD1-NH2 2.69Å; D259-R277 IonicContact OD2-CZ 3.46Å; D259-R277 IonicContact OD2-NH1 3.22Å; D259-R277 PolarHBondContact OD2-NH1 3.15Å; D259-R277 IonicContact OD2-NH2 3.15Å; D259-R277 PolarHBondContact OD2-NH2 2.87Å
260	F	98.2	Very high	96.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.8	-47.6	174.6	174.5	-109.4	0	0	0	111.6	L146 P173 A178 M181 F217 W239 L246 F255 N257 E258 V262 W263 M264	L146-F260 HydrophobicContact CD2-CE1 3.83Å; L146-F260 HydrophobicContact CD2-CZ 3.69Å; P173-F260 HydrophobicContact CB-CE2 4.25Å; P173-F260 HydrophobicContact CB-CZ 3.78Å; P173-F260 HydrophobicContact CG-CE2 3.68Å; P173-F260 HydrophobicContact CG-CZ 3.68Å; A178-F260 HydrophobicContact CB-CE2 3.93Å; A178-F260 HydrophobicContact CB-CZ 4.41Å; M181-F260 HydrophobicContact CE-CB 3.94Å; M181-F260 HydrophobicContact SD-CB 4.19Å; M181-F260 HydrophobicContact SD-CD2 3.82Å; F217-F260 HydrophobicContact CD1-CE1 4.22Å; F217-F260 HydrophobicContact CE1-CE1 4.07Å; W239-F260 AromaticContact CH2-CD2 3.79Å; W239-F260 HydrophobicContact CH2-CD2 3.79Å; W239-F260 AromaticContact CH2-CE2 3.93Å; W239-F260 HydrophobicContact CH2-CE2 3.93Å; W239-F260 AromaticContact CZ2-CD2 4Å; W239-F260 HydrophobicContact CZ2-CD2 4Å; W239-F260 HydrophobicContact CZ2-CE2 4.01Å; L246-F260 HydrophobicContact CD1-CB 4.24Å; F255-F260 HydrophobicContact CD1-CE1 4.14Å; N257-F260 HydrophobicContact CB-CB 4.11Å; N257-F260 WeakPolarHBondContact O-CB 3.29Å; N257-F260 PolarHBondContact O-N 3.27Å; N257-F260 PolarHBondContact OD1-N 3.29Å; E258-F260 VanDerWaalsContact C-N 3.33Å; F260-V262 PolarHBondContact O-N 3.29Å; F260-W263 WeakPolarHBondContact O-CB 3.47Å; F260-W263 PolarHBondContact O-N 3.36Å; F260-W263 VanDerWaalsContact O-N 3.14Å; F260-M264 HydrophobicContact CD1-CG 4.22Å; F260-M264 HydrophobicContact CD2-CG 3.98Å; F260-M264 HydrophobicContact CD2-SD 4.49Å; F260-M264 HydrophobicContact CE1-CG 3.81Å; F260-M264 HydrophobicContact CE2-CG 3.52Å; F260-M264 HydrophobicContact CE2-SD 3.65Å; F260-M264 HydrophobicContact CG-CG 4.31Å; F260-M264 HydrophobicContact CZ-CE 4.22Å; F260-M264 HydrophobicContact CZ-CG 3.43Å; F260-M264 VanDerWaalsContact CZ-CG 3.43Å; F260-M264 HydrophobicContact CZ-SD 3.75Å; F260-M264 VanDerWaalsContact O-CG 3.3Å; F260-M264 WeakPolarHBondContact O-CG 3.49Å; F260-M264 PolarHBondContact O-N 3.26Å
261	I	98.4	Very high	96.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-47.1	177.8	-70.2	170.5	0	0	0	111.2	A208 D212 K213 F217 N257 E258 W263 M264 R265	A208-I261 HydrophobicContact CB-CB 4.23Å; A208-I261 HydrophobicContact CB-CG2 3.8Å; D212-I261 HydrophobicContact CB-CG2 3.54Å; K213-I261 HydrophobicContact CB-CD1 4.26Å; K213-I261 HydrophobicContact CG-CD1 4.47Å; F217-I261 HydrophobicContact CB-CD1 4.15Å; F217-I261 HydrophobicContact CB-CG1 4.22Å; F217-I261 HydrophobicContact CD1-CG1 4.32Å; F217-I261 HydrophobicContact CD2-CD1 4.32Å; F217-I261 HydrophobicContact CD2-CG1 3.88Å; F217-I261 HydrophobicContact CD2-CG2 4.22Å; F217-I261 HydrophobicContact CE2-CG1 4.3Å; F217-I261 HydrophobicContact CE2-CG2 4.13Å; F217-I261 HydrophobicContact CG-CD1 4.32Å; F217-I261 HydrophobicContact CG-CG1 3.89Å; N257-I261 WeakPolarHBondContact O-CG1 3.43Å; N257-I261 PolarHBondContact O-N 3.14Å; E258-I261 PolarHBondContact O-N 3Å; I261-W263 VanDerWaalsContact C-N 3.25Å; I261-W263 PolarHBondContact O-N 3.34Å; I261-M264 PolarHBondContact O-N 2.98Å; I261-R265 PolarHBondContact O-N 3.44Å
262	V	98.5	Very high	97.2	Very high	18 Å²	18	28 Å²	28	11%	0.109	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-39.4	178.1	168.1	0	0	0	0	110.7	I207 A208 E258 F260 K274	I207-V262 HydrophobicContact CB-CG2 4.49Å; I207-V262 HydrophobicContact CD1-CG2 4.17Å; I207-V262 HydrophobicContact CG1-CG2 4.01Å; A208-V262 HydrophobicContact CB-CG2 4.37Å; E258-V262 WeakPolarHBondContact O-CB 3.41Å; E258-V262 VanDerWaalsContact O-CG2 3.24Å; E258-V262 WeakPolarHBondContact O-CG2 3.13Å; E258-V262 PolarHBondContact O-N 3.5Å; F260-V262 PolarHBondContact O-N 3.29Å; V262-K274 HydrophobicContact CG1-CB 3.81Å; V262-K274 HydrophobicContact CG1-CD 4.33Å; V262-K274 HydrophobicContact CG1-CG 4.17Å; V262-K274 PolarHBondContact O-NZ 3.49Å
263	W	98.4	Very high	97.4	Very high	1 Å²	1	32.6 Å²	32.6	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-65.4	-47.8	175.3	-180	-103.5	0	0	0	112.6	Y125 L127 F130 Q132 Y137 I177 S180 M181 F182 D259 F260 I261 R265 F272 K274	Y125-W263 HydrophobicContact CE2-CE3 4.36Å; Y125-W263 HydrophobicContact CE2-CZ3 4.32Å; L127-W263 HydrophobicContact CD1-CH2 4.04Å; L127-W263 HydrophobicContact CD1-CZ3 3.88Å; F130-W263 HydrophobicContact CD1-CH2 4.39Å; F130-W263 AromaticContact CE1-CH2 3.71Å; F130-W263 HydrophobicContact CE1-CH2 3.71Å; F130-W263 AromaticContact CE1-CZ2 3.91Å; F130-W263 HydrophobicContact CE1-CZ2 3.91Å; F130-W263 AromaticContact CZ-CH2 3.97Å; F130-W263 HydrophobicContact CZ-CH2 3.97Å; F130-W263 HydrophobicContact CZ-CZ2 4.01Å; Q132-W263 VanDerWaalsContact NE2-CZ2 3.35Å; Y137-W263 WeakPolarHBondContact OH-CZ2 3.48Å; I177-W263 PolarHBondContact O-NE1 3.08Å; S180-W263 WeakPolarHBondContact O-CZ2 3.21Å; M181-W263 HydrophobicContact CB-CG 4.29Å; M181-W263 HydrophobicContact CG-CB 4.25Å; M181-W263 HydrophobicContact CG-CG 4.03Å; F182-W263 HydrophobicContact CB-CE3 3.81Å; F182-W263 HydrophobicContact CB-CH2 4.5Å; F182-W263 HydrophobicContact CB-CZ3 3.77Å; D259-W263 PolarHBondContact O-N 2.97Å; F260-W263 WeakPolarHBondContact O-CB 3.47Å; F260-W263 PolarHBondContact O-N 3.36Å; F260-W263 VanDerWaalsContact O-N 3.14Å; I261-W263 VanDerWaalsContact C-N 3.25Å; I261-W263 PolarHBondContact O-N 3.34Å; W263-R265 PolarHBondContact O-N 2.91Å; W263-R265 VanDerWaalsContact O-N 3.09Å; W263-F272 HydrophobicContact CZ3-CE2 4.37Å; W263-F272 HydrophobicContact CZ3-CZ 4.34Å; W263-K274 HydrophobicContact CE3-CD 3.84Å; W263-K274 HydrophobicContact CZ3-CD 4.33Å; W263-K274 PolarHBondContact O-NZ 3.39Å; W263-K274 VanDerWaalsContact O-NZ 3.16Å
264	M	98.2	Very high	97.6	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-61.5	-20.3	-176.6	-72.1	-57.7	-75.3	0	0	114.1	R141 L146 I177 A178 F217 F260 I261 T266	R141-M264 HydrophobicContact CB-CE 4.19Å; L146-M264 HydrophobicContact CD1-CE 3.49Å; L146-M264 VanDerWaalsContact CD1-CE 3.49Å; L146-M264 HydrophobicContact CD2-CE 4.3Å; I177-M264 HydrophobicContact CB-CE 4.31Å; I177-M264 HydrophobicContact CB-SD 4.06Å; I177-M264 HydrophobicContact CG2-CE 4.24Å; I177-M264 HydrophobicContact CG2-SD 3.57Å; I177-M264 VanDerWaalsContact CG2-SD 3.57Å; A178-M264 HydrophobicContact CB-CE 4.42Å; A178-M264 HydrophobicContact CB-SD 3.91Å; F217-M264 HydrophobicContact CE1-CB 4.14Å; F217-M264 HydrophobicContact CE1-CG 4.18Å; F217-M264 HydrophobicContact CZ-CB 3.74Å; F217-M264 HydrophobicContact CZ-CG 4.3Å; F260-M264 HydrophobicContact CD1-CG 4.22Å; F260-M264 HydrophobicContact CD2-CG 3.98Å; F260-M264 HydrophobicContact CD2-SD 4.49Å; F260-M264 HydrophobicContact CE1-CG 3.81Å; F260-M264 HydrophobicContact CE2-CG 3.52Å; F260-M264 HydrophobicContact CE2-SD 3.65Å; F260-M264 HydrophobicContact CG-CG 4.31Å; F260-M264 HydrophobicContact CZ-CE 4.22Å; F260-M264 HydrophobicContact CZ-CG 3.43Å; F260-M264 VanDerWaalsContact CZ-CG 3.43Å; F260-M264 HydrophobicContact CZ-SD 3.75Å; F260-M264 VanDerWaalsContact O-CG 3.3Å; F260-M264 WeakPolarHBondContact O-CG 3.49Å; F260-M264 PolarHBondContact O-N 3.26Å; I261-M264 PolarHBondContact O-N 2.98Å; M264-T266 PolarHBondContact O-N 2.99Å; M264-T266 VanDerWaalsContact O-N 3.1Å
265	R	97.8	Very high	97.7	Very high	105 Å²	105	33.9 Å²	33.9	40%	0.396	18%	0.183	S	C	.	.	S	Bend	trans	-73.5	95.2	168.6	-173.5	178.3	-70.8	-159.4	-2.5	110.9	D212 I261 W263 A267 K274	D212-R265 VanDerWaalsContact CG-NH2 3.35Å; D212-R265 IonicContact OD1-NH2 3.61Å; D212-R265 IonicContact OD2-CZ 2.62Å; D212-R265 IonicContact OD2-NE 3.59Å; D212-R265 PolarHBondContact OD2-NE 3.22Å; D212-R265 IonicContact OD2-NH2 3.99Å; D212-R265 PolarHBondContact OD2-NH2 3.16Å; I261-R265 PolarHBondContact O-N 3.44Å; W263-R265 PolarHBondContact O-N 2.91Å; W263-R265 VanDerWaalsContact O-N 3.09Å; R265-A267 PolarHBondContact O-N 3.17Å; R265-K274 PolarHBondContact O-NZ 3.01Å
266	T	97.1	Very high	97.8	Very high	40 Å²	40	34.5 Å²	34.5	25%	0.245	19%	0.186	C	C	.	.			trans	-57.7	130.7	-178.9	52.5	0	0	0	0	112.9	Y137 V138 I177 M264	Y137-T266 HydrophobicContact CE1-CG2 4.39Å; V138-T266 HydrophobicContact CG2-CG2 4.38Å; I177-T266 HydrophobicContact CD1-CG2 3.76Å; I177-T266 HydrophobicContact CG1-CG2 4.26Å; I177-T266 HydrophobicContact CG2-CG2 4.45Å; M264-T266 PolarHBondContact O-N 2.99Å; M264-T266 VanDerWaalsContact O-N 3.1Å
267	A	97.8	Very high	97.9	Very high	19 Å²	19	33.6 Å²	33.6	16%	0.157	18%	0.181	C	C	.	.			trans	-74.7	148	173.2	0	0	0	0	0	111.9	Q132 R265 F272	Q132-A267 HydrophobicContact CB-CB 4.4Å; R265-A267 PolarHBondContact O-N 3.17Å; A267-F272 HydrophobicContact CB-CB 3.54Å; A267-F272 HydrophobicContact CB-CD1 3.67Å; A267-F272 HydrophobicContact CB-CD2 4.02Å; A267-F272 HydrophobicContact CB-CE1 4.35Å; A267-F272 HydrophobicContact CB-CG 3.46Å; A267-F272 VanDerWaalsContact CB-CG 3.46Å
268	A	97.1	Very high	97.9	Very high	81 Å²	81	34.2 Å²	34.2	67%	0.669	18%	0.183	S	C	*	.	S	Bend	trans	-80.9	-21.4	-179.6	0	0	0	0	0	113.9	N133	N133-A268 WeakPolarHBondContact CB-O 3.35Å; N133-A268 PolarHBondContact ND2-O 3.43Å
269	L	97.3	Very high	97.9	Very high	115 Å²	115	34.2 Å²	34.2	60%	0.602	18%	0.184	S	C	*	.	S	Bend	trans	-121.7	153.9	-175.1	-64.9	175.1	0	0	0	110.5	T271 F272	L269-T271 PolarHBondContact O-N 3.01Å; L269-F272 WeakPolarHBondContact O-CD1 3.3Å
270	P	97.1	Very high	97.7	Very high	33 Å²	33	37.8 Å²	37.8	21%	0.214	20%	0.2	C	C	.	.	S	Bend	trans	-69.5	-18.2	178.8	28	-35.9	0	0	0	114	N129 F130 Y131	N129-P270 PolarHBondContact N-O 2.86Å; F130-P270 PolarHBondContact N-O 3.48Å; F130-P270 WeakPolarHBondContact O-CA 3.41Å; Y131-P270 HydrophobicContact CD1-CB 3.65Å; Y131-P270 HydrophobicContact CD1-CG 4.27Å; Y131-P270 HydrophobicContact CD2-CB 4.43Å; Y131-P270 HydrophobicContact CE1-CB 3.52Å; Y131-P270 HydrophobicContact CE1-CG 3.86Å; Y131-P270 HydrophobicContact CE2-CB 4.32Å; Y131-P270 HydrophobicContact CG-CB 4.1Å
271	T	97.8	Very high	97.4	Very high	71 Å²	71	40.9 Å²	40.9	44%	0.436	21%	0.213	S	C	.	.	S	Bend	trans	-113.4	109.1	176.4	-59.8	0	0	0	0	107.1	L127 L269	L127-T271 WeakPolarHBondContact O-CA 3.47Å; L269-T271 PolarHBondContact O-N 3.01Å
272	F	97.9	Very high	96.9	Very high	17 Å²	17	49.4 Å²	49.4	8%	0.075	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	166.9	-174.5	62.3	-91.4	0	0	0	111.3	G126 L127 F130 Q132 W263 A267 L269 K274	G126-F272 CarbonylContact C-O 3.57Å; G126-F272 VanDerWaalsContact CA-O 3.22Å; G126-F272 WeakPolarHBondContact CA-O 3.46Å; L127-F272 HydrophobicContact CB-CE1 4.14Å; L127-F272 HydrophobicContact CB-CE2 4.15Å; L127-F272 HydrophobicContact CB-CZ 3.82Å; L127-F272 HydrophobicContact CD1-CE2 4.19Å; L127-F272 HydrophobicContact CD1-CZ 3.84Å; L127-F272 HydrophobicContact CG-CE2 4.44Å; L127-F272 HydrophobicContact CG-CZ 4.31Å; L127-F272 PolarHBondContact N-O 2.88Å; L127-F272 PolarHBondContact O-N 3.01Å; F130-F272 HydrophobicContact CB-CE1 4.04Å; F130-F272 AromaticContact CD1-CE1 3.8Å; F130-F272 HydrophobicContact CD1-CE1 3.8Å; F130-F272 AromaticContact CD1-CZ 3.85Å; F130-F272 HydrophobicContact CD1-CZ 3.85Å; F130-F272 HydrophobicContact CG-CE1 4.37Å; F130-F272 WeakPolarHBondContact O-CE1 3.19Å; Q132-F272 HydrophobicContact CG-CE1 3.9Å; Q132-F272 HydrophobicContact CG-CZ 3.99Å; W263-F272 HydrophobicContact CZ3-CE2 4.37Å; W263-F272 HydrophobicContact CZ3-CZ 4.34Å; A267-F272 HydrophobicContact CB-CB 3.54Å; A267-F272 HydrophobicContact CB-CD1 3.67Å; A267-F272 HydrophobicContact CB-CD2 4.02Å; A267-F272 HydrophobicContact CB-CE1 4.35Å; A267-F272 HydrophobicContact CB-CG 3.46Å; A267-F272 VanDerWaalsContact CB-CG 3.46Å; L269-F272 WeakPolarHBondContact O-CD1 3.3Å; F272-K274 HydrophobicContact CD2-CD 4.25Å; F272-K274 HydrophobicContact CD2-CG 4.03Å; F272-K274 HydrophobicContact CE2-CD 3.88Å; F272-K274 HydrophobicContact CE2-CG 4.16Å
273	R	97.8	Very high	96.4	Very high	98 Å²	98	51.8 Å²	51.8	37%	0.37	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.2	170.9	66.8	178.8	83	177.6	-4.2	109.3	E76 Y124 Y125 I314	E76-R273 IonicContact OE1-CZ 2.76Å; E76-R273 IonicContact OE1-NH1 3.34Å; E76-R273 IonicContact OE1-NH2 3.77Å; E76-R273 PolarHBondContact OE1-NH2 2.94Å; E76-R273 IonicContact OE2-CZ 3.55Å; E76-R273 IonicContact OE2-NH1 3.97Å; E76-R273 PolarHBondContact OE2-NH1 3.38Å; E76-R273 IonicContact OE2-NH2 3.71Å; Y124-R273 HydrophobicContact CD1-CG 4.25Å; Y124-R273 HydrophobicContact CG-CG 4.5Å; Y125-R273 CarbonylContact O-C 3.47Å; Y125-R273 VanDerWaalsContact O-CA 3.28Å; Y125-R273 WeakPolarHBondContact O-CA 3.32Å; R273-I314 HydrophobicContact CB-CD1 3.94Å
274	K	98.3	Very high	95.7	Very high	15 Å²	15	58.4 Å²	58.4	7%	0.065	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.6	177.9	-78.2	176.8	-178.4	-68.3	0	109	Y124 Y125 V262 W263 R265 F272 Y276	Y124-K274 WeakPolarHBondContact CA-O 3.38Å; Y124-K274 WeakPolarHBondContact CB-O 3.48Å; Y125-K274 HydrophobicContact CD2-CB 4.29Å; Y125-K274 HydrophobicContact CE1-CB 3.92Å; Y125-K274 HydrophobicContact CE2-CB 3.63Å; Y125-K274 HydrophobicContact CE2-CD 3.81Å; Y125-K274 HydrophobicContact CE2-CG 4.23Å; Y125-K274 VanDerWaalsContact CZ-CB 3.41Å; Y125-K274 PolarHBondContact N-O 3.34Å; Y125-K274 PolarHBondContact O-N 3.06Å; Y125-K274 WeakPolarHBondContact OH-CB 3.4Å; Y125-K274 WeakPolarHBondContact OH-CD 3.37Å; V262-K274 HydrophobicContact CG1-CB 3.81Å; V262-K274 HydrophobicContact CG1-CD 4.33Å; V262-K274 HydrophobicContact CG1-CG 4.17Å; V262-K274 PolarHBondContact O-NZ 3.49Å; W263-K274 HydrophobicContact CE3-CD 3.84Å; W263-K274 HydrophobicContact CZ3-CD 4.33Å; W263-K274 PolarHBondContact O-NZ 3.39Å; W263-K274 VanDerWaalsContact O-NZ 3.16Å; R265-K274 PolarHBondContact O-NZ 3.01Å; F272-K274 HydrophobicContact CD2-CD 4.25Å; F272-K274 HydrophobicContact CD2-CG 4.03Å; F272-K274 HydrophobicContact CE2-CD 3.88Å; F272-K274 HydrophobicContact CE2-CG 4.16Å; K274-Y276 PolarHBondContact O-N 2.94Å
275	L	98.3	Very high	95.1	Very high	27 Å²	27	65.9 Å²	65.9	14%	0.141	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	125.3	-178.6	-177.2	60	0	0	0	108.7	F122 Y124 I207 I278	F122-L275 HydrophobicContact CB-CD1 3.87Å; F122-L275 HydrophobicContact CD1-CD1 3.87Å; F122-L275 HydrophobicContact CD1-CD2 4.24Å; F122-L275 HydrophobicContact CG-CD1 4.38Å; Y124-L275 HydrophobicContact CD1-CB 4.09Å; Y124-L275 HydrophobicContact CD1-CD1 4.21Å; Y124-L275 HydrophobicContact CE1-CB 3.93Å; Y124-L275 HydrophobicContact CE1-CD1 3.86Å; Y124-L275 HydrophobicContact CE1-CG 4.47Å; I207-L275 HydrophobicContact CB-CD2 3.71Å; I207-L275 HydrophobicContact CB-CG 3.93Å; I207-L275 HydrophobicContact CG2-CD2 3.9Å; I207-L275 HydrophobicContact CG2-CG 3.96Å; L275-I278 HydrophobicContact CD2-CD1 4.38Å; L275-I278 HydrophobicContact CD2-CG1 4.29Å
276	Y	98.3	Very high	94.7	Very high	14 Å²	14	64.6 Å²	64.6	6%	0.055	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	-58.9	177.4	-172.7	-122.4	0	0	0	109.3	M123 Y125 L186 I207 K274	M123-Y276 HydrophobicContact CE-CD1 4.22Å; M123-Y276 HydrophobicContact CG-CD1 4.43Å; M123-Y276 WeakPolarHBondContact O-CA 3.2Å; M123-Y276 VanDerWaalsContact O-CB 3.32Å; M123-Y276 WeakPolarHBondContact O-CB 3.32Å; M123-Y276 PolarHBondContact O-N 2.9Å; M123-Y276 HydrophobicContact SD-CD1 3.97Å; Y125-Y276 AromaticContact CD1-CD2 3.94Å; Y125-Y276 HydrophobicContact CD1-CD2 3.94Å; Y125-Y276 HydrophobicContact CD1-CG 4.16Å; Y125-Y276 HydrophobicContact CE1-CD2 4.18Å; L186-Y276 HydrophobicContact CB-CD1 4.13Å; L186-Y276 HydrophobicContact CB-CE1 3.64Å; L186-Y276 HydrophobicContact CD1-CD1 3.96Å; L186-Y276 HydrophobicContact CD1-CE1 4.14Å; L186-Y276 HydrophobicContact CD1-CG 4.34Å; L186-Y276 HydrophobicContact CG-CD1 4.49Å; L186-Y276 HydrophobicContact CG-CE1 4.19Å; L186-Y276 PolarHBondContact N-OH 3.27Å; L186-Y276 WeakPolarHBondContact O-CE1 3.31Å; I207-Y276 WeakPolarHBondContact CD1-O 3.33Å; K274-Y276 PolarHBondContact O-N 2.94Å
277	R	98	Very high	94.5	Very high	13 Å²	13	64.4 Å²	64.4	5%	0.049	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	158.4	-174.4	-58.7	-70.5	172.4	-108.7	4.4	111.3	M123 L202 M203 D259	M123-R277 HydrophobicContact CB-CB 4.34Å; M123-R277 PolarHBondContact N-O 3.35Å; M123-R277 PolarHBondContact O-N 2.71Å; M123-R277 VanDerWaalsContact O-N 3.11Å; L202-R277 HydrophobicContact CB-CB 3.87Å; L202-R277 HydrophobicContact CB-CG 3.81Å; L202-R277 HydrophobicContact CD1-CG 4.18Å; L202-R277 HydrophobicContact CD2-CB 4.42Å; L202-R277 HydrophobicContact CG-CG 4.49Å; M203-R277 WeakPolarHBondContact O-CA 3.42Å; M203-R277 VanDerWaalsContact O-CD 3.29Å; M203-R277 WeakPolarHBondContact O-CD 3.37Å; D259-R277 IonicContact OD1-CZ 3.36Å; D259-R277 IonicContact OD1-NH1 3.59Å; D259-R277 PolarHBondContact OD1-NH1 3.46Å; D259-R277 IonicContact OD1-NH2 2.69Å; D259-R277 IonicContact OD2-CZ 3.46Å; D259-R277 IonicContact OD2-NH1 3.22Å; D259-R277 PolarHBondContact OD2-NH1 3.15Å; D259-R277 IonicContact OD2-NH2 3.15Å; D259-R277 PolarHBondContact OD2-NH2 2.87Å
278	I	97.8	Very high	94.3	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.082	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.7	172.4	-60	164.7	0	0	0	108.4	F122 M203 G206 I207 L275 Q280	F122-I278 HydrophobicContact CD1-CD1 4.49Å; F122-I278 HydrophobicContact CD1-CG1 3.88Å; F122-I278 HydrophobicContact CE1-CD1 4.15Å; F122-I278 HydrophobicContact CE1-CG1 3.95Å; F122-I278 HydrophobicContact CE1-CG2 4.38Å; M203-I278 HydrophobicContact CB-CB 4.42Å; M203-I278 VanDerWaalsContact CB-O 3.29Å; M203-I278 WeakPolarHBondContact CB-O 3.33Å; M203-I278 PolarHBondContact N-O 2.77Å; M203-I278 PolarHBondContact O-N 3.43Å; G206-I278 VanDerWaalsContact O-CD1 3.3Å; G206-I278 WeakPolarHBondContact O-CD1 3.19Å; I207-I278 HydrophobicContact CG2-CD1 4.01Å; I207-I278 HydrophobicContact CG2-CG1 4.04Å; L275-I278 HydrophobicContact CD2-CD1 4.38Å; L275-I278 HydrophobicContact CD2-CG1 4.29Å; I278-Q280 HydrophobicContact CG2-CG 4.04Å
279	I	97	Very high	94.3	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	102.7	171.6	-50	171	0	0	0	105.7	V121 L188 I200 L202 T288 L289	V121-I279 HydrophobicContact CB-CB 4.18Å; V121-I279 HydrophobicContact CB-CD1 4.37Å; V121-I279 HydrophobicContact CG1-CD1 4.45Å; V121-I279 PolarHBondContact N-O 2.83Å; V121-I279 PolarHBondContact O-N 2.93Å; L188-I279 HydrophobicContact CD2-CD1 4.02Å; I200-I279 HydrophobicContact CG2-CD1 4.05Å; I200-I279 HydrophobicContact CG2-CG1 4.32Å; I200-I279 HydrophobicContact CG2-CG2 3.78Å; L202-I279 HydrophobicContact CD2-CD1 3.93Å; L202-I279 HydrophobicContact CD2-CG1 3.69Å; I279-T288 HydrophobicContact CB-CG2 4.2Å; I279-T288 HydrophobicContact CG2-CG2 3.59Å; I279-L289 HydrophobicContact CD1-CD1 4.18Å; I279-L289 HydrophobicContact CD1-CD2 4.23Å; I279-L289 HydrophobicContact CG2-CD2 4.47Å
280	Q	94.6	Very high	94.2	Very high	103 Å²	103	57.2 Å²	57.2	48%	0.481	29%	0.289	S	S	.	.			trans	-76.2	140.6	-177.4	-70.2	-167.3	-21.1	0	0	111.2	M203 I278 K282	M203-Q280 HydrophobicContact CE-CG 3.86Å; M203-Q280 HydrophobicContact CG-CG 4.27Å; M203-Q280 HydrophobicContact SD-CG 4.17Å; I278-Q280 HydrophobicContact CG2-CG 4.04Å; Q280-K282 PolarHBondContact O-N 3.36Å
281	K	92.5	Very high	94.1	Very high	64 Å²	64	64.4 Å²	64.4	28%	0.278	31%	0.312	S	S	.	.			trans	-65.7	119.9	169.8	-172.9	171.3	-170.9	167.1	0	109.1	E118 N120 N283 T288	E118-K281 VanDerWaalsContact O-CD 3.26Å; E118-K281 WeakPolarHBondContact O-CD 3.47Å; E118-K281 WeakPolarHBondContact O-CE 3.37Å; E118-K281 PolarHBondContact O-NZ 2.98Å; N120-K281 WeakPolarHBondContact OD1-CB 3.39Å; N120-K281 PolarHBondContact OD1-N 2.82Å; K281-N283 WeakPolarHBondContact CE-O 3.24Å; K281-N283 WeakPolarHBondContact CG-O 3.32Å; K281-T288 WeakPolarHBondContact CB-OG1 3.44Å
282	K	88.4	Confident	94	Very high	180 Å²	180	61.9 Å²	61.9	78%	0.783	30%	0.3	S	S	*	.			trans	-83.6	-39.7	-179.6	-69	-174.7	176.6	-177.8	0	113.2	Q280	Q280-K282 PolarHBondContact O-N 3.36Å
283	N	86.2	Confident	93.9	Very high	69 Å²	69	65.8 Å²	65.8	37%	0.369	32%	0.322	S	S	.	.			trans	-142.1	149	-174.6	-168.9	-8.1	0	0	0	109.9	K281 M285 T286	K281-N283 WeakPolarHBondContact CE-O 3.24Å; K281-N283 WeakPolarHBondContact CG-O 3.32Å; N283-M285 VanDerWaalsContact C-N 3.31Å; N283-M285 VanDerWaalsContact ND2-CE 3.29Å; N283-M285 WeakPolarHBondContact ND2-CE 3.36Å; N283-M285 PolarHBondContact OD1-N 3.02Å; N283-T286 VanDerWaalsContact O-O 3.14Å
284	N	84.1	Confident	93.9	Very high	139 Å²	139	61.2 Å²	61.2	74%	0.743	30%	0.304	S	S	*	.	S	Bend	trans	-71.7	-24.1	176.2	-76.7	-9.5	0	0	0	113.4
285	M	85.9	Confident	93.9	Very high	160 Å²	160	61.5 Å²	61.5	79%	0.788	31%	0.308	S	S	*	.	S	Bend	trans	-82.4	-19.9	-175.8	-64.2	-176.3	-72.2	0	0	114.3	N283	N283-M285 VanDerWaalsContact C-N 3.31Å; N283-M285 VanDerWaalsContact ND2-CE 3.29Å; N283-M285 WeakPolarHBondContact ND2-CE 3.36Å; N283-M285 PolarHBondContact OD1-N 3.02Å
286	T	88.9	Confident	93.9	Very high	77 Å²	77	60.3 Å²	60.3	47%	0.472	30%	0.301	S	S	.	.	S	Bend	trans	-121	143.8	-178.7	53.3	0	0	0	0	110.9	N283	N283-T286 VanDerWaalsContact O-O 3.14Å
287	P	92.8	Very high	93.9	Very high	36 Å²	36	62.1 Å²	62.1	23%	0.234	31%	0.31	C	S	.	.			trans	-64.3	150.1	172.9	28.2	-34.9	0	0	0	110	P116 P290	P116-P287 HydrophobicContact CB-CB 3.81Å; P116-P287 HydrophobicContact CB-CG 4.1Å; P287-P290 HydrophobicContact CG-CB 4.03Å
288	T	95	Very high	93.9	Very high	20 Å²	20	61.5 Å²	61.5	12%	0.123	31%	0.308	C	S	.	.	S	Bend	trans	-64.1	-43.1	176.7	-53.7	0	0	0	0	111.1	F117 S119 V121 I279 K281	F117-T288 WeakPolarHBondContact O-CB 3.5Å; F117-T288 PolarHBondContact O-N 2.87Å; S119-T288 VanDerWaalsContact O-CB 3.24Å; S119-T288 WeakPolarHBondContact O-CB 3.29Å; S119-T288 PolarHBondContact O-OG1 3.02Å; V121-T288 HydrophobicContact CG2-CG2 3.95Å; I279-T288 HydrophobicContact CB-CG2 4.2Å; I279-T288 HydrophobicContact CG2-CG2 3.59Å; K281-T288 WeakPolarHBondContact CB-OG1 3.44Å
289	L	96	Very high	93.8	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-125	107.6	169.1	-60.2	176.5	0	0	0	108.5	L113 P116 F117 V121 L188 I200 I279 Y294 L315	L113-L289 HydrophobicContact CD1-CB 4.07Å; L113-L289 HydrophobicContact CD1-CD1 4.21Å; P116-L289 CarbonylContact C-O 3.48Å; P116-L289 WeakPolarHBondContact CA-O 3.36Å; F117-L289 HydrophobicContact CB-CB 4.07Å; F117-L289 HydrophobicContact CD2-CB 4.43Å; F117-L289 HydrophobicContact CG-CB 4.45Å; F117-L289 PolarHBondContact N-O 3Å; F117-L289 PolarHBondContact O-N 3.36Å; V121-L289 HydrophobicContact CB-CD1 4.22Å; V121-L289 HydrophobicContact CG1-CD1 3.9Å; V121-L289 HydrophobicContact CG2-CD1 4.01Å; V121-L289 HydrophobicContact CG2-CG 4.1Å; L188-L289 HydrophobicContact CD2-CD2 4.45Å; I200-L289 HydrophobicContact CD1-CD2 4.39Å; I200-L289 HydrophobicContact CG1-CD2 4.43Å; I200-L289 HydrophobicContact CG2-CD2 4.23Å; I279-L289 HydrophobicContact CD1-CD1 4.18Å; I279-L289 HydrophobicContact CD1-CD2 4.23Å; I279-L289 HydrophobicContact CG2-CD2 4.47Å; L289-Y294 HydrophobicContact CD2-CE1 4.08Å; L289-L315 HydrophobicContact CD1-CD1 4.15Å
290	P	94.8	Very high	93.7	Very high	44 Å²	44	62 Å²	62	29%	0.286	31%	0.312	S	S	.	.			trans	-66	158.6	175.1	26.8	-34.9	0	0	0	111.8	Y190 P287 G292 Y294	Y190-P290 HydrophobicContact CD2-CG 4.4Å; Y190-P290 HydrophobicContact CE2-CG 3.94Å; P287-P290 HydrophobicContact CG-CB 4.03Å; P290-G292 PolarHBondContact O-N 2.88Å; P290-Y294 WeakPolarHBondContact CD-OH 3.32Å; P290-Y294 WeakPolarHBondContact O-CE2 3.33Å; P290-Y294 PolarHBondContact O-OH 3.43Å
291	R	95.4	Very high	93.7	Very high	185 Å²	185	57.8 Å²	57.8	70%	0.698	29%	0.293	S	S	*	.	S	Bend	trans	-57.9	134.2	165.4	171.1	-173.8	166.8	174.2	-6.9	108.8	L113 E114	L113-R291 WeakPolarHBondContact O-CA 3.44Å; L113-R291 VanDerWaalsContact O-CG 3.26Å; L113-R291 WeakPolarHBondContact O-CG 3.33Å; E114-R291 VanDerWaalsContact O-CD 3.29Å; E114-R291 WeakPolarHBondContact O-CD 3.36Å; E114-R291 WeakPolarHBondContact O-CG 3.47Å
292	G	95.3	Very high	93.8	Very high	18 Å²	18	54.9 Å²	54.9	19%	0.186	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	157.8	-169.3	178.7	0	0	0	0	0	113.2	S112 L113 P290 Y294	S112-G292 CarbonylContact C-O 3.58Å; S112-G292 VanDerWaalsContact CA-O 3.31Å; S112-G292 WeakPolarHBondContact CA-O 3.18Å; L113-G292 PolarHBondContact N-O 3.21Å; L113-G292 PolarHBondContact O-N 3.05Å; P290-G292 PolarHBondContact O-N 2.88Å; G292-Y294 WeakPolarHBondContact O-CD2 3.47Å
293	N	97.3	Very high	94	Very high	98 Å²	98	47 Å²	47	52%	0.524	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	138.9	-179.6	-67.4	-20.5	0	0	0	110.3	S112 I191	S112-N293 WeakPolarHBondContact CB-OD1 3.32Å; I191-N293 HydrophobicContact CB-CB 4.11Å; I191-N293 PolarHBondContact N-O 2.8Å
294	Y	97.7	Very high	94.4	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	161.9	-179.9	-70	-97	0	0	0	109.4	P110 F111 L113 L188 Y189 Y190 I200 L289 P290 G292	P110-Y294 WeakPolarHBondContact CA-O 3.41Å; F111-Y294 HydrophobicContact CE2-CD2 4.31Å; F111-Y294 HydrophobicContact CE2-CG 4.11Å; F111-Y294 VanDerWaalsContact CZ-CB 3.41Å; F111-Y294 HydrophobicContact CZ-CG 4.09Å; F111-Y294 PolarHBondContact N-O 3.3Å; F111-Y294 PolarHBondContact O-N 3.19Å; F111-Y294 VanDerWaalsContact O-O 3.12Å; L113-Y294 HydrophobicContact CB-CD2 4.34Å; L113-Y294 HydrophobicContact CB-CE2 4.06Å; L113-Y294 HydrophobicContact CD1-CD2 3.93Å; L113-Y294 HydrophobicContact CD1-CE2 3.52Å; L113-Y294 HydrophobicContact CG-CD2 3.82Å; L113-Y294 HydrophobicContact CG-CE2 3.78Å; L188-Y294 HydrophobicContact CD1-CD1 4.19Å; L188-Y294 HydrophobicContact CG-CD1 4.36Å; Y189-Y294 CarbonylContact O-C 3.54Å; Y189-Y294 WeakPolarHBondContact O-CA 3.29Å; Y189-Y294 WeakPolarHBondContact O-CB 3.49Å; Y189-Y294 WeakPolarHBondContact O-CD1 3.35Å; Y190-Y294 HydrophobicContact CD2-CD1 4.22Å; Y190-Y294 HydrophobicContact CD2-CD2 4.42Å; Y190-Y294 AromaticContact CD2-CE1 3.68Å; Y190-Y294 HydrophobicContact CD2-CE1 3.68Å; Y190-Y294 AromaticContact CD2-CE2 3.88Å; Y190-Y294 HydrophobicContact CD2-CE2 3.88Å; Y190-Y294 AromaticContact CD2-CZ 3.49Å; Y190-Y294 VanDerWaalsContact CD2-CZ 3.49Å; Y190-Y294 HydrophobicContact CE2-CE2 4.34Å; Y190-Y294 HydrophobicContact CG-CE1 4.19Å; I200-Y294 HydrophobicContact CG1-CE1 4.47Å; L289-Y294 HydrophobicContact CD2-CE1 4.08Å; P290-Y294 WeakPolarHBondContact CD-OH 3.32Å; P290-Y294 WeakPolarHBondContact O-CE2 3.33Å; P290-Y294 PolarHBondContact O-OH 3.43Å; G292-Y294 WeakPolarHBondContact O-CD2 3.47Å
295	T	97.7	Very high	94.7	Very high	22 Å²	22	41.2 Å²	41.2	14%	0.135	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124	171.7	-57.8	0	0	0	0	108.5	A108 L109 Y189	A108-T295 HydrophobicContact CB-CG2 3.94Å; L109-T295 WeakPolarHBondContact O-CA 3.34Å; Y189-T295 PolarHBondContact N-O 3.42Å; Y189-T295 PolarHBondContact O-N 2.9Å
296	L	98	Very high	95	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	115.6	169.5	177.5	67.2	0	0	0	108.2	I79 A108 L109 F111 M123 L186 V298 V313	I79-L296 HydrophobicContact CG2-CD2 4.15Å; A108-L296 CarbonylContact C-O 3.6Å; A108-L296 WeakPolarHBondContact CA-O 3.38Å; L109-L296 HydrophobicContact CB-CB 4.46Å; L109-L296 HydrophobicContact CD1-CD2 4.26Å; L109-L296 HydrophobicContact CD1-CG 4.48Å; L109-L296 PolarHBondContact N-O 3.3Å; L109-L296 PolarHBondContact O-N 3.04Å; F111-L296 HydrophobicContact CD1-CB 4.45Å; F111-L296 HydrophobicContact CE1-CB 4Å; M123-L296 HydrophobicContact CE-CD1 3.95Å; L186-L296 HydrophobicContact CB-CD1 4.29Å; L296-V298 HydrophobicContact CD2-CG2 3.9Å; L296-V298 HydrophobicContact CG-CG2 3.77Å; L296-V313 HydrophobicContact CD1-CG2 4.38Å; L296-V313 HydrophobicContact CD2-CB 3.99Å; L296-V313 HydrophobicContact CD2-CG2 3.62Å
297	E	97.8	Very high	95.2	Very high	52 Å²	52	38 Å²	38	24%	0.243	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	124.4	171.2	-173.9	165.6	-170	0	0	109	D187 Y189 R197	D187-E297 HydrophobicContact CB-CB 4.41Å; D187-E297 PolarHBondContact N-O 3.43Å; D187-E297 PolarHBondContact O-N 3.38Å; Y189-E297 HydrophobicContact CD2-CB 4.37Å; Y189-E297 HydrophobicContact CE2-CB 3.97Å; Y189-E297 WeakPolarHBondContact CE2-OE2 3.32Å; R197-E297 IonicContact CZ-OE2 2.69Å; R197-E297 IonicContact NH1-OE2 2.72Å; R197-E297 PolarHBondContact NH1-OE2 2.9Å; R197-E297 VanDerWaalsContact NH1-OE2 3.15Å; R197-E297 IonicContact NH2-OE2 3.73Å; R197-E297 PolarHBondContact NH2-OE2 3.43Å
298	V	97.9	Very high	95.3	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	120.3	-175.7	-178.9	0	0	0	0	108.9	Y81 T106 C107 L109 T185 L186 L296 Y300	Y81-V298 HydrophobicContact CD2-CB 4.46Å; Y81-V298 HydrophobicContact CD2-CG1 3.76Å; Y81-V298 HydrophobicContact CD2-CG2 4.06Å; Y81-V298 HydrophobicContact CE2-CG1 3.77Å; Y81-V298 HydrophobicContact CG-CG2 4.27Å; T106-V298 CarbonylContact C-O 3.57Å; T106-V298 VanDerWaalsContact CA-O 3.23Å; T106-V298 WeakPolarHBondContact CA-O 3.41Å; C107-V298 PolarHBondContact N-O 2.74Å; C107-V298 PolarHBondContact O-N 3.12Å; L109-V298 HydrophobicContact CD1-CG2 3.78Å; T185-V298 CarbonylContact O-C 3.53Å; T185-V298 WeakPolarHBondContact O-CA 3.43Å; L186-V298 HydrophobicContact CD2-CB 4.37Å; L186-V298 HydrophobicContact CD2-CG1 3.93Å; L186-V298 HydrophobicContact CD2-CG2 3.89Å; L296-V298 HydrophobicContact CD2-CG2 3.9Å; L296-V298 HydrophobicContact CG-CG2 3.77Å; V298-Y300 HydrophobicContact CG1-CD2 4.47Å; V298-Y300 PolarHBondContact O-N 3.36Å
299	T	96.6	Very high	95.3	Very high	29 Å²	29	43.2 Å²	43.2	18%	0.178	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	104.9	160.5	-54	0	0	0	0	108.4	P104 T106 D184 T185 N301	P104-T299 HydrophobicContact CB-CG2 3.98Å; T106-T299 HydrophobicContact CG2-CG2 4.33Å; D184-T299 VanDerWaalsContact CA-O 3.3Å; D184-T299 WeakPolarHBondContact CA-O 3.3Å; D184-T299 WeakPolarHBondContact CB-O 3.28Å; T185-T299 PolarHBondContact N-O 3.44Å; T185-T299 VanDerWaalsContact N-O 3.11Å; T185-T299 PolarHBondContact O-N 2.89Å; T299-N301 PolarHBondContact O-N 3.42Å
300	Y	95.2	Very high	95.4	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.008	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	99.8	-171.9	-158.1	-71.7	0	0	0	110.5	T82 C93 F97 C105 V298 K311	T82-Y300 PolarHBondContact O-OH 3.39Å; C93-Y300 HydrophobicContact CB-CD1 4.38Å; C93-Y300 HydrophobicContact CB-CD2 4.19Å; C93-Y300 HydrophobicContact CB-CG 3.94Å; F97-Y300 HydrophobicContact CB-CD1 4.33Å; F97-Y300 HydrophobicContact CD1-CD1 4.39Å; F97-Y300 WeakPolarHBondContact CD2-O 3.42Å; F97-Y300 WeakPolarHBondContact CE2-O 3.44Å; F97-Y300 HydrophobicContact CG-CD1 4.4Å; C105-Y300 WeakPolarHBondContact O-CB 3.34Å; C105-Y300 PolarHBondContact O-N 3.48Å; V298-Y300 HydrophobicContact CG1-CD2 4.47Å; V298-Y300 PolarHBondContact O-N 3.36Å; Y300-K311 VanDerWaalsContact CE1-NZ 3.33Å; Y300-K311 VanDerWaalsContact CE2-CE 3.43Å; Y300-K311 VanDerWaalsContact CZ-CE 3.4Å; Y300-K311 WeakPolarHBondContact OH-CE 3.27Å
301	N	94.1	Very high	95.5	Very high	15 Å²	15	45.7 Å²	45.7	8%	0.08	22%	0.222	C	C	.	.			trans	-118.7	-11.5	-179.8	-64	-46.6	0	0	0	113.8	F97 N183 D184 R240 T299 P303	F97-N301 VanDerWaalsContact CE1-C 3.46Å; F97-N301 WeakPolarHBondContact CE1-O 3.27Å; F97-N301 HydrophobicContact CZ-CB 4.35Å; N183-N301 WeakPolarHBondContact O-CB 3.31Å; N183-N301 PolarHBondContact O-ND2 3.32Å; N183-N301 WeakPolarHBondContact OD1-CB 3.32Å; N183-N301 PolarHBondContact OD1-O 3.33Å; D184-N301 PolarHBondContact OD1-N 2.91Å; R240-N301 PolarHBondContact NH1-OD1 3.22Å; T299-N301 PolarHBondContact O-N 3.42Å; N301-P303 VanDerWaalsContact O-CD 3.32Å; N301-P303 WeakPolarHBondContact O-CD 3.24Å
302	Y	94.8	Very high	95.7	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.008	20%	0.196	C	C	.	.			trans	-110.5	96.6	-175.2	-156.8	-99.4	0	0	0	111	W99 L127 F130 S180 M181 F182 N183 D184 V304 K311	W99-Y302 AromaticContact CH2-CD2 3.62Å; W99-Y302 HydrophobicContact CH2-CD2 3.62Å; W99-Y302 AromaticContact CH2-CE2 3.57Å; W99-Y302 HydrophobicContact CH2-CE2 3.57Å; W99-Y302 HydrophobicContact CZ2-CD2 4.24Å; W99-Y302 HydrophobicContact CZ2-CE2 4.09Å; L127-Y302 HydrophobicContact CD1-CE1 4.09Å; F130-Y302 WeakPolarHBondContact CE2-OH 3.45Å; F130-Y302 WeakPolarHBondContact CZ-OH 3.5Å; S180-Y302 VanDerWaalsContact O-CE2 3.27Å; S180-Y302 WeakPolarHBondContact O-CE2 3.44Å; S180-Y302 PolarHBondContact O-OH 2.95Å; M181-Y302 WeakPolarHBondContact O-CE2 3.45Å; F182-Y302 HydrophobicContact CD2-CD1 4.06Å; F182-Y302 HydrophobicContact CD2-CD2 4.35Å; F182-Y302 AromaticContact CD2-CG 3.95Å; F182-Y302 HydrophobicContact CD2-CG 3.95Å; F182-Y302 HydrophobicContact CE2-CG 4.46Å; N183-Y302 WeakPolarHBondContact OD1-CB 3.32Å; N183-Y302 PolarHBondContact OD1-N 3.07Å; D184-Y302 WeakPolarHBondContact OD1-CB 3.39Å; D184-Y302 PolarHBondContact OD1-N 3.39Å; Y302-V304 HydrophobicContact CD1-CG1 3.72Å; Y302-V304 HydrophobicContact CE1-CG1 4.08Å; Y302-K311 WeakPolarHBondContact O-CE 3.22Å; Y302-K311 PolarHBondContact O-NZ 3.31Å
303	P	93.2	Very high	95.8	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.091	19%	0.189	C	C	.	.			trans	-78.4	127.9	-179	31.5	-33.9	0	0	0	110.9	F97 W99 N301	F97-P303 HydrophobicContact CD1-CB 4.32Å; F97-P303 HydrophobicContact CD1-CG 4.42Å; W99-P303 HydrophobicContact CD2-CG 3.85Å; W99-P303 HydrophobicContact CG-CG 3.91Å; W99-P303 HydrophobicContact CZ2-CG 4.09Å; N301-P303 VanDerWaalsContact O-CD 3.32Å; N301-P303 WeakPolarHBondContact O-CD 3.24Å
304	V	94.5	Very high	95.9	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	16%	0.164	C	C	.	.			trans	-118.5	-10.4	-179.2	-59.4	0	0	0	0	114	T82 L127 Y302 S306 F307 E308 G309 K311	T82-V304 HydrophobicContact CG2-CG2 3.75Å; L127-V304 HydrophobicContact CD2-CG1 4.49Å; Y302-V304 HydrophobicContact CD1-CG1 3.72Å; Y302-V304 HydrophobicContact CE1-CG1 4.08Å; V304-S306 VanDerWaalsContact C-N 3.29Å; V304-S306 PolarHBondContact O-N 3.48Å; V304-F307 HydrophobicContact CB-CE1 4.3Å; V304-F307 HydrophobicContact CB-CE2 4.03Å; V304-F307 HydrophobicContact CB-CZ 3.7Å; V304-F307 HydrophobicContact CG1-CE1 4.5Å; V304-F307 HydrophobicContact CG1-CE2 4.32Å; V304-F307 HydrophobicContact CG1-CZ 3.73Å; V304-F307 PolarHBondContact O-N 3.47Å; V304-E308 PolarHBondContact O-N 2.96Å; V304-G309 WeakPolarHBondContact CG2-O 3.38Å; V304-G309 PolarHBondContact O-N 3.15Å; V304-K311 HydrophobicContact CB-CG 4.38Å; V304-K311 HydrophobicContact CG1-CD 3.78Å; V304-K311 HydrophobicContact CG1-CG 3.67Å; V304-K311 HydrophobicContact CG2-CD 4.26Å; V304-K311 HydrophobicContact CG2-CG 3.81Å
305	R	91	Very high	95.9	Very high	87 Å²	87	33.5 Å²	33.5	33%	0.328	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	-61.6	-34.6	-174.9	-78.7	-162.3	176.4	-163.2	-4.8	113.1	G83 F91 S94 F307 E308	G83-R305 PolarHBondContact O-NH2 2.87Å; F91-R305 VanDerWaalsContact CD2-NH2 3.3Å; F91-R305 VanDerWaalsContact CE2-NH2 3.29Å; S94-R305 VanDerWaalsContact CB-NE 3.34Å; S94-R305 VanDerWaalsContact O-CD 3.23Å; S94-R305 WeakPolarHBondContact O-CD 3.49Å; S94-R305 PolarHBondContact O-NE 3.26Å; S94-R305 PolarHBondContact OG-NE 3.4Å; S94-R305 PolarHBondContact OG-NH2 3.32Å; R305-F307 PolarHBondContact O-N 2.9Å; R305-F307 VanDerWaalsContact O-N 3.11Å; R305-E308 PolarHBondContact O-N 3.17Å
306	S	91.2	Very high	95.9	Very high	106 Å²	106	32.5 Å²	32.5	74%	0.741	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-63.1	-19.1	-176.5	60.1	0	0	0	0	114.1	V304	V304-S306 VanDerWaalsContact C-N 3.29Å; V304-S306 PolarHBondContact O-N 3.48Å
307	F	93	Very high	95.8	Very high	64 Å²	64	33 Å²	33	28%	0.281	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-124.5	22.8	176.3	57.6	-96.3	0	0	0	111.6	N129 F130 V304 R305 G309	N129-F307 PolarHBondContact ND2-O 2.88Å; N129-F307 WeakPolarHBondContact O-CD2 3.3Å; F130-F307 HydrophobicContact CB-CE2 4.49Å; F130-F307 AromaticContact CD2-CE2 3.99Å; F130-F307 HydrophobicContact CD2-CE2 3.99Å; F130-F307 AromaticContact CD2-CZ 3.84Å; F130-F307 HydrophobicContact CD2-CZ 3.84Å; F130-F307 HydrophobicContact CE2-CZ 4.44Å; V304-F307 HydrophobicContact CB-CE1 4.3Å; V304-F307 HydrophobicContact CB-CE2 4.03Å; V304-F307 HydrophobicContact CB-CZ 3.7Å; V304-F307 HydrophobicContact CG1-CE1 4.5Å; V304-F307 HydrophobicContact CG1-CE2 4.32Å; V304-F307 HydrophobicContact CG1-CZ 3.73Å; V304-F307 PolarHBondContact O-N 3.47Å; R305-F307 PolarHBondContact O-N 2.9Å; R305-F307 VanDerWaalsContact O-N 3.11Å; F307-G309 PolarHBondContact O-N 2.99Å; F307-G309 VanDerWaalsContact O-N 3.09Å
308	E	95.2	Very high	95.6	Very high	162 Å²	162	34 Å²	34	76%	0.757	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.6	32.3	179	-56.6	176.7	-176.3	0	0	113.2	V304 R305	V304-E308 PolarHBondContact O-N 2.96Å; R305-E308 PolarHBondContact O-N 3.17Å
309	G	95.9	Very high	95.4	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.021	18%	0.176	C	C	.	.			trans	-76.4	158.1	177.5	0	0	0	0	0	112.5	S128 V304 F307	S128-G309 VanDerWaalsContact O-CA 3.28Å; S128-G309 WeakPolarHBondContact O-CA 3.33Å; V304-G309 WeakPolarHBondContact CG2-O 3.38Å; V304-G309 PolarHBondContact O-N 3.15Å; F307-G309 PolarHBondContact O-N 2.99Å; F307-G309 VanDerWaalsContact O-N 3.09Å
310	R	97.3	Very high	95.2	Very high	97 Å²	97	43.6 Å²	43.6	37%	0.366	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144	174	-60.5	-66.5	-171.8	146.3	-8.4	110.7	T82 T84 L127 S128	T82-R310 WeakPolarHBondContact OG1-CA 3.22Å; T84-R310 PolarHBondContact OG1-NH1 2.78Å; L127-R310 WeakPolarHBondContact CA-O 2.98Å; S128-R310 PolarHBondContact N-O 2.93Å; S128-R310 PolarHBondContact O-N 2.88Å
311	K	97.6	Very high	95	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	133.9	176	-56.3	-167.5	-67.2	-176.7	0	110.4	D80 Y81 T82 G126 L127 F182 D184 Y300 Y302 V304	D80-K311 WeakPolarHBondContact CA-O 3.45Å; Y81-K311 HydrophobicContact CD1-CB 4.32Å; Y81-K311 HydrophobicContact CD2-CB 4.32Å; Y81-K311 HydrophobicContact CE1-CB 3.8Å; Y81-K311 HydrophobicContact CE2-CB 3.8Å; Y81-K311 HydrophobicContact CE2-CD 3.98Å; Y81-K311 PolarHBondContact N-O 2.86Å; T82-K311 PolarHBondContact OG1-N 3.18Å; T82-K311 PolarHBondContact OG1-O 3.42Å; G126-K311 WeakPolarHBondContact O-CA 3.05Å; L127-K311 HydrophobicContact CD2-CB 4.44Å; L127-K311 HydrophobicContact CD2-CD 4.28Å; L127-K311 HydrophobicContact CD2-CG 3.74Å; F182-K311 HydrophobicContact CE2-CD 4.46Å; D184-K311 IonicContact OD1-NZ 2.68Å; D184-K311 PolarHBondContact OD1-NZ 3.32Å; D184-K311 WeakPolarHBondContact OD2-CD 3.29Å; D184-K311 WeakPolarHBondContact OD2-CE 3.29Å; D184-K311 IonicContact OD2-NZ 3.38Å; D184-K311 PolarHBondContact OD2-NZ 3.01Å; Y300-K311 VanDerWaalsContact CE1-NZ 3.33Å; Y300-K311 VanDerWaalsContact CE2-CE 3.43Å; Y300-K311 VanDerWaalsContact CZ-CE 3.4Å; Y300-K311 WeakPolarHBondContact OH-CE 3.27Å; Y302-K311 WeakPolarHBondContact O-CE 3.22Å; Y302-K311 PolarHBondContact O-NZ 3.31Å; V304-K311 HydrophobicContact CB-CG 4.38Å; V304-K311 HydrophobicContact CG1-CD 3.78Å; V304-K311 HydrophobicContact CG1-CG 3.67Å; V304-K311 HydrophobicContact CG2-CD 4.26Å; V304-K311 HydrophobicContact CG2-CG 3.81Å
312	R	98	Very high	94.9	Very high	38 Å²	38	47 Å²	47	14%	0.143	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.5	179.4	55.5	175.3	171.6	-102.6	-10.5	111.7	E78 I79 Y81 Y125 G126 S128 I314	E78-R312 HydrophobicContact CG-CB 4.26Å; E78-R312 WeakPolarHBondContact OE1-CD 3.41Å; E78-R312 IonicContact OE1-NE 3.53Å; E78-R312 IonicContact OE1-NH1 2.82Å; E78-R312 IonicContact OE2-NE 3.9Å; I79-R312 CarbonylContact O-C 3.59Å; I79-R312 WeakPolarHBondContact O-CA 3.37Å; I79-R312 WeakPolarHBondContact O-CB 3.42Å; Y81-R312 VanDerWaalsContact CE1-C 3.42Å; Y125-R312 CarbonylContact C-O 3.58Å; Y125-R312 WeakPolarHBondContact CA-O 3.48Å; G126-R312 PolarHBondContact N-O 3.47Å; G126-R312 PolarHBondContact O-N 3.33Å; S128-R312 PolarHBondContact OG-NH1 2.8Å; S128-R312 PolarHBondContact OG-NH2 2.98Å; R312-I314 HydrophobicContact CG-CD1 4.38Å; R312-I314 HydrophobicContact CG-CG1 4.43Å
313	V	98.3	Very high	94.8	Very high	5 Å²	5	48.4 Å²	48.4	3%	0.03	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.2	167.4	173.4	0	0	0	0	107.9	E78 I79 Y81 M123 Y124 L186 L296	E78-V313 WeakPolarHBondContact CA-O 3.46Å; I79-V313 HydrophobicContact CG2-CB 4.09Å; I79-V313 PolarHBondContact N-O 3.37Å; I79-V313 PolarHBondContact O-N 2.99Å; Y81-V313 HydrophobicContact CD1-CG2 3.84Å; Y81-V313 HydrophobicContact CE1-CG2 3.58Å; M123-V313 HydrophobicContact CE-CG1 3.69Å; M123-V313 HydrophobicContact CE-CG2 4.44Å; M123-V313 HydrophobicContact CG-CG1 4.11Å; Y124-V313 WeakPolarHBondContact O-CA 3.48Å; L186-V313 HydrophobicContact CD1-CG2 3.77Å; L186-V313 HydrophobicContact CD2-CG2 4.03Å; L186-V313 HydrophobicContact CG-CG2 4.42Å; L296-V313 HydrophobicContact CD1-CG2 4.38Å; L296-V313 HydrophobicContact CD2-CB 3.99Å; L296-V313 HydrophobicContact CD2-CG2 3.62Å
314	I	98.3	Very high	94.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	123	178.7	-56.5	153.9	0	0	0	107.9	E76 F77 E78 M123 Y124 R273 R312	E76-I314 HydrophobicContact CG-CG2 3.65Å; F77-I314 CarbonylContact O-C 3.59Å; F77-I314 VanDerWaalsContact O-CA 3.32Å; F77-I314 WeakPolarHBondContact O-CA 3.29Å; E78-I314 HydrophobicContact CB-CG1 4.22Å; E78-I314 HydrophobicContact CG-CG1 3.88Å; M123-I314 CarbonylContact C-O 3.51Å; M123-I314 WeakPolarHBondContact CA-O 3.36Å; Y124-I314 PolarHBondContact N-O 2.84Å; Y124-I314 PolarHBondContact O-N 2.81Å; R273-I314 HydrophobicContact CB-CD1 3.94Å; R312-I314 HydrophobicContact CG-CD1 4.38Å; R312-I314 HydrophobicContact CG-CG1 4.43Å
315	L	98.1	Very high	94.8	Very high	3 Å²	3	56.5 Å²	56.5	2%	0.016	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120.2	169.8	-60.8	176.9	0	0	0	107.6	E76 F77 F111 F117 V121 M123 L188 L289	E76-L315 CarbonylContact C-O 3.23Å; E76-L315 VanDerWaalsContact CA-O 3.3Å; E76-L315 WeakPolarHBondContact CA-O 3.4Å; F77-L315 HydrophobicContact CD1-CD1 4.48Å; F77-L315 PolarHBondContact N-O 3.4Å; F77-L315 PolarHBondContact O-N 2.94Å; F111-L315 HydrophobicContact CE2-CD1 4.39Å; F111-L315 HydrophobicContact CZ-CD1 4.2Å; F117-L315 HydrophobicContact CE1-CB 4.43Å; V121-L315 HydrophobicContact CG1-CB 4.12Å; V121-L315 HydrophobicContact CG1-CD2 4.46Å; M123-L315 HydrophobicContact CB-CD2 3.79Å; M123-L315 HydrophobicContact CG-CD2 3.74Å; M123-L315 HydrophobicContact SD-CD2 4.48Å; L188-L315 HydrophobicContact CD2-CD1 4.25Å; L289-L315 HydrophobicContact CD1-CD1 4.15Å
316	S	97.3	Very high	95	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.9	-178.9	-171.4	0	0	0	0	111.5	K75 F122	K75-S316 WeakPolarHBondContact O-CA 3.3Å; F122-S316 PolarHBondContact N-O 2.89Å; F122-S316 PolarHBondContact O-N 3.25Å
317	T	96.4	Very high	95.3	Very high	12 Å²	12	56.1 Å²	56.1	7%	0.074	27%	0.274	C	S	.	.			trans	-76.1	167.1	157	60.9	0	0	0	0	109.8	I74 K75 F117 S119	I74-T317 WeakPolarHBondContact CG2-O 3.34Å; K75-T317 PolarHBondContact N-OG1 3.29Å; K75-T317 PolarHBondContact O-N 2.89Å; F117-T317 HydrophobicContact CB-CG2 4.22Å; F117-T317 HydrophobicContact CD1-CG2 3.66Å; F117-T317 HydrophobicContact CE1-CG2 4.48Å; F117-T317 HydrophobicContact CG-CG2 4.34Å; S119-T317 WeakPolarHBondContact OG-CB 3.4Å; S119-T317 WeakPolarHBondContact OG-CG2 3.48Å
318	I	94.6	Very high	95.4	Very high	74 Å²	74	56.5 Å²	56.5	38%	0.379	28%	0.279	S	S	.	.			trans	-124.6	154.1	172.9	66.1	175.9	0	0	0	110.4	F122	F122-I318 HydrophobicContact CD2-CB 4.48Å; F122-I318 HydrophobicContact CD2-CD1 4.26Å; F122-I318 HydrophobicContact CD2-CG1 4.14Å; F122-I318 HydrophobicContact CD2-CG2 3.72Å; F122-I318 HydrophobicContact CE1-CD1 4.37Å; F122-I318 HydrophobicContact CE2-CB 4.33Å; F122-I318 HydrophobicContact CE2-CD1 3.46Å; F122-I318 VanDerWaalsContact CE2-CD1 3.46Å; F122-I318 HydrophobicContact CE2-CG1 3.53Å; F122-I318 HydrophobicContact CE2-CG2 3.99Å; F122-I318 HydrophobicContact CG-CG2 4.32Å; F122-I318 HydrophobicContact CZ-CD1 3.51Å; F122-I318 HydrophobicContact CZ-CG1 4.12Å
319	S	93.5	Very high	95.5	Very high	27 Å²	27	48.8 Å²	48.8	19%	0.189	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-104.2	179.7	164.9	73.5	0	0	0	0	110.1	M321 G322	S319-M321 PolarHBondContact O-N 3.46Å; S319-M321 VanDerWaalsContact O-N 3.17Å; S319-M321 PolarHBondContact OG-N 3Å; S319-G322 PolarHBondContact N-O 2.98Å; S319-G322 PolarHBondContact O-N 3.42Å; S319-G322 PolarHBondContact OG-O 2.81Å
320	W	92.9	Very high	95.6	Very high	203 Å²	203	52.6 Å²	52.6	77%	0.769	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-23.8	172.5	68.1	-92.8	0	0	0	113.4	L67	L67-W320 HydrophobicContact CD2-CH2 4.02Å; L67-W320 HydrophobicContact CD2-CZ2 3.94Å
321	M	90.8	Very high	95.6	Very high	59 Å²	59	49.4 Å²	49.4	29%	0.291	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	0.6	178.2	-169.9	173	58	0	0	112.7	L67 S319 L328	L67-M321 HydrophobicContact CB-CE 4.28Å; L67-M321 HydrophobicContact CD2-CE 4.16Å; L67-M321 HydrophobicContact CD2-SD 3.53Å; L67-M321 VanDerWaalsContact CD2-SD 3.53Å; L67-M321 HydrophobicContact CG-SD 4.48Å; S319-M321 PolarHBondContact O-N 3.46Å; S319-M321 VanDerWaalsContact O-N 3.17Å; S319-M321 PolarHBondContact OG-N 3Å; M321-L328 HydrophobicContact SD-CD2 3.71Å
322	G	91.9	Very high	95.6	Very high	29 Å²	29	53.2 Å²	53.2	30%	0.299	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	100.9	-148.2	-176.5	0	0	0	0	0	113	I74 S319	I74-G322 VanDerWaalsContact CD1-O 3.3Å; I74-G322 WeakPolarHBondContact CD1-O 3.4Å; S319-G322 PolarHBondContact N-O 2.98Å; S319-G322 PolarHBondContact O-N 3.42Å; S319-G322 PolarHBondContact OG-O 2.81Å
323	G	91.2	Very high	95.6	Very high	33 Å²	33	53.7 Å²	53.7	34%	0.34	28%	0.276	S	S	.	.	S	Bend	trans	-78.8	-177.3	-176.4	0	0	0	0	0	114.1	I74 N325	I74-G323 VanDerWaalsContact CD1-C 3.41Å; I74-G323 WeakPolarHBondContact CD1-O 3.21Å; G323-N325 PolarHBondContact O-N 3.4Å; G323-N325 VanDerWaalsContact O-N 3.15Å
324	K	93	Very high	95.6	Very high	91 Å²	91	57.1 Å²	57.1	40%	0.396	30%	0.298	S	S	.	.	S	Bend	trans	-66.1	110.9	-178.9	-172.3	173.7	-172	179.6	0	111	I74 E76	I74-K324 HydrophobicContact CB-CB 4.16Å; I74-K324 HydrophobicContact CG2-CB 3.95Å; E76-K324 HydrophobicContact CB-CD 4.21Å
325	N	95	Very high	95.6	Very high	94 Å²	94	60.6 Å²	60.6	50%	0.503	32%	0.319	S	S	.	.			trans	-154.1	97.2	172.6	-173.7	-4.4	0	0	0	111	S71 G323 F327	S71-N325 PolarHBondContact OG-N 3.26Å; S71-N325 PolarHBondContact OG-O 3.13Å; G323-N325 PolarHBondContact O-N 3.4Å; G323-N325 VanDerWaalsContact O-N 3.15Å; N325-F327 PolarHBondContact O-N 2.91Å; N325-F327 WeakPolarHBondContact OD1-CB 3.24Å; N325-F327 PolarHBondContact OD1-N 3.4Å; N325-F327 VanDerWaalsContact OD1-N 3.14Å
326	P	95.4	Very high	95.6	Very high	42 Å²	42	60.5 Å²	60.5	27%	0.273	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-8.8	-176.7	31.1	-35.3	0	0	0	113.4	Y68 L328 G329 I330	Y68-P326 HydrophobicContact CD2-CB 3.91Å; Y68-P326 HydrophobicContact CE2-CB 3.95Å; P326-L328 VanDerWaalsContact C-N 3.31Å; P326-L328 PolarHBondContact O-N 2.92Å; P326-G329 PolarHBondContact O-N 3.36Å; P326-G329 VanDerWaalsContact O-N 3.15Å; P326-I330 HydrophobicContact CB-CD1 4.16Å; P326-I330 HydrophobicContact CG-CD1 4.46Å; P326-I330 WeakPolarHBondContact O-CG1 3.4Å; P326-I330 PolarHBondContact O-N 3.04Å
327	F	96.9	Very high	95.6	Very high	142 Å²	142	63.1 Å²	63.1	62%	0.623	34%	0.337	S	S	*	.	H	α-helix	trans	-55.5	-43.9	-173.9	175.9	-100.4	0	0	0	112.6	N325 G329 I330 A331	N325-F327 PolarHBondContact O-N 2.91Å; N325-F327 WeakPolarHBondContact OD1-CB 3.24Å; N325-F327 PolarHBondContact OD1-N 3.4Å; N325-F327 VanDerWaalsContact OD1-N 3.14Å; F327-G329 PolarHBondContact O-N 3.1Å; F327-I330 PolarHBondContact O-N 3.22Å; F327-A331 WeakPolarHBondContact O-CB 3.5Å; F327-A331 PolarHBondContact O-N 3.24Å
328	L	95.6	Very high	95.7	Very high	72 Å²	72	66.2 Å²	66.2	38%	0.377	36%	0.355	S	S	.	.	H	α-helix	trans	-62.6	-44.7	-179.1	-166.8	70	0	0	0	111	L67 M321 P326 I330 A331 Y332	L67-L328 HydrophobicContact CD1-CD2 4.01Å; L67-L328 HydrophobicContact CD1-CG 4.12Å; M321-L328 HydrophobicContact SD-CD2 3.71Å; P326-L328 VanDerWaalsContact C-N 3.31Å; P326-L328 PolarHBondContact O-N 2.92Å; L328-I330 PolarHBondContact O-N 3.46Å; L328-A331 PolarHBondContact O-N 3.26Å; L328-Y332 HydrophobicContact CD1-CD2 4.2Å; L328-Y332 HydrophobicContact CD1-CE2 3.86Å; L328-Y332 HydrophobicContact CG-CD2 4.1Å; L328-Y332 HydrophobicContact CG-CE2 4Å; L328-Y332 VanDerWaalsContact O-CD2 3.28Å; L328-Y332 WeakPolarHBondContact O-CD2 3.33Å; L328-Y332 PolarHBondContact O-N 2.93Å
329	G	96.9	Very high	95.8	Very high	1 Å²	1	63.8 Å²	63.8	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-46.2	175.6	0	0	0	0	0	112.3	G64 P326 F327 A331 Y332 I333	G64-G329 VanDerWaalsContact O-CA 3.32Å; G64-G329 WeakPolarHBondContact O-CA 3.41Å; P326-G329 PolarHBondContact O-N 3.36Å; P326-G329 VanDerWaalsContact O-N 3.15Å; F327-G329 PolarHBondContact O-N 3.1Å; G329-A331 VanDerWaalsContact C-N 3.34Å; G329-A331 PolarHBondContact O-N 3.45Å; G329-Y332 PolarHBondContact O-N 2.89Å; G329-I333 VanDerWaalsContact O-CG1 3.3Å; G329-I333 WeakPolarHBondContact O-CG1 3.26Å; G329-I333 PolarHBondContact O-N 3.18Å
330	I	97.8	Very high	95.9	Very high	81 Å²	81	66.1 Å²	66.1	42%	0.415	35%	0.351	S	S	.	.	H	α-helix	trans	-60.9	-42.6	177	-64.7	166.4	0	0	0	111.1	Y68 P326 F327 L328 I333 T334	Y68-I330 HydrophobicContact CD2-CG1 4.04Å; Y68-I330 HydrophobicContact CE2-CD1 4.36Å; Y68-I330 HydrophobicContact CE2-CG1 4.14Å; P326-I330 HydrophobicContact CB-CD1 4.16Å; P326-I330 HydrophobicContact CG-CD1 4.46Å; P326-I330 WeakPolarHBondContact O-CG1 3.4Å; P326-I330 PolarHBondContact O-N 3.04Å; F327-I330 PolarHBondContact O-N 3.22Å; L328-I330 PolarHBondContact O-N 3.46Å; I330-I333 PolarHBondContact O-N 3.33Å; I330-T334 VanDerWaalsContact O-CB 3.32Å; I330-T334 WeakPolarHBondContact O-CB 3.4Å; I330-T334 PolarHBondContact O-N 3.49Å; I330-T334 PolarHBondContact O-OG1 3.05Å
331	A	98.1	Very high	96.1	Very high	31 Å²	31	62.9 Å²	62.9	26%	0.256	34%	0.343	S	S	.	.	H	α-helix	trans	-63.2	-45.6	179.2	0	0	0	0	0	111.7	F327 L328 G329 T334 V335	F327-A331 WeakPolarHBondContact O-CB 3.5Å; F327-A331 PolarHBondContact O-N 3.24Å; L328-A331 PolarHBondContact O-N 3.26Å; G329-A331 VanDerWaalsContact C-N 3.34Å; G329-A331 PolarHBondContact O-N 3.45Å; A331-T334 PolarHBondContact O-N 3.4Å; A331-V335 WeakPolarHBondContact O-CB 3.26Å; A331-V335 WeakPolarHBondContact O-CG2 3.16Å; A331-V335 PolarHBondContact O-N 3.03Å
332	Y	98.1	Very high	96.3	Very high	80 Å²	80	63.7 Å²	63.7	31%	0.314	35%	0.348	S	S	.	.	H	α-helix	trans	-62.8	-44.2	176.9	-91.3	-101.2	0	0	0	112.3	F60 I63 L67 L328 G329 G336	F60-Y332 HydrophobicContact CB-CD1 4.16Å; F60-Y332 HydrophobicContact CD1-CD1 4.28Å; F60-Y332 HydrophobicContact CD1-CE1 4.3Å; F60-Y332 HydrophobicContact CD2-CD1 4.1Å; F60-Y332 HydrophobicContact CD2-CE1 4.43Å; F60-Y332 HydrophobicContact CE1-CE1 4.36Å; F60-Y332 HydrophobicContact CE2-CE1 4.49Å; F60-Y332 AromaticContact CG-CD1 3.93Å; F60-Y332 HydrophobicContact CG-CD1 3.93Å; F60-Y332 HydrophobicContact CG-CE1 4.33Å; F60-Y332 HydrophobicContact CZ-CE1 4.46Å; I63-Y332 HydrophobicContact CB-CD1 4.41Å; I63-Y332 HydrophobicContact CG2-CD1 3.91Å; I63-Y332 HydrophobicContact CG2-CE1 4.02Å; L67-Y332 HydrophobicContact CD1-CD2 4.08Å; L67-Y332 HydrophobicContact CD1-CE2 4.29Å; L67-Y332 HydrophobicContact CD1-CG 4.34Å; L328-Y332 HydrophobicContact CD1-CD2 4.2Å; L328-Y332 HydrophobicContact CD1-CE2 3.86Å; L328-Y332 HydrophobicContact CG-CD2 4.1Å; L328-Y332 HydrophobicContact CG-CE2 4Å; L328-Y332 VanDerWaalsContact O-CD2 3.28Å; L328-Y332 WeakPolarHBondContact O-CD2 3.33Å; L328-Y332 PolarHBondContact O-N 2.93Å; G329-Y332 PolarHBondContact O-N 2.89Å; Y332-G336 PolarHBondContact O-N 2.95Å
333	I	98.3	Very high	96.4	Very high	48 Å²	48	62.3 Å²	62.3	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-61.4	-48.4	175.8	-66	166.5	0	0	0	109.8	I65 G329 I330 G336 S337	I65-I333 HydrophobicContact CG1-CD1 4.05Å; I65-I333 HydrophobicContact CG1-CG1 4.3Å; G329-I333 VanDerWaalsContact O-CG1 3.3Å; G329-I333 WeakPolarHBondContact O-CG1 3.26Å; G329-I333 PolarHBondContact O-N 3.18Å; I330-I333 PolarHBondContact O-N 3.33Å; I333-G336 PolarHBondContact O-N 3.41Å; I333-S337 WeakPolarHBondContact O-CB 3.4Å; I333-S337 PolarHBondContact O-N 3.22Å; I333-S337 PolarHBondContact O-OG 3.31Å
334	T	98.2	Very high	96.5	Very high	77 Å²	77	63.3 Å²	63.3	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-61.9	-51.4	-177.3	-55.1	0	0	0	0	111.4	I330 A331 G336 S337 V338	I330-T334 VanDerWaalsContact O-CB 3.32Å; I330-T334 WeakPolarHBondContact O-CB 3.4Å; I330-T334 PolarHBondContact O-N 3.49Å; I330-T334 PolarHBondContact O-OG1 3.05Å; A331-T334 PolarHBondContact O-N 3.4Å; T334-G336 PolarHBondContact O-N 3.39Å; T334-S337 PolarHBondContact O-N 2.96Å; T334-V338 WeakPolarHBondContact O-CB 3.34Å; T334-V338 VanDerWaalsContact O-CG2 3.29Å; T334-V338 WeakPolarHBondContact O-CG2 3.38Å; T334-V338 PolarHBondContact O-N 3.5Å
335	V	98	Very high	96.5	Very high	73 Å²	73	61.4 Å²	61.4	44%	0.442	33%	0.329	S	S	.	.	H	α-helix	trans	-63.7	-42.5	178.7	174	0	0	0	0	110.7	F60 A331 V338 C339	F60-V335 HydrophobicContact CD2-CG1 4.15Å; F60-V335 HydrophobicContact CE2-CG1 4.3Å; A331-V335 WeakPolarHBondContact O-CB 3.26Å; A331-V335 WeakPolarHBondContact O-CG2 3.16Å; A331-V335 PolarHBondContact O-N 3.03Å; V335-V338 PolarHBondContact O-N 3.4Å; V335-C339 WeakPolarHBondContact O-CB 3.36Å; V335-C339 PolarHBondContact O-N 3.4Å; V335-C339 PolarHBondContact O-SG 2.98Å; V335-C339 VanDerWaalsContact O-SG 3.33Å
336	G	98	Very high	96.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.8	0	0	0	0	0	112.8	G57 Y332 I333 T334 C339 F340	G57-G336 WeakPolarHBondContact CA-O 3.34Å; Y332-G336 PolarHBondContact O-N 2.95Å; I333-G336 PolarHBondContact O-N 3.41Å; T334-G336 PolarHBondContact O-N 3.39Å; G336-C339 PolarHBondContact O-N 3.02Å; G336-F340 WeakPolarHBondContact O-CB 3.32Å; G336-F340 PolarHBondContact O-N 3.44Å
337	S	97.8	Very high	96.2	Very high	57 Å²	57	62.1 Å²	62.1	40%	0.399	33%	0.33	S	S	.	.	H	α-helix	trans	-65.3	-42.3	176.8	-65	0	0	0	0	112.4	I333 T334 F340 F341	I333-S337 WeakPolarHBondContact O-CB 3.4Å; I333-S337 PolarHBondContact O-N 3.22Å; I333-S337 PolarHBondContact O-OG 3.31Å; T334-S337 PolarHBondContact O-N 2.96Å; S337-F340 PolarHBondContact O-N 3.4Å; S337-F341 VanDerWaalsContact O-CB 3.32Å; S337-F341 WeakPolarHBondContact O-CB 3.33Å; S337-F341 PolarHBondContact O-N 3.48Å
338	V	97.8	Very high	96	Very high	77 Å²	77	60.2 Å²	60.2	47%	0.467	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-45.6	175.7	170.9	0	0	0	0	110.6	T334 V335 F340 F341 L342	T334-V338 WeakPolarHBondContact O-CB 3.34Å; T334-V338 VanDerWaalsContact O-CG2 3.29Å; T334-V338 WeakPolarHBondContact O-CG2 3.38Å; T334-V338 PolarHBondContact O-N 3.5Å; V335-V338 PolarHBondContact O-N 3.4Å; V338-F340 PolarHBondContact O-N 2.78Å; V338-F341 PolarHBondContact O-N 3.24Å; V338-L342 HydrophobicContact CG1-CD1 3.9Å; V338-L342 HydrophobicContact CG1-CG 4.33Å; V338-L342 WeakPolarHBondContact O-CB 3.25Å; V338-L342 VanDerWaalsContact O-CG 3.29Å; V338-L342 WeakPolarHBondContact O-CG 3.37Å; V338-L342 PolarHBondContact O-N 3.08Å
339	C	96.6	Very high	95.7	Very high	22 Å²	22	60.6 Å²	60.6	15%	0.149	33%	0.327	C	S	.	.	H	α-helix	trans	-60.7	-44.3	176.5	-76.4	0	0	0	0	112.2	F53 I56 V335 G336 L342 G343	F53-C339 HydrophobicContact CD1-CB 4.11Å; F53-C339 WeakPolarHBondContact CD1-O 3.5Å; I56-C339 HydrophobicContact CG2-CB 4.27Å; V335-C339 WeakPolarHBondContact O-CB 3.36Å; V335-C339 PolarHBondContact O-N 3.4Å; V335-C339 PolarHBondContact O-SG 2.98Å; V335-C339 VanDerWaalsContact O-SG 3.33Å; G336-C339 PolarHBondContact O-N 3.02Å; C339-L342 PolarHBondContact O-N 3.45Å; C339-G343 PolarHBondContact O-N 3.17Å
340	F	95.9	Very high	95.3	Very high	77 Å²	77	64.9 Å²	64.9	34%	0.338	35%	0.346	S	S	.	.	H	α-helix	trans	-63.5	-45.8	177.6	-170.8	-86.2	0	0	0	111.4	F54 L58 G336 S337 V338 G343 V344	F54-F340 AromaticContact CD1-CD2 3.77Å; F54-F340 HydrophobicContact CD1-CD2 3.77Å; F54-F340 AromaticContact CD1-CE2 3.56Å; F54-F340 HydrophobicContact CD1-CE2 3.56Å; F54-F340 HydrophobicContact CD1-CG 4.49Å; F54-F340 HydrophobicContact CD1-CZ 4.1Å; F54-F340 HydrophobicContact CE1-CD2 4.26Å; F54-F340 HydrophobicContact CE1-CE1 4.41Å; F54-F340 AromaticContact CE1-CE2 3.94Å; F54-F340 HydrophobicContact CE1-CE2 3.94Å; F54-F340 HydrophobicContact CE1-CZ 4.01Å; L58-F340 HydrophobicContact CD2-CE2 4.16Å; L58-F340 HydrophobicContact CG-CE2 4.38Å; G336-F340 WeakPolarHBondContact O-CB 3.32Å; G336-F340 PolarHBondContact O-N 3.44Å; S337-F340 PolarHBondContact O-N 3.4Å; V338-F340 PolarHBondContact O-N 2.78Å; F340-G343 WeakPolarHBondContact O-CA 3.45Å; F340-G343 PolarHBondContact O-N 3.28Å; F340-V344 HydrophobicContact CD1-CG2 4.15Å; F340-V344 HydrophobicContact CE1-CG2 3.89Å; F340-V344 WeakPolarHBondContact O-CG2 3.42Å; F340-V344 PolarHBondContact O-N 3.36Å
341	F	96.6	Very high	94.8	Very high	135 Å²	135	68.4 Å²	68.4	59%	0.592	36%	0.36	S	S	*	.	H	α-helix	trans	-60.7	-46.6	177.1	176.9	-100.9	0	0	0	112	S337 V338 G343 V344 V345	S337-F341 VanDerWaalsContact O-CB 3.32Å; S337-F341 WeakPolarHBondContact O-CB 3.33Å; S337-F341 PolarHBondContact O-N 3.48Å; V338-F341 PolarHBondContact O-N 3.24Å; F341-G343 VanDerWaalsContact C-N 3.28Å; F341-G343 PolarHBondContact O-N 3.32Å; F341-V344 PolarHBondContact O-N 2.9Å; F341-V344 VanDerWaalsContact O-N 3.15Å; F341-V345 HydrophobicContact CD1-CG2 4.28Å; F341-V345 HydrophobicContact CE1-CG2 3.82Å; F341-V345 HydrophobicContact CE2-CG2 4.25Å; F341-V345 HydrophobicContact CZ-CG2 3.8Å; F341-V345 WeakPolarHBondContact O-CG2 3.23Å; F341-V345 PolarHBondContact O-N 2.82Å
342	L	94.8	Very high	94.3	Very high	76 Å²	76	74 Å²	74	40%	0.398	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-38.6	174.6	-71.6	174.6	0	0	0	111.6	F53 V338 C339 V344 V345 L346	F53-L342 HydrophobicContact CD1-CB 4.38Å; F53-L342 HydrophobicContact CE1-CB 4.31Å; F53-L342 HydrophobicContact CE1-CD1 4.41Å; V338-L342 HydrophobicContact CG1-CD1 3.9Å; V338-L342 HydrophobicContact CG1-CG 4.33Å; V338-L342 WeakPolarHBondContact O-CB 3.25Å; V338-L342 VanDerWaalsContact O-CG 3.29Å; V338-L342 WeakPolarHBondContact O-CG 3.37Å; V338-L342 PolarHBondContact O-N 3.08Å; C339-L342 PolarHBondContact O-N 3.45Å; L342-V344 PolarHBondContact O-N 3.37Å; L342-V345 PolarHBondContact O-N 3.1Å; L342-L346 WeakPolarHBondContact O-CB 3.46Å; L342-L346 VanDerWaalsContact O-CG 3.29Å; L342-L346 WeakPolarHBondContact O-CG 3.38Å; L342-L346 PolarHBondContact O-N 3.23Å
343	G	94.3	Very high	93.4	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-57.2	-45.6	172.3	0	0	0	0	0	112.6	L50 F54 C339 F340 F341 L347	L50-G343 WeakPolarHBondContact CD1-O 3.2Å; F54-G343 VanDerWaalsContact CZ-C 3.49Å; C339-G343 PolarHBondContact O-N 3.17Å; F340-G343 WeakPolarHBondContact O-CA 3.45Å; F340-G343 PolarHBondContact O-N 3.28Å; F341-G343 VanDerWaalsContact C-N 3.28Å; F341-G343 PolarHBondContact O-N 3.32Å; G343-L347 WeakPolarHBondContact O-CB 3.23Å; G343-L347 PolarHBondContact O-N 2.99Å
344	V	94.6	Very high	91.9	Very high	53 Å²	53	75.4 Å²	75.4	32%	0.321	39%	0.393	S	S	.	.	H	α-helix	trans	-63.6	-45.8	175.9	174.8	0	0	0	0	111.6	F54 F340 F341 L342 L347 I348	F54-V344 HydrophobicContact CE1-CG2 3.84Å; F54-V344 HydrophobicContact CZ-CG2 4.01Å; F340-V344 HydrophobicContact CD1-CG2 4.15Å; F340-V344 HydrophobicContact CE1-CG2 3.89Å; F340-V344 WeakPolarHBondContact O-CG2 3.42Å; F340-V344 PolarHBondContact O-N 3.36Å; F341-V344 PolarHBondContact O-N 2.9Å; F341-V344 VanDerWaalsContact O-N 3.15Å; L342-V344 PolarHBondContact O-N 3.37Å; V344-L347 WeakPolarHBondContact O-CB 3Å; V344-L347 PolarHBondContact O-N 3.45Å; V344-I348 HydrophobicContact CG1-CD1 4.01Å; V344-I348 WeakPolarHBondContact O-CG1 3.45Å; V344-I348 PolarHBondContact O-N 3.28Å
345	V	92.9	Very high	90	Very high	52 Å²	52	76.3 Å²	76.3	32%	0.315	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-46.5	178.6	172.3	0	0	0	0	111.1	F341 L342 L347 I348 I349	F341-V345 HydrophobicContact CD1-CG2 4.28Å; F341-V345 HydrophobicContact CE1-CG2 3.82Å; F341-V345 HydrophobicContact CE2-CG2 4.25Å; F341-V345 HydrophobicContact CZ-CG2 3.8Å; F341-V345 WeakPolarHBondContact O-CG2 3.23Å; F341-V345 PolarHBondContact O-N 2.82Å; L342-V345 PolarHBondContact O-N 3.1Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 2.6Å; V345-I348 PolarHBondContact O-N 3.4Å; V345-I349 HydrophobicContact CG1-CD1 3.81Å; V345-I349 WeakPolarHBondContact O-CG1 3.38Å; V345-I349 PolarHBondContact O-N 3.14Å
346	L	91.2	Very high	87.9	Confident	70 Å²	70	81.8 Å²	81.8	37%	0.366	42%	0.416	S	S	.	.	H	α-helix	trans	-64.2	-34.2	176.8	-71.3	173.9	0	0	0	112	L50 F53 L342 I349 H350	L50-L346 HydrophobicContact CD1-CB 3.97Å; F53-L346 HydrophobicContact CD2-CD1 4.15Å; F53-L346 HydrophobicContact CE2-CD1 3.86Å; F53-L346 HydrophobicContact CZ-CD1 4.43Å; L342-L346 WeakPolarHBondContact O-CB 3.46Å; L342-L346 VanDerWaalsContact O-CG 3.29Å; L342-L346 WeakPolarHBondContact O-CG 3.38Å; L342-L346 PolarHBondContact O-N 3.23Å; L346-I349 PolarHBondContact O-N 3.13Å; L346-H350 WeakPolarHBondContact O-CB 3.49Å; L346-H350 PolarHBondContact O-N 2.97Å
347	L	92.7	Very high	85.6	Confident	81 Å²	81	88.5 Å²	88.5	42%	0.424	45%	0.452	S	S	.	.	H	α-helix	trans	-61.6	-47.3	174.4	-169	144.9	0	0	0	110.8	L50 F54 G343 V344 V345 H350 H351	L50-L347 VanDerWaalsContact CD1-CA 3.46Å; L50-L347 HydrophobicContact CD1-CB 3.75Å; L50-L347 HydrophobicContact CD1-CG 4.46Å; L50-L347 VanDerWaalsContact CD1-N 3.29Å; L50-L347 HydrophobicContact CD2-CD1 4.04Å; L50-L347 HydrophobicContact CD2-CG 4.48Å; F54-L347 HydrophobicContact CE2-CD1 4.06Å; F54-L347 HydrophobicContact CZ-CD1 4.16Å; G343-L347 WeakPolarHBondContact O-CB 3.23Å; G343-L347 PolarHBondContact O-N 2.99Å; V344-L347 WeakPolarHBondContact O-CB 3Å; V344-L347 PolarHBondContact O-N 3.45Å; V345-L347 VanDerWaalsContact C-N 3.29Å; V345-L347 PolarHBondContact O-N 2.6Å; L347-H350 PolarHBondContact O-N 3.35Å; L347-H351 WeakPolarHBondContact O-CB 3.44Å; L347-H351 PolarHBondContact O-N 3.49Å
348	I	91.6	Very high	83.2	Confident	102 Å²	102	93 Å²	93	52%	0.523	47%	0.472	S	S	.	.	H	α-helix	trans	-62.7	-46.5	178.9	-66	164.9	0	0	0	110.4	V344 V345 H351 K352	V344-I348 HydrophobicContact CG1-CD1 4.01Å; V344-I348 WeakPolarHBondContact O-CG1 3.45Å; V344-I348 PolarHBondContact O-N 3.28Å; V345-I348 PolarHBondContact O-N 3.4Å; I348-H351 PolarHBondContact O-N 3.11Å; I348-K352 WeakPolarHBondContact O-CB 3.35Å; I348-K352 PolarHBondContact O-N 3.21Å
349	I	89.5	Confident	80.8	Confident	80 Å²	80	95.1 Å²	95.1	41%	0.41	48%	0.484	S	S	.	.	H	α-helix	trans	-62.7	-46.9	178	-67.7	169.3	0	0	0	110.4	V345 L346 H351 K352 Y353	V345-I349 HydrophobicContact CG1-CD1 3.81Å; V345-I349 WeakPolarHBondContact O-CG1 3.38Å; V345-I349 PolarHBondContact O-N 3.14Å; L346-I349 PolarHBondContact O-N 3.13Å; I349-H351 VanDerWaalsContact C-N 3.32Å; I349-H351 PolarHBondContact O-N 3.19Å; I349-K352 PolarHBondContact O-N 3.32Å; I349-Y353 HydrophobicContact CG2-CD2 3.88Å; I349-Y353 HydrophobicContact CG2-CE2 4.45Å; I349-Y353 WeakPolarHBondContact O-CD2 3.16Å; I349-Y353 PolarHBondContact O-N 3.27Å
350	H	87.8	Confident	78.3	Confident	90 Å²	90	98 Å²	98	42%	0.417	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-41.6	179	-179.1	-100.8	0	0	0	111.6	A46 L346 L347 G354	A46-H350 HydrophobicContact CB-CB 4.45Å; A46-H350 VanDerWaalsContact CB-CD2 3.45Å; A46-H350 WeakPolarHBondContact CB-CD2 3.31Å; L346-H350 WeakPolarHBondContact O-CB 3.49Å; L346-H350 PolarHBondContact O-N 2.97Å; L347-H350 PolarHBondContact O-N 3.35Å; H350-G354 WeakPolarHBondContact O-CA 3.46Å; H350-G354 PolarHBondContact O-N 3.08Å
351	H	88.2	Confident	75.9	Confident	155 Å²	155	101.9 Å²	101.9	72%	0.718	53%	0.534	S	S	*	.	H	α-helix	trans	-66.4	-39.5	175.9	-167.9	-91.2	0	0	0	112.2	L347 I348 I349	L347-H351 WeakPolarHBondContact O-CB 3.44Å; L347-H351 PolarHBondContact O-N 3.49Å; I348-H351 PolarHBondContact O-N 3.11Å; I349-H351 VanDerWaalsContact C-N 3.32Å; I349-H351 PolarHBondContact O-N 3.19Å
352	K	87.9	Confident	73.3	Confident	148 Å²	148	102.9 Å²	102.9	64%	0.643	54%	0.544	S	S	*	.	H	α-helix	trans	-71.3	-38.2	-179.6	-174.4	177.1	177.4	-175.4	0	113.6	I348 I349	I348-K352 WeakPolarHBondContact O-CB 3.35Å; I348-K352 PolarHBondContact O-N 3.21Å; I349-K352 PolarHBondContact O-N 3.32Å
353	Y	79.9	Confident	70.9	Confident	119 Å²	119	104.6 Å²	104.6	47%	0.467	56%	0.56	S	S	.	*	H	α-helix	trans	-108.7	-14.8	-173.2	-66.6	-82.9	0	0	0	114	I349 S355 R356	I349-Y353 HydrophobicContact CG2-CD2 3.88Å; I349-Y353 HydrophobicContact CG2-CE2 4.45Å; I349-Y353 WeakPolarHBondContact O-CD2 3.16Å; I349-Y353 PolarHBondContact O-N 3.27Å; Y353-S355 VanDerWaalsContact C-N 3.3Å; Y353-S355 PolarHBondContact O-N 3.16Å; Y353-R356 WeakPolarHBondContact O-CB 3.16Å; Y353-R356 PolarHBondContact O-N 3.02Å
354	G	65.9	Low	68.4	Low	39 Å²	39	116.1 Å²	116.1	40%	0.402	62%	0.621	S	S	.	*	G	3₁₀ helix	trans	-69.8	-23.1	179.9	0	0	0	0	0	114.2	H350 R356	H350-G354 WeakPolarHBondContact O-CA 3.46Å; H350-G354 PolarHBondContact O-N 3.08Å; G354-R356 VanDerWaalsContact C-N 3.26Å; G354-R356 PolarHBondContact O-N 3.39Å
355	S	58.1	Low	67.1	Low	96 Å²	96	119.3 Å²	119.3	67%	0.671	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-75.3	-12	176.5	-171.9	0	0	0	0	113.5	Y353 N357	Y353-S355 VanDerWaalsContact C-N 3.3Å; Y353-S355 PolarHBondContact O-N 3.16Å; S355-N357 VanDerWaalsContact C-N 3.33Å; S355-N357 PolarHBondContact O-N 3.01Å
356	R	53.5	Low	65.8	Low	188 Å²	188	122.8 Å²	122.8	71%	0.709	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-77.2	-11.3	-173.3	-122.9	174.7	173.6	175.9	-3.6	114.9	Y353 G354	Y353-R356 WeakPolarHBondContact O-CB 3.16Å; Y353-R356 PolarHBondContact O-N 3.02Å; G354-R356 VanDerWaalsContact C-N 3.26Å; G354-R356 PolarHBondContact O-N 3.39Å
357	N	50.2	Low	64.4	Low	141 Å²	141	125.7 Å²	125.7	75%	0.754	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-100.1	-2.4	-175.7	-80.2	2	0	0	0	115.5	S355 T359	S355-N357 VanDerWaalsContact C-N 3.33Å; S355-N357 PolarHBondContact O-N 3.01Å; N357-T359 VanDerWaalsContact C-N 3.29Å; N357-T359 PolarHBondContact O-N 2.95Å
358	N	47.9	Very low	62.7	Low	153 Å²	153	128.4 Å²	128.4	82%	0.818	68%	0.684	S	S	*	*	S	Bend	trans	-88.7	13.1	177.6	-74.5	-4.4	0	0	0	113.8
359	T	46.4	Very low	60.9	Low	120 Å²	120	130 Å²	130	74%	0.736	69%	0.694	S	S	*	*			trans	-127.5	40.1	-179.3	39.7	0	0	0	0	112.4	N357	N357-T359 VanDerWaalsContact C-N 3.29Å; N357-T359 PolarHBondContact O-N 2.95Å
360	A	43.5	Very low	59	Low	82 Å²	82	133.3 Å²	133.3	68%	0.678	71%	0.712	S	S	*	*			trans	-111.8	85.1	159.8	0	0	0	0	0	107.7	I362	A360-I362 PolarHBondContact O-N 3.04Å
361	D	46.5	Very low	56.9	Low	160 Å²	160	136.4 Å²	136.4	86%	0.856	73%	0.734	S	S	*	*			trans	-52.3	119.2	160.9	-74.2	-42.5	0	0	0	108.2	P363	D361-P363 WeakPolarHBondContact O-CD 3.35Å
362	I	41.1	Very low	54.5	Low	155 Å²	155	135 Å²	135	80%	0.795	74%	0.735	S	S	*	*			trans	-100	104.8	162.3	-58.2	176.8	0	0	0	105	A360	A360-I362 PolarHBondContact O-N 3.04Å
363	P	44.5	Very low	51.8	Low	113 Å²	113	133.9 Å²	133.9	73%	0.734	74%	0.742	S	S	*	*			trans	-67.6	141.1	170.5	26	-25	0	0	0	109.2	D361	D361-P363 WeakPolarHBondContact O-CD 3.35Å
364	N	43.5	Very low	49.2	Very low	241 Å²	241	135.3 Å²	135.3	100%	1.289	77%	0.767	S	S	*	*			trans	-34	0	-175.1	-72.5	-25	0	0	0	116.9

Retrieved 364 of 364 residues in 288.5 ms (Link to these results)

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