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Steroidogenic acute regulatory protein, mitochondrial

Plays a key role in steroid hormone synthesis by enhancing the metabolism of cholesterol into pregnenolone. Mediates the transfer of cholesterol from the outer mitochondrial membrane to the inner mitochondrial membrane where it is cleaved to pregnenolone (By similarity).

AlphaFold DB , UniProt , Accession Q9DEB4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene star, Length 287 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	35.7	Very low	41	Very low	239 Å²	239	127.9 Å²	127.9	100%	1.177	73%	0.728	S	S	*	*				0	104	0	-64.3	-178.7	82	0	0	107.7
2	L	37.4	Very low	41	Very low	177 Å²	177	128.2 Å²	128.2	93%	0.927	72%	0.723	S	S	*	*			trans	-74.1	126.5	178.8	-88	153.3	0	0	0	109.2
3	P	39.9	Very low	41.5	Very low	94 Å²	94	122.7 Å²	122.7	61%	0.61	70%	0.698	S	S	*	*			trans	-69.6	141	-170.6	-15.1	29.4	0	0	0	111.7	T5	P3-T5 PolarHBondContact O-N 2.71Å
4	A	48.8	Very low	41.7	Very low	82 Å²	82	125.9 Å²	125.9	68%	0.678	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	10.5	-173.5	0	0	0	0	0	116.5	F6 K7	A4-F6 PolarHBondContact O-N 2.8Å; A4-K7 PolarHBondContact O-N 2.72Å
5	T	43.2	Very low	41.7	Very low	106 Å²	106	132.1 Å²	132.1	65%	0.65	70%	0.704	S	S	*	*	H	α-helix	trans	-71.5	-26.6	-178.5	51.7	0	0	0	0	113.1	P3 K7	P3-T5 PolarHBondContact O-N 2.71Å; T5-K7 VanDerWaalsContact C-N 3.3Å; T5-K7 PolarHBondContact O-N 2.9Å
6	F	43	Very low	42.3	Very low	188 Å²	188	133.5 Å²	133.5	83%	0.825	71%	0.705	S	S	*	*	H	α-helix	trans	-70.6	-20.9	178.1	-112.6	-87	0	0	0	114.3	A4	A4-F6 PolarHBondContact O-N 2.8Å
7	K	43.5	Very low	42.6	Very low	179 Å²	179	129.9 Å²	129.9	78%	0.778	68%	0.684	S	S	*	*	H	α-helix	trans	-80.5	-23.8	-178.8	-72.7	-168.5	177.7	-176.1	0	113.7	A4 T5 G11	A4-K7 PolarHBondContact O-N 2.72Å; T5-K7 VanDerWaalsContact C-N 3.3Å; T5-K7 PolarHBondContact O-N 2.9Å; K7-G11 PolarHBondContact O-N 3.01Å
8	L	38.8	Very low	43.2	Very low	135 Å²	135	135.5 Å²	135.5	71%	0.707	70%	0.695	S	S	*	*	H	α-helix	trans	-76.6	-36.6	-177.3	-80.3	164.3	0	0	0	112.8	A10 G11	L8-A10 PolarHBondContact O-N 2.94Å; L8-G11 PolarHBondContact O-N 3.38Å
9	C	38.9	Very low	43.8	Very low	107 Å²	107	136.1 Å²	136.1	72%	0.723	70%	0.699	S	S	*	*	H	α-helix	trans	-70.4	-29.7	177.2	-93.4	0	0	0	0	113.5
10	A	41.4	Very low	44.4	Very low	48 Å²	48	132.7 Å²	132.7	40%	0.397	68%	0.681	S	S	.	*	H	α-helix	trans	-73.6	-33.4	176.4	0	0	0	0	0	112.4	L8 I12 S13 Y14	L8-A10 PolarHBondContact O-N 2.94Å; A10-I12 VanDerWaalsContact C-N 3.32Å; A10-I12 PolarHBondContact O-N 3.14Å; A10-S13 PolarHBondContact O-OG 3.37Å; A10-Y14 WeakPolarHBondContact O-CD2 3.39Å
11	G	40.2	Very low	44.6	Very low	52 Å²	52	132.2 Å²	132.2	54%	0.536	69%	0.685	S	S	.	*	H	α-helix	trans	-65.1	-32	-176.5	0	0	0	0	0	114.4	K7 L8	K7-G11 PolarHBondContact O-N 3.01Å; L8-G11 PolarHBondContact O-N 3.38Å
12	I	41.5	Very low	45.7	Very low	131 Å²	131	123.4 Å²	123.4	67%	0.672	66%	0.655	S	S	*	*	H	α-helix	trans	-80.3	-33.9	-175.5	-54.9	172.8	0	0	0	111.1	A10 Y14	A10-I12 VanDerWaalsContact C-N 3.32Å; A10-I12 PolarHBondContact O-N 3.14Å; I12-Y14 PolarHBondContact O-N 3.36Å
13	S	47.5	Very low	46.5	Very low	57 Å²	57	122.4 Å²	122.4	40%	0.399	65%	0.65	S	S	.	*	H	α-helix	trans	-71.4	-30.2	-178.5	56.3	0	0	0	0	113.2	A10 R15 H16 M17	A10-S13 PolarHBondContact O-OG 3.37Å; S13-R15 PolarHBondContact O-N 3.25Å; S13-H16 PolarHBondContact O-N 3.02Å; S13-M17 PolarHBondContact O-N 3.03Å
14	Y	44.4	Very low	47.4	Very low	168 Å²	168	126.4 Å²	126.4	66%	0.659	65%	0.653	S	S	*	*	H	α-helix	trans	-65.4	-34.6	179.8	-94.2	-89.7	0	0	0	113.9	A10 I12 M17	A10-Y14 WeakPolarHBondContact O-CD2 3.39Å; I12-Y14 PolarHBondContact O-N 3.36Å; Y14-M17 WeakPolarHBondContact O-CB 3.38Å; Y14-M17 PolarHBondContact O-N 3.03Å
15	R	41.2	Very low	47.9	Very low	219 Å²	219	129 Å²	129	83%	0.826	65%	0.649	S	S	*	*	H	α-helix	trans	-71.4	-34	-178.3	-156	178.6	-174.9	-168.8	1.9	112.1	S13 M17	S13-R15 PolarHBondContact O-N 3.25Å; R15-M17 VanDerWaalsContact C-N 3.31Å
16	H	51.9	Low	48.6	Very low	154 Å²	154	129.5 Å²	129.5	71%	0.713	65%	0.647	S	S	*	*	H	α-helix	trans	-72.6	-23.9	174.4	-92.7	56.4	0	0	0	113.1	S13 R18	S13-H16 PolarHBondContact O-N 3.02Å; H16-R18 PolarHBondContact O-N 2.91Å
17	M	47.6	Very low	49.4	Very low	72 Å²	72	123.1 Å²	123.1	36%	0.355	63%	0.629	S	S	.	*	H	α-helix	trans	-70.3	-29.7	-177.9	-154.1	164.3	-55.8	0	0	113.5	S13 Y14 R15 N19 M28	S13-M17 PolarHBondContact O-N 3.03Å; Y14-M17 WeakPolarHBondContact O-CB 3.38Å; Y14-M17 PolarHBondContact O-N 3.03Å; R15-M17 VanDerWaalsContact C-N 3.31Å; M17-N19 VanDerWaalsContact C-N 3.28Å; M17-N19 PolarHBondContact O-N 2.96Å; M17-M28 HydrophobicContact CE-CE 3.19Å; M17-M28 HydrophobicContact CE-SD 3.99Å; M17-M28 HydrophobicContact CG-CE 4.33Å; M17-M28 HydrophobicContact CG-SD 3.87Å; M17-M28 HydrophobicContact SD-CE 3.69Å; M17-M28 HydrophobicContact SD-SD 3.72Å
18	R	52.6	Low	50	Low	231 Å²	231	118.3 Å²	118.3	87%	0.872	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-17.7	-174.1	-137.2	178.5	-175.2	173.7	1	114.1	H16	H16-R18 PolarHBondContact O-N 2.91Å
19	N	55	Low	51.2	Low	146 Å²	146	116.1 Å²	116.1	78%	0.781	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	11.3	-176.7	-74.2	-0.1	0	0	0	114.2	M17	M17-N19 VanDerWaalsContact C-N 3.28Å; M17-N19 PolarHBondContact O-N 2.96Å
20	M	55.8	Low	52.1	Low	68 Å²	68	113.7 Å²	113.7	34%	0.335	59%	0.591	S	S	.	*			trans	-90.1	121.5	-179.1	-66.5	-126.9	-71.5	0	0	112.5	R24	M20-R24 HydrophobicContact CB-CB 4.37Å; M20-R24 HydrophobicContact CE-CB 3.72Å; M20-R24 HydrophobicContact SD-CB 3.7Å; M20-R24 WeakPolarHBondContact SD-CD 3.44Å; M20-R24 HydrophobicContact SD-CG 4.18Å
21	T	48.9	Very low	53	Low	124 Å²	124	116.5 Å²	116.5	76%	0.761	60%	0.598	S	S	*	*			trans	-100.8	152.4	179	49	0	0	0	0	113.4	L23 R24	T21-L23 PolarHBondContact O-N 3.09Å; T21-L23 VanDerWaalsContact O-N 3.08Å; T21-R24 PolarHBondContact O-N 3.3Å
22	G	58.4	Low	53.9	Low	54 Å²	54	119.1 Å²	119.1	56%	0.557	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.3	-99.6	162.5	0	0	0	0	0	116.3
23	L	53.9	Low	54.5	Low	156 Å²	156	118 Å²	118	82%	0.817	59%	0.587	S	S	*	*	H	α-helix	trans	-70.8	-37.2	-171.7	-85.9	139.1	0	0	0	113.6	T21 K25 N26 A27	T21-L23 PolarHBondContact O-N 3.09Å; T21-L23 VanDerWaalsContact O-N 3.08Å; L23-K25 VanDerWaalsContact C-N 3.32Å; L23-K25 PolarHBondContact O-N 3.21Å; L23-N26 PolarHBondContact O-N 2.89Å; L23-A27 PolarHBondContact O-N 3.34Å
24	R	58.9	Low	54.6	Low	178 Å²	178	121.2 Å²	121.2	67%	0.672	60%	0.596	S	S	*	*	H	α-helix	trans	-73.5	-26.2	-178.4	-66.7	-172.1	179.1	178.6	-1.6	112.7	M20 T21 M28	M20-R24 HydrophobicContact CB-CB 4.37Å; M20-R24 HydrophobicContact CE-CB 3.72Å; M20-R24 HydrophobicContact SD-CB 3.7Å; M20-R24 WeakPolarHBondContact SD-CD 3.44Å; M20-R24 HydrophobicContact SD-CG 4.18Å; T21-R24 PolarHBondContact O-N 3.3Å; R24-M28 WeakPolarHBondContact O-CB 3.03Å; R24-M28 PolarHBondContact O-N 3.07Å; R24-M28 VanDerWaalsContact O-N 3.16Å
25	K	59	Low	55	Low	135 Å²	135	117.9 Å²	117.9	59%	0.587	59%	0.589	S	S	*	*	H	α-helix	trans	-68.9	-41.9	175.1	-165.4	176.6	180	-177.4	0	111.2	L23 M28 V29	L23-K25 VanDerWaalsContact C-N 3.32Å; L23-K25 PolarHBondContact O-N 3.21Å; K25-M28 PolarHBondContact O-N 3.43Å; K25-V29 WeakPolarHBondContact O-CG2 3.44Å; K25-V29 PolarHBondContact O-N 3.36Å
26	N	58.4	Low	55.3	Low	117 Å²	117	111.6 Å²	111.6	63%	0.626	57%	0.572	S	S	*	*	H	α-helix	trans	-65.2	-43.8	177.7	-69.6	-6.5	0	0	0	112	L23 M28 V29 A30	L23-N26 PolarHBondContact O-N 2.89Å; N26-M28 VanDerWaalsContact C-N 3.25Å; N26-M28 PolarHBondContact O-N 3.23Å; N26-V29 PolarHBondContact O-N 2.8Å; N26-A30 PolarHBondContact O-N 2.78Å
27	A	60.8	Low	55.3	Low	54 Å²	54	110.6 Å²	110.6	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-59	-38.9	174.7	0	0	0	0	0	111.8	L23 A30 I31	L23-A27 PolarHBondContact O-N 3.34Å; A27-A30 PolarHBondContact O-N 2.84Å; A27-I31 WeakPolarHBondContact O-CD1 3.27Å; A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 3.4Å
28	M	54.4	Low	55.1	Low	78 Å²	78	112.5 Å²	112.5	38%	0.384	58%	0.58	S	S	.	*	H	α-helix	trans	-73.6	-37.2	178.8	-162.7	168.7	-151.1	0	0	113.4	M17 R24 K25 N26 A30 I31 H32	M17-M28 HydrophobicContact CE-CE 3.19Å; M17-M28 HydrophobicContact CE-SD 3.99Å; M17-M28 HydrophobicContact CG-CE 4.33Å; M17-M28 HydrophobicContact CG-SD 3.87Å; M17-M28 HydrophobicContact SD-CE 3.69Å; M17-M28 HydrophobicContact SD-SD 3.72Å; R24-M28 WeakPolarHBondContact O-CB 3.03Å; R24-M28 PolarHBondContact O-N 3.07Å; R24-M28 VanDerWaalsContact O-N 3.16Å; K25-M28 PolarHBondContact O-N 3.43Å; N26-M28 VanDerWaalsContact C-N 3.25Å; N26-M28 PolarHBondContact O-N 3.23Å; M28-A30 VanDerWaalsContact C-N 3.28Å; M28-A30 PolarHBondContact O-N 2.81Å; M28-I31 PolarHBondContact O-N 2.82Å; M28-H32 WeakPolarHBondContact O-CB 3.35Å; M28-H32 PolarHBondContact O-N 2.83Å
29	V	64.3	Low	54.7	Low	90 Å²	90	105 Å²	105	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-62.3	-39.9	171.5	171.8	0	0	0	0	110.1	K25 N26 H32 H33	K25-V29 WeakPolarHBondContact O-CG2 3.44Å; K25-V29 PolarHBondContact O-N 3.36Å; N26-V29 PolarHBondContact O-N 2.8Å; V29-H32 PolarHBondContact O-N 3.43Å; V29-H33 WeakPolarHBondContact O-CB 3.5Å; V29-H33 PolarHBondContact O-N 3.21Å
30	A	58.9	Low	54.1	Low	56 Å²	56	99.9 Å²	99.9	46%	0.463	55%	0.549	S	S	.	.	H	α-helix	trans	-63.2	-45.9	175	0	0	0	0	0	111.8	N26 A27 M28 H32 H33 E34	N26-A30 PolarHBondContact O-N 2.78Å; A27-A30 PolarHBondContact O-N 2.84Å; M28-A30 VanDerWaalsContact C-N 3.28Å; M28-A30 PolarHBondContact O-N 2.81Å; A30-H32 PolarHBondContact O-N 2.8Å; A30-H33 PolarHBondContact O-N 3.3Å; A30-E34 WeakPolarHBondContact O-CG 3.43Å; A30-E34 PolarHBondContact O-N 2.97Å
31	I	59.1	Low	54	Low	107 Å²	107	103.3 Å²	103.3	55%	0.549	58%	0.577	S	S	.	*	H	α-helix	trans	-63.3	-42	176.1	-67	162.5	0	0	0	111.2	A27 M28 E34 L35	A27-I31 WeakPolarHBondContact O-CD1 3.27Å; A27-I31 VanDerWaalsContact O-CG1 3.26Å; A27-I31 WeakPolarHBondContact O-CG1 3.39Å; A27-I31 PolarHBondContact O-N 3.4Å; M28-I31 PolarHBondContact O-N 2.82Å; I31-E34 PolarHBondContact O-N 3.23Å; I31-L35 HydrophobicContact CG2-CD1 4.04Å; I31-L35 HydrophobicContact CG2-CG 4.49Å; I31-L35 VanDerWaalsContact O-CG 3.3Å; I31-L35 WeakPolarHBondContact O-CG 3.5Å; I31-L35 PolarHBondContact O-N 3.02Å
32	H	59.2	Low	53.6	Low	106 Å²	106	102.4 Å²	102.4	49%	0.491	57%	0.567	S	S	.	*	H	α-helix	trans	-69	-36.6	178.6	-173.7	60.2	0	0	0	112.3	M28 V29 A30 L35 N36	M28-H32 WeakPolarHBondContact O-CB 3.35Å; M28-H32 PolarHBondContact O-N 2.83Å; V29-H32 PolarHBondContact O-N 3.43Å; A30-H32 PolarHBondContact O-N 2.8Å; H32-L35 PolarHBondContact O-N 2.97Å; H32-N36 PolarHBondContact CD2-ND2 2.83Å; H32-N36 PolarHBondContact CE1-ND2 2.62Å; H32-N36 PolarHBondContact NE2-ND2 2.81Å; H32-N36 WeakPolarHBondContact O-CB 3.44Å; H32-N36 PolarHBondContact O-N 3.38Å
33	H	55.3	Low	53.1	Low	107 Å²	107	104.4 Å²	104.4	50%	0.495	57%	0.57	S	S	.	*	H	α-helix	trans	-63.5	-43.3	173.8	-175.9	-88.4	0	0	0	111.1	V29 A30 N36 M37	V29-H33 WeakPolarHBondContact O-CB 3.5Å; V29-H33 PolarHBondContact O-N 3.21Å; A30-H33 PolarHBondContact O-N 3.3Å; H33-N36 PolarHBondContact O-N 3.33Å; H33-M37 WeakPolarHBondContact CE1-CE 3.26Å; H33-M37 WeakPolarHBondContact O-CG 3.22Å; H33-M37 PolarHBondContact O-N 3.48Å
34	E	49.1	Very low	52.8	Low	126 Å²	126	100.5 Å²	100.5	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-61	-42.8	171.9	-76.5	-65.3	154	0	0	112	A30 I31 N36 M37 L38	A30-E34 WeakPolarHBondContact O-CG 3.43Å; A30-E34 PolarHBondContact O-N 2.97Å; I31-E34 PolarHBondContact O-N 3.23Å; E34-N36 PolarHBondContact O-N 3.24Å; E34-M37 WeakPolarHBondContact O-CB 3.41Å; E34-M37 PolarHBondContact O-N 2.68Å; E34-L38 WeakPolarHBondContact O-CG 3.35Å; E34-L38 PolarHBondContact O-N 3.38Å
35	L	51.6	Low	52	Low	98 Å²	98	95.1 Å²	95.1	51%	0.513	55%	0.546	S	S	.	.	H	α-helix	trans	-67.5	-34.1	176.9	-70.4	170.8	0	0	0	113.3	I31 H32 L38 A39	I31-L35 HydrophobicContact CG2-CD1 4.04Å; I31-L35 HydrophobicContact CG2-CG 4.49Å; I31-L35 VanDerWaalsContact O-CG 3.3Å; I31-L35 WeakPolarHBondContact O-CG 3.5Å; I31-L35 PolarHBondContact O-N 3.02Å; H32-L35 PolarHBondContact O-N 2.97Å; L35-L38 HydrophobicContact CD2-CD1 4.17Å; L35-L38 CarbonylContact O-C 3.56Å; L35-L38 WeakPolarHBondContact O-CB 3.37Å; L35-L38 PolarHBondContact O-N 3.31Å; L35-A39 PolarHBondContact O-N 3.21Å; L35-A39 VanDerWaalsContact O-N 3.13Å
36	N	49.1	Very low	51.1	Low	87 Å²	87	95.3 Å²	95.3	47%	0.465	54%	0.543	S	S	.	.	H	α-helix	trans	-74.1	-31.6	175.5	-76.6	-18.5	0	0	0	112.3	H32 H33 E34 L38 A39	H32-N36 PolarHBondContact CD2-ND2 2.83Å; H32-N36 PolarHBondContact CE1-ND2 2.62Å; H32-N36 PolarHBondContact NE2-ND2 2.81Å; H32-N36 WeakPolarHBondContact O-CB 3.44Å; H32-N36 PolarHBondContact O-N 3.38Å; H33-N36 PolarHBondContact O-N 3.33Å; E34-N36 PolarHBondContact O-N 3.24Å; N36-L38 PolarHBondContact O-N 3.38Å; N36-A39 PolarHBondContact O-N 3.42Å; N36-A39 VanDerWaalsContact O-N 3.08Å
37	M	51	Low	50.6	Low	133 Å²	133	95.4 Å²	95.4	66%	0.655	54%	0.542	S	S	*	.	H	α-helix	trans	-59.5	-32.1	167.3	-72.2	-70.1	-169.1	0	0	111.3	H33 E34	H33-M37 WeakPolarHBondContact CE1-CE 3.26Å; H33-M37 WeakPolarHBondContact O-CG 3.22Å; H33-M37 PolarHBondContact O-N 3.48Å; E34-M37 WeakPolarHBondContact O-CB 3.41Å; E34-M37 PolarHBondContact O-N 2.68Å
38	L	43	Very low	49.7	Very low	111 Å²	111	96.3 Å²	96.3	58%	0.581	55%	0.546	S	S	*	.	H	α-helix	trans	-78.7	-18.3	175.1	-63	168.5	0	0	0	113.9	E34 L35 N36 G40	E34-L38 WeakPolarHBondContact O-CG 3.35Å; E34-L38 PolarHBondContact O-N 3.38Å; L35-L38 HydrophobicContact CD2-CD1 4.17Å; L35-L38 CarbonylContact O-C 3.56Å; L35-L38 WeakPolarHBondContact O-CB 3.37Å; L35-L38 PolarHBondContact O-N 3.31Å; N36-L38 PolarHBondContact O-N 3.38Å; L38-G40 VanDerWaalsContact C-N 3.33Å
39	A	44.7	Very low	49	Very low	75 Å²	75	98.6 Å²	98.6	62%	0.62	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	8.7	-178.7	0	0	0	0	0	114	L35 N36	L35-A39 PolarHBondContact O-N 3.21Å; L35-A39 VanDerWaalsContact O-N 3.13Å; N36-A39 PolarHBondContact O-N 3.42Å; N36-A39 VanDerWaalsContact O-N 3.08Å
40	G	42.4	Very low	48	Very low	37 Å²	37	98.3 Å²	98.3	38%	0.381	55%	0.553	S	S	.	*	S	Bend	trans	-60.3	149	170.8	0	0	0	0	0	112	L38 N42	L38-G40 VanDerWaalsContact C-N 3.33Å; G40-N42 PolarHBondContact O-N 2.9Å
41	P	53.6	Low	47	Very low	141 Å²	141	105.7 Å²	105.7	92%	0.916	57%	0.569	S	S	*	*	S	Bend	trans	-73.7	15.8	-159.6	29.7	-36.8	0	0	0	115.7
42	N	40.8	Very low	46.1	Very low	105 Å²	105	110.4 Å²	110.4	56%	0.561	58%	0.58	S	S	*	*			trans	-139.5	87.1	177.4	-156.8	-6.8	0	0	0	113	G40 S44	G40-N42 PolarHBondContact O-N 2.9Å; N42-S44 PolarHBondContact O-N 3Å; N42-S44 PolarHBondContact OD1-OG 3.26Å
43	P	48.4	Very low	45	Very low	95 Å²	95	116.2 Å²	116.2	62%	0.617	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	9.4	176.7	-19.4	32.2	0	0	0	115.2	W46	P43-W46 PolarHBondContact O-NE1 3.46Å
44	S	46.3	Very low	44.3	Very low	74 Å²	74	114.9 Å²	114.9	52%	0.517	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.3	-19.1	179.5	65.2	0	0	0	0	113.8	N42	N42-S44 PolarHBondContact O-N 3Å; N42-S44 PolarHBondContact OD1-OG 3.26Å
45	S	42.1	Very low	44	Very low	66 Å²	66	111.5 Å²	111.5	46%	0.462	59%	0.591	S	S	.	*	H	α-helix	trans	-81.2	-27.7	-179.1	73.4	0	0	0	0	113.6	I47 S48 H49	S45-I47 VanDerWaalsContact C-N 3.34Å; S45-I47 PolarHBondContact O-N 2.92Å; S45-S48 PolarHBondContact O-N 2.81Å; S45-S48 PolarHBondContact O-OG 2.87Å; S45-H49 PolarHBondContact O-CD2 3.1Å; S45-H49 VanDerWaalsContact O-CD2 3.3Å; S45-H49 PolarHBondContact O-N 3.05Å
46	W	41	Very low	43.5	Very low	138 Å²	138	113.4 Å²	113.4	52%	0.523	60%	0.6	S	S	.	*	H	α-helix	trans	-69.9	-28	179.8	79	-49.7	0	0	0	113.3	P43 S48 H49 V50	P43-W46 PolarHBondContact O-NE1 3.46Å; W46-S48 PolarHBondContact O-N 3.48Å; W46-H49 PolarHBondContact O-N 3.19Å; W46-H49 VanDerWaalsContact O-N 3.15Å; W46-V50 HydrophobicContact CE3-CG2 4.09Å; W46-V50 WeakPolarHBondContact O-CB 3.46Å; W46-V50 WeakPolarHBondContact O-CG2 3.14Å; W46-V50 PolarHBondContact O-N 3.01Å
47	I	46.3	Very low	43.1	Very low	119 Å²	119	116.7 Å²	116.7	61%	0.61	62%	0.617	S	S	*	*	H	α-helix	trans	-62.7	-33	177	-66.7	173.7	0	0	0	110.4	S45 R51	S45-I47 VanDerWaalsContact C-N 3.34Å; S45-I47 PolarHBondContact O-N 2.92Å; I47-R51 WeakPolarHBondContact O-CB 3.36Å; I47-R51 PolarHBondContact O-N 3.01Å
48	S	43.1	Very low	42.8	Very low	74 Å²	74	113.5 Å²	113.5	52%	0.517	61%	0.608	S	S	.	*	H	α-helix	trans	-80.1	-31	175.5	66.8	0	0	0	0	112.9	S45 W46	S45-S48 PolarHBondContact O-N 2.81Å; S45-S48 PolarHBondContact O-OG 2.87Å; W46-S48 PolarHBondContact O-N 3.48Å
49	H	40	Very low	42.6	Very low	126 Å²	126	110.3 Å²	110.3	58%	0.583	60%	0.595	S	S	*	*	H	α-helix	trans	-79.3	-37	178.5	-78.5	-69.7	0	0	0	114	S45 W46 R51 R52 R53	S45-H49 PolarHBondContact O-CD2 3.1Å; S45-H49 VanDerWaalsContact O-CD2 3.3Å; S45-H49 PolarHBondContact O-N 3.05Å; W46-H49 PolarHBondContact O-N 3.19Å; W46-H49 VanDerWaalsContact O-N 3.15Å; H49-R51 VanDerWaalsContact C-N 3.3Å; H49-R52 PolarHBondContact O-N 3.18Å; H49-R52 VanDerWaalsContact O-N 3.11Å; H49-R53 PolarHBondContact O-N 3.34Å
50	V	42.2	Very low	42.6	Very low	84 Å²	84	115.8 Å²	115.8	51%	0.509	60%	0.6	S	S	.	*	H	α-helix	trans	-66.1	-37.2	174.9	174.5	0	0	0	0	110.1	W46 R52 R53 S54	W46-V50 HydrophobicContact CE3-CG2 4.09Å; W46-V50 WeakPolarHBondContact O-CB 3.46Å; W46-V50 WeakPolarHBondContact O-CG2 3.14Å; W46-V50 PolarHBondContact O-N 3.01Å; V50-R52 PolarHBondContact O-N 3.07Å; V50-R53 PolarHBondContact O-N 3.43Å; V50-S54 PolarHBondContact O-N 3.06Å; V50-S54 PolarHBondContact O-OG 3.23Å
51	R	39.1	Very low	43	Very low	210 Å²	210	116 Å²	116	79%	0.792	59%	0.592	S	S	*	*	H	α-helix	trans	-61.6	-25	173.4	-159.4	175.5	-152.2	168	7	113.2	I47 H49	I47-R51 WeakPolarHBondContact O-CB 3.36Å; I47-R51 PolarHBondContact O-N 3.01Å; H49-R51 VanDerWaalsContact C-N 3.3Å
52	R	38.7	Very low	42.7	Very low	207 Å²	207	115.4 Å²	115.4	78%	0.781	58%	0.577	S	S	*	*	H	α-helix	trans	-93.5	-17	-175.5	-137.6	-179.9	-167.8	-172.8	3.5	114.7	H49 V50	H49-R52 PolarHBondContact O-N 3.18Å; H49-R52 VanDerWaalsContact O-N 3.11Å; V50-R52 PolarHBondContact O-N 3.07Å
53	R	36.4	Very low	43.2	Very low	228 Å²	228	118.6 Å²	118.6	86%	0.86	59%	0.588	S	S	*	*	H	α-helix	trans	-105	-18.3	-179.4	-78	-176	82	-179.5	6.4	115	H49 V50 S55	H49-R53 PolarHBondContact O-N 3.34Å; V50-R53 PolarHBondContact O-N 3.43Å; R53-S55 VanDerWaalsContact C-N 3.31Å
54	S	41.5	Very low	43.4	Very low	79 Å²	79	121.7 Å²	121.7	55%	0.552	59%	0.594	S	S	*	*	S	Bend	trans	-83.1	-5.5	173.5	56.7	0	0	0	0	114	V50 L56	V50-S54 PolarHBondContact O-N 3.06Å; V50-S54 PolarHBondContact O-OG 3.23Å; S54-L56 PolarHBondContact O-N 3.29Å
55	S	42.3	Very low	44.2	Very low	55 Å²	55	123.5 Å²	123.5	39%	0.385	60%	0.595	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.5	7.9	-173.5	70.5	0	0	0	0	115.8	R53 S59	R53-S55 VanDerWaalsContact C-N 3.31Å; S55-S59 WeakPolarHBondContact O-CB 3.09Å; S55-S59 PolarHBondContact O-OG 3.42Å
56	L	41	Very low	46.2	Very low	137 Å²	137	123.7 Å²	123.7	72%	0.717	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-20.2	178.6	-68.9	177.1	0	0	0	114.5	S54	S54-L56 PolarHBondContact O-N 3.29Å
57	L	41.4	Very low	48.6	Very low	156 Å²	156	119.6 Å²	119.6	82%	0.817	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-31.9	175	-90.8	149.3	0	0	0	112.3
58	S	43.9	Very low	50.8	Low	67 Å²	67	117.9 Å²	117.9	47%	0.469	58%	0.584	S	S	.	*	S	Bend	trans	-76.6	-32.5	178.4	-156.8	0	0	0	0	113	R60	S58-R60 PolarHBondContact O-N 3.03Å
59	S	38.5	Very low	53.3	Low	43 Å²	43	122.7 Å²	122.7	30%	0.301	60%	0.598	S	S	.	*	H	α-helix	trans	-72.4	-28.1	-175.2	64.8	0	0	0	0	113.8	S55 I61 E62	S55-S59 WeakPolarHBondContact O-CB 3.09Å; S55-S59 PolarHBondContact O-OG 3.42Å; S59-I61 VanDerWaalsContact C-N 3.26Å; S59-I61 PolarHBondContact O-N 3.2Å; S59-E62 PolarHBondContact O-N 2.9Å
60	R	44.7	Very low	55.9	Low	191 Å²	191	119.1 Å²	119.1	72%	0.721	59%	0.59	S	S	*	*	H	α-helix	trans	-67.5	-25.5	-179.6	-78.4	-171.7	178.6	-173.7	-1.5	113.4	S58	S58-R60 PolarHBondContact O-N 3.03Å
61	I	51.6	Low	58.5	Low	42 Å²	42	116.9 Å²	116.9	22%	0.215	57%	0.574	C	S	.	*	H	α-helix	trans	-79.9	-35.1	179.3	-58.9	175.8	0	0	0	110.9	S59 Y67 V72	S59-I61 VanDerWaalsContact C-N 3.26Å; S59-I61 PolarHBondContact O-N 3.2Å; I61-Y67 HydrophobicContact CG2-CD2 4.36Å; I61-V72 HydrophobicContact CG2-CG1 4.19Å; I61-V72 HydrophobicContact CG2-CG2 4.22Å
62	E	48	Very low	61.3	Low	128 Å²	128	108.2 Å²	108.2	60%	0.598	55%	0.545	S	S	*	.	H	α-helix	trans	-68.2	-34.5	-178.1	-72.2	177.6	-178.9	0	0	112.6	S59	S59-E62 PolarHBondContact O-N 2.9Å
63	E	49.5	Very low	64.1	Low	171 Å²	171	101.7 Å²	101.7	80%	0.799	53%	0.531	S	S	*	.	H	α-helix	trans	-87.1	-29.5	-174.5	-75.3	-178.7	171.4	0	0	114.9
64	E	52.9	Low	67	Low	161 Å²	161	91.7 Å²	91.7	75%	0.752	49%	0.493	S	S	*	.	H	α-helix	trans	-79.1	-26.4	-168	-86.2	-174.5	173.8	0	0	115
65	Q	62.9	Low	69.7	Low	112 Å²	112	88.6 Å²	88.6	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-142.1	8.8	-174.8	-63.9	-167.1	12.6	0	0	117.4	Y67	Q65-Y67 VanDerWaalsContact C-N 3.27Å; Q65-Y67 HydrophobicContact CB-CD1 4.16Å; Q65-Y67 HydrophobicContact CB-CD2 4.31Å; Q65-Y67 HydrophobicContact CB-CE1 3.73Å; Q65-Y67 HydrophobicContact CB-CE2 3.91Å; Q65-Y67 HydrophobicContact CB-CG 4.44Å; Q65-Y67 PolarHBondContact O-N 2.78Å; Q65-Y67 PolarHBondContact OE1-OH 2.82Å
66	G	84.5	Confident	72.4	Confident	70 Å²	70	92.5 Å²	92.5	72%	0.722	48%	0.481	S	S	*	.			trans	64.7	28.4	173.6	0	0	0	0	0	114.7
67	Y	90.9	Very high	75.1	Confident	51 Å²	51	87.9 Å²	87.9	20%	0.2	46%	0.456	C	S	.	.			trans	-66.5	145.1	179.2	-64.8	-35.2	0	0	0	112.7	I61 Q65 E71 V75 I159 G160	I61-Y67 HydrophobicContact CG2-CD2 4.36Å; Q65-Y67 VanDerWaalsContact C-N 3.27Å; Q65-Y67 HydrophobicContact CB-CD1 4.16Å; Q65-Y67 HydrophobicContact CB-CD2 4.31Å; Q65-Y67 HydrophobicContact CB-CE1 3.73Å; Q65-Y67 HydrophobicContact CB-CE2 3.91Å; Q65-Y67 HydrophobicContact CB-CG 4.44Å; Q65-Y67 PolarHBondContact O-N 2.78Å; Q65-Y67 PolarHBondContact OE1-OH 2.82Å; Y67-E71 WeakPolarHBondContact CA-OE2 3.3Å; Y67-E71 HydrophobicContact CD1-CB 4.37Å; Y67-E71 HydrophobicContact CG-CB 4.18Å; Y67-V75 HydrophobicContact CE2-CG2 4.22Å; Y67-I159 HydrophobicContact CD1-CG2 4.01Å; Y67-I159 HydrophobicContact CD2-CG2 4.44Å; Y67-I159 HydrophobicContact CE1-CG2 3.69Å; Y67-I159 HydrophobicContact CE2-CG2 4.16Å; Y67-I159 HydrophobicContact CG-CG2 4.36Å; Y67-G160 WeakPolarHBondContact OH-CA 3.42Å; Y67-G160 PolarHBondContact OH-N 3.28Å
68	N	94	Very high	77.8	Confident	83 Å²	83	80.5 Å²	80.5	44%	0.444	42%	0.417	S	S	.	.			trans	-77.3	168.8	169.4	69.3	59.7	0	0	0	111.8	A70 E71 V72	N68-A70 VanDerWaalsContact C-N 3.27Å; N68-A70 PolarHBondContact O-N 2.83Å; N68-A70 WeakPolarHBondContact OD1-CB 3.45Å; N68-A70 PolarHBondContact OD1-N 3.11Å; N68-E71 PolarHBondContact N-OE2 3.4Å; N68-E71 PolarHBondContact ND2-OE2 2.75Å; N68-E71 WeakPolarHBondContact O-CB 3.47Å; N68-E71 PolarHBondContact O-N 2.9Å; N68-E71 VanDerWaalsContact O-N 3.09Å; N68-E71 PolarHBondContact OD1-N 3.1Å; N68-V72 WeakPolarHBondContact O-CG2 3.38Å; N68-V72 PolarHBondContact O-N 2.84Å
69	E	94.8	Very high	80.4	Confident	176 Å²	176	80.4 Å²	80.4	82%	0.822	41%	0.409	S	S	*	.	H	α-helix	trans	-56.5	-37.3	-176.3	-173.1	177.6	-176.4	0	0	113.6	S73	E69-S73 WeakPolarHBondContact O-CB 3.33Å; E69-S73 PolarHBondContact O-N 3Å
70	A	95.1	Very high	83.2	Confident	50 Å²	50	82.3 Å²	82.3	41%	0.413	41%	0.413	S	S	.	.	H	α-helix	trans	-69.4	-40.9	178	0	0	0	0	0	111.6	N68 S73 Y74	N68-A70 VanDerWaalsContact C-N 3.27Å; N68-A70 PolarHBondContact O-N 2.83Å; N68-A70 WeakPolarHBondContact OD1-CB 3.45Å; N68-A70 PolarHBondContact OD1-N 3.11Å; A70-S73 WeakPolarHBondContact O-CB 3.33Å; A70-S73 PolarHBondContact O-N 2.93Å; A70-Y74 HydrophobicContact CB-CE2 4.47Å; A70-Y74 WeakPolarHBondContact O-CD2 3.22Å; A70-Y74 PolarHBondContact O-N 2.77Å
71	E	96.8	Very high	85.8	Confident	38 Å²	38	73.2 Å²	73.2	18%	0.178	38%	0.379	C	S	.	.	H	α-helix	trans	-63.2	-44.4	175.4	-72.4	174.5	148.6	0	0	112	Y67 N68 S73 Y74 V75 Q157 I159	Y67-E71 WeakPolarHBondContact CA-OE2 3.3Å; Y67-E71 HydrophobicContact CD1-CB 4.37Å; Y67-E71 HydrophobicContact CG-CB 4.18Å; N68-E71 PolarHBondContact N-OE2 3.4Å; N68-E71 PolarHBondContact ND2-OE2 2.75Å; N68-E71 WeakPolarHBondContact O-CB 3.47Å; N68-E71 PolarHBondContact O-N 2.9Å; N68-E71 VanDerWaalsContact O-N 3.09Å; N68-E71 PolarHBondContact OD1-N 3.1Å; E71-S73 VanDerWaalsContact C-N 3.27Å; E71-S73 PolarHBondContact O-N 2.68Å; E71-Y74 PolarHBondContact O-N 2.97Å; E71-V75 WeakPolarHBondContact O-CG2 3.36Å; E71-V75 PolarHBondContact O-N 2.96Å; E71-Q157 PolarHBondContact OE1-NE2 3.2Å; E71-I159 HydrophobicContact CB-CG1 4.34Å; E71-I159 HydrophobicContact CB-CG2 3.84Å; E71-I159 HydrophobicContact CG-CG1 3.97Å; E71-I159 HydrophobicContact CG-CG2 4.16Å
72	V	96.8	Very high	88	Confident	28 Å²	28	71.6 Å²	71.6	17%	0.17	37%	0.371	C	S	.	.	H	α-helix	trans	-59	-41.2	173.7	175	0	0	0	0	110.9	I61 N68 V75 K76	I61-V72 HydrophobicContact CG2-CG1 4.19Å; I61-V72 HydrophobicContact CG2-CG2 4.22Å; N68-V72 WeakPolarHBondContact O-CG2 3.38Å; N68-V72 PolarHBondContact O-N 2.84Å; V72-V75 PolarHBondContact O-N 2.98Å; V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 3.41Å
73	S	97.5	Very high	90.4	Very high	70 Å²	70	71.5 Å²	71.5	49%	0.49	37%	0.37	S	S	.	.	H	α-helix	trans	-62.1	-45.6	176.4	-172.2	0	0	0	0	112.1	E69 A70 E71 K76 Q77	E69-S73 WeakPolarHBondContact O-CB 3.33Å; E69-S73 PolarHBondContact O-N 3Å; A70-S73 WeakPolarHBondContact O-CB 3.33Å; A70-S73 PolarHBondContact O-N 2.93Å; E71-S73 VanDerWaalsContact C-N 3.27Å; E71-S73 PolarHBondContact O-N 2.68Å; S73-K76 PolarHBondContact O-N 3.02Å; S73-Q77 WeakPolarHBondContact O-CB 3.22Å; S73-Q77 PolarHBondContact O-N 3.45Å
74	Y	98.3	Very high	92.7	Very high	18 Å²	18	67.9 Å²	67.9	7%	0.071	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-45.4	176.4	-68.3	-50.2	0	0	0	112.2	A70 E71 K76 Q77 G78 I159 V165 V186 T203 Q204	A70-Y74 HydrophobicContact CB-CE2 4.47Å; A70-Y74 WeakPolarHBondContact O-CD2 3.22Å; A70-Y74 PolarHBondContact O-N 2.77Å; E71-Y74 PolarHBondContact O-N 2.97Å; Y74-K76 VanDerWaalsContact C-N 3.35Å; Y74-K76 PolarHBondContact O-N 2.86Å; Y74-Q77 PolarHBondContact O-N 3.23Å; Y74-G78 PolarHBondContact O-N 3.44Å; Y74-I159 HydrophobicContact CD2-CD1 4.17Å; Y74-V165 HydrophobicContact CD1-CG2 3.76Å; Y74-V165 HydrophobicContact CD2-CG2 3.9Å; Y74-V165 HydrophobicContact CE1-CG2 3.88Å; Y74-V165 HydrophobicContact CE2-CG2 4.01Å; Y74-V165 HydrophobicContact CG-CG2 3.79Å; Y74-V186 HydrophobicContact CD1-CB 4.48Å; Y74-V186 HydrophobicContact CD1-CG2 4.46Å; Y74-V186 WeakPolarHBondContact O-CG2 3.49Å; Y74-T203 HydrophobicContact CD1-CG2 4.28Å; Y74-T203 HydrophobicContact CE1-CG2 3.9Å; Y74-T203 WeakPolarHBondContact CE1-OG1 3.5Å; Y74-Q204 WeakPolarHBondContact CE1-O 3.39Å; Y74-Q204 PolarHBondContact OH-O 3.32Å
75	V	98.1	Very high	94.9	Very high	13 Å²	13	60.2 Å²	60.2	8%	0.079	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-49.9	177.8	172.5	0	0	0	0	110.2	Y67 E71 V72 Q77 G78 E79 I159 T163	Y67-V75 HydrophobicContact CE2-CG2 4.22Å; E71-V75 WeakPolarHBondContact O-CG2 3.36Å; E71-V75 PolarHBondContact O-N 2.96Å; V72-V75 PolarHBondContact O-N 2.98Å; V75-Q77 VanDerWaalsContact C-N 3.33Å; V75-Q77 PolarHBondContact O-N 3.38Å; V75-G78 PolarHBondContact O-N 3.36Å; V75-E79 WeakPolarHBondContact O-CG 3.47Å; V75-E79 PolarHBondContact O-N 2.91Å; V75-I159 HydrophobicContact CG2-CB 4.44Å; V75-I159 HydrophobicContact CG2-CG2 3.68Å; V75-T163 HydrophobicContact CG2-CG2 4.23Å
76	K	98.1	Very high	96.5	Very high	137 Å²	137	57.9 Å²	57.9	60%	0.596	31%	0.306	S	S	*	.	H	α-helix	trans	-59.8	-42.6	178.1	-176.8	-179.1	176.9	-176	0	112.2	V72 S73 Y74 E79 E80	V72-K76 WeakPolarHBondContact O-CB 3.43Å; V72-K76 PolarHBondContact O-N 3.41Å; S73-K76 PolarHBondContact O-N 3.02Å; Y74-K76 VanDerWaalsContact C-N 3.35Å; Y74-K76 PolarHBondContact O-N 2.86Å; K76-E79 PolarHBondContact O-N 3.11Å; K76-E80 WeakPolarHBondContact O-CB 3.5Å; K76-E80 PolarHBondContact O-N 3.48Å
77	Q	98.4	Very high	97.1	Very high	41 Å²	41	58.6 Å²	58.6	19%	0.192	30%	0.301	C	S	.	.	H	α-helix	trans	-66.4	-40.4	179.3	-169.9	-176	28.9	0	0	112	S73 Y74 V75 E80 A81 V186 M201 S202 T203	S73-Q77 WeakPolarHBondContact O-CB 3.22Å; S73-Q77 PolarHBondContact O-N 3.45Å; Y74-Q77 PolarHBondContact O-N 3.23Å; V75-Q77 VanDerWaalsContact C-N 3.33Å; V75-Q77 PolarHBondContact O-N 3.38Å; Q77-E80 PolarHBondContact O-N 3.24Å; Q77-A81 PolarHBondContact O-N 3.32Å; Q77-V186 HydrophobicContact CB-CG1 4.03Å; Q77-V186 HydrophobicContact CG-CG1 3.73Å; Q77-M201 HydrophobicContact CG-CG 3.85Å; Q77-M201 HydrophobicContact CG-SD 3.63Å; Q77-S202 PolarHBondContact NE2-O 3.24Å; Q77-T203 PolarHBondContact OE1-OG1 3.36Å
78	G	98.3	Very high	97.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-41.9	174.5	0	0	0	0	0	112.5	Y74 V75 A81 L82 C188	Y74-G78 PolarHBondContact O-N 3.44Å; V75-G78 PolarHBondContact O-N 3.36Å; G78-A81 WeakPolarHBondContact O-CB 3.38Å; G78-A81 PolarHBondContact O-N 2.88Å; G78-L82 PolarHBondContact O-N 3.19Å; G78-L82 VanDerWaalsContact O-N 3.07Å; G78-C188 WeakPolarHBondContact O-CB 3.26Å
79	E	98.1	Very high	97.7	Very high	66 Å²	66	54.2 Å²	54.2	31%	0.308	28%	0.28	S	S	.	.	H	α-helix	trans	-66.2	-41.3	174.5	-70.4	-172.9	160.2	0	0	112.6	V75 K76 A81 L82 Q83 K190	V75-E79 WeakPolarHBondContact O-CG 3.47Å; V75-E79 PolarHBondContact O-N 2.91Å; K76-E79 PolarHBondContact O-N 3.11Å; E79-A81 VanDerWaalsContact C-N 3.29Å; E79-A81 PolarHBondContact O-N 2.71Å; E79-L82 WeakPolarHBondContact O-CB 3.17Å; E79-L82 PolarHBondContact O-N 3.37Å; E79-Q83 WeakPolarHBondContact O-CG 3.31Å; E79-Q83 PolarHBondContact O-N 3.45Å; E79-K190 IonicContact OE1-NZ 3.91Å; E79-K190 PolarHBondContact OE1-NZ 3.22Å
80	E	98.2	Very high	97.7	Very high	82 Å²	82	48.3 Å²	48.3	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-60	-41.8	174.8	-174.8	-178.1	163.6	0	0	111.3	K76 Q77 Q83 K84 M201	K76-E80 WeakPolarHBondContact O-CB 3.5Å; K76-E80 PolarHBondContact O-N 3.48Å; Q77-E80 PolarHBondContact O-N 3.24Å; E80-Q83 PolarHBondContact O-N 2.89Å; E80-K84 HydrophobicContact CG-CD 4.09Å; E80-K84 HydrophobicContact CG-CG 4.48Å; E80-K84 WeakPolarHBondContact O-CB 3.39Å; E80-K84 WeakPolarHBondContact O-CG 3.38Å; E80-K84 PolarHBondContact O-N 3.12Å; E80-K84 WeakPolarHBondContact OE1-CE 3.23Å; E80-K84 IonicContact OE1-NZ 3.29Å; E80-K84 PolarHBondContact OE1-NZ 3.41Å; E80-M201 HydrophobicContact CB-CE 4.46Å; E80-M201 HydrophobicContact CG-CE 4.35Å
81	A	98.4	Very high	97.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-48.5	175.1	0	0	0	0	0	110.8	Q77 G78 E79 Q83 K84 S85 G200 M201	Q77-A81 PolarHBondContact O-N 3.32Å; G78-A81 WeakPolarHBondContact O-CB 3.38Å; G78-A81 PolarHBondContact O-N 2.88Å; E79-A81 VanDerWaalsContact C-N 3.29Å; E79-A81 PolarHBondContact O-N 2.71Å; A81-Q83 PolarHBondContact O-N 3.41Å; A81-K84 PolarHBondContact O-N 3.04Å; A81-S85 WeakPolarHBondContact O-CB 3.46Å; A81-S85 PolarHBondContact O-N 2.9Å; A81-S85 PolarHBondContact O-OG 3.15Å; A81-G200 WeakPolarHBondContact CB-O 3.38Å; A81-M201 HydrophobicContact CB-CB 4.2Å; A81-M201 HydrophobicContact CB-CE 3.49Å; A81-M201 VanDerWaalsContact CB-CE 3.49Å; A81-M201 HydrophobicContact CB-CG 4.05Å
82	L	98.5	Very high	97.5	Very high	9 Å²	9	53.5 Å²	53.5	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-57.5	-48.6	178.1	-178.8	62.7	0	0	0	111.9	G78 E79 S85 I86 K190 F197 A199	G78-L82 PolarHBondContact O-N 3.19Å; G78-L82 VanDerWaalsContact O-N 3.07Å; E79-L82 WeakPolarHBondContact O-CB 3.17Å; E79-L82 PolarHBondContact O-N 3.37Å; L82-S85 PolarHBondContact O-N 2.98Å; L82-I86 HydrophobicContact CD1-CD1 3.66Å; L82-I86 HydrophobicContact CD1-CG1 4.15Å; L82-I86 HydrophobicContact CG-CD1 3.86Å; L82-I86 WeakPolarHBondContact O-CB 3.46Å; L82-I86 VanDerWaalsContact O-CG1 3.29Å; L82-I86 WeakPolarHBondContact O-CG1 3.22Å; L82-I86 PolarHBondContact O-N 3.36Å; L82-K190 HydrophobicContact CD2-CB 4.07Å; L82-K190 HydrophobicContact CD2-CD 3.75Å; L82-K190 HydrophobicContact CD2-CG 3.91Å; L82-F197 HydrophobicContact CD1-CB 3.69Å; L82-F197 HydrophobicContact CD1-CD1 4.02Å; L82-F197 HydrophobicContact CD1-CG 3.97Å; L82-A199 VanDerWaalsContact CA-CB 3.47Å; L82-A199 HydrophobicContact CB-CB 3.72Å; L82-A199 HydrophobicContact CD1-CB 3.73Å; L82-A199 HydrophobicContact CG-CB 4.34Å
83	Q	98.2	Very high	97.4	Very high	125 Å²	125	58.1 Å²	58.1	58%	0.584	31%	0.309	S	S	*	.	H	α-helix	trans	-65	-45.4	-179.2	-65.8	-54.8	-36.6	0	0	112.1	E79 E80 A81 I86 S87	E79-Q83 WeakPolarHBondContact O-CG 3.31Å; E79-Q83 PolarHBondContact O-N 3.45Å; E80-Q83 PolarHBondContact O-N 2.89Å; A81-Q83 PolarHBondContact O-N 3.41Å; Q83-I86 PolarHBondContact O-N 2.92Å; Q83-S87 WeakPolarHBondContact O-CB 3.12Å; Q83-S87 PolarHBondContact O-N 3.02Å
84	K	98.1	Very high	97.3	Very high	95 Å²	95	57.6 Å²	57.6	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-60.2	-47.2	176.7	-77.5	178.5	170.8	174.1	0	111.1	E80 A81 S87 I88 M201 P221	E80-K84 HydrophobicContact CG-CD 4.09Å; E80-K84 HydrophobicContact CG-CG 4.48Å; E80-K84 WeakPolarHBondContact O-CB 3.39Å; E80-K84 WeakPolarHBondContact O-CG 3.38Å; E80-K84 PolarHBondContact O-N 3.12Å; E80-K84 WeakPolarHBondContact OE1-CE 3.23Å; E80-K84 IonicContact OE1-NZ 3.29Å; E80-K84 PolarHBondContact OE1-NZ 3.41Å; A81-K84 PolarHBondContact O-N 3.04Å; K84-S87 WeakPolarHBondContact O-CB 3.33Å; K84-S87 PolarHBondContact O-N 3.16Å; K84-I88 VanDerWaalsContact O-CG1 3.3Å; K84-I88 WeakPolarHBondContact O-CG1 3.42Å; K84-I88 PolarHBondContact O-N 3.42Å; K84-M201 HydrophobicContact CD-CE 4.46Å; K84-P221 HydrophobicContact CB-CB 4.1Å
85	S	98.5	Very high	97.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-66.1	-41.4	-179.7	-63.3	0	0	0	0	113	A81 L82 S87 I88 L89 T222	A81-S85 WeakPolarHBondContact O-CB 3.46Å; A81-S85 PolarHBondContact O-N 2.9Å; A81-S85 PolarHBondContact O-OG 3.15Å; L82-S85 PolarHBondContact O-N 2.98Å; S85-S87 VanDerWaalsContact C-N 3.32Å; S85-S87 PolarHBondContact O-N 2.81Å; S85-I88 PolarHBondContact O-N 3.5Å; S85-L89 WeakPolarHBondContact O-CB 3.42Å; S85-L89 WeakPolarHBondContact O-CG 3.22Å; S85-L89 PolarHBondContact O-N 3.18Å; S85-T222 PolarHBondContact OG-N 3.42Å; S85-T222 PolarHBondContact OG-O 2.83Å
86	I	97.7	Very high	97.2	Very high	63 Å²	63	61.9 Å²	61.9	32%	0.323	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-40.4	175.3	-71.6	172.6	0	0	0	110.8	L82 Q83 L89 G90 F197	L82-I86 HydrophobicContact CD1-CD1 3.66Å; L82-I86 HydrophobicContact CD1-CG1 4.15Å; L82-I86 HydrophobicContact CG-CD1 3.86Å; L82-I86 WeakPolarHBondContact O-CB 3.46Å; L82-I86 VanDerWaalsContact O-CG1 3.29Å; L82-I86 WeakPolarHBondContact O-CG1 3.22Å; L82-I86 PolarHBondContact O-N 3.36Å; Q83-I86 PolarHBondContact O-N 2.92Å; I86-L89 PolarHBondContact O-N 3.35Å; I86-G90 PolarHBondContact O-N 2.91Å; I86-F197 HydrophobicContact CD1-CD1 4.1Å; I86-F197 HydrophobicContact CD1-CE1 3.88Å; I86-F197 HydrophobicContact CD1-CZ 4.42Å; I86-F197 HydrophobicContact CG1-CD1 4.38Å; I86-F197 HydrophobicContact CG1-CE1 4.18Å
87	S	97.4	Very high	97.2	Very high	86 Å²	86	58.8 Å²	58.8	60%	0.601	33%	0.331	S	S	*	.	H	α-helix	trans	-59.1	-47.5	175.4	-176.6	0	0	0	0	111.6	Q83 K84 S85 L89 G90 D91	Q83-S87 WeakPolarHBondContact O-CB 3.12Å; Q83-S87 PolarHBondContact O-N 3.02Å; K84-S87 WeakPolarHBondContact O-CB 3.33Å; K84-S87 PolarHBondContact O-N 3.16Å; S85-S87 VanDerWaalsContact C-N 3.32Å; S85-S87 PolarHBondContact O-N 2.81Å; S87-L89 PolarHBondContact O-N 3.15Å; S87-G90 PolarHBondContact O-N 2.99Å; S87-D91 PolarHBondContact O-N 3.25Å
88	I	98	Very high	97.2	Very high	19 Å²	19	60.4 Å²	60.4	10%	0.097	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-45.8	177.2	-66.6	165.1	0	0	0	111.5	K84 S85 G90 D91 W95 L112 V118 P221 L241	K84-I88 VanDerWaalsContact O-CG1 3.3Å; K84-I88 WeakPolarHBondContact O-CG1 3.42Å; K84-I88 PolarHBondContact O-N 3.42Å; S85-I88 PolarHBondContact O-N 3.5Å; I88-G90 VanDerWaalsContact C-N 3.29Å; I88-G90 PolarHBondContact O-N 3.01Å; I88-D91 PolarHBondContact O-N 3.06Å; I88-W95 HydrophobicContact CG2-CH2 4.03Å; I88-W95 HydrophobicContact CG2-CZ2 3.98Å; I88-L112 HydrophobicContact CB-CD1 4.4Å; I88-L112 HydrophobicContact CD1-CD1 3.53Å; I88-L112 HydrophobicContact CG1-CD1 3.6Å; I88-L112 HydrophobicContact CG2-CD1 3.89Å; I88-V118 HydrophobicContact CG2-CG2 4.27Å; I88-P221 HydrophobicContact CD1-CG 4.03Å; I88-L241 HydrophobicContact CB-CD2 4.04Å; I88-L241 HydrophobicContact CD1-CD2 4.07Å; I88-L241 HydrophobicContact CG2-CD1 3.73Å; I88-L241 HydrophobicContact CG2-CD2 3.98Å
89	L	97.6	Very high	97.1	Very high	22 Å²	22	62.3 Å²	62.3	12%	0.115	35%	0.349	C	S	.	.	H	α-helix	trans	-69.8	-25.5	-179.9	-72.5	175.2	0	0	0	113.1	S85 I86 S87 Q92 K120 V225 T239 L241	S85-L89 WeakPolarHBondContact O-CB 3.42Å; S85-L89 WeakPolarHBondContact O-CG 3.22Å; S85-L89 PolarHBondContact O-N 3.18Å; I86-L89 PolarHBondContact O-N 3.35Å; S87-L89 PolarHBondContact O-N 3.15Å; L89-Q92 PolarHBondContact O-NE2 2.92Å; L89-K120 HydrophobicContact CD2-CD 3.57Å; L89-K120 HydrophobicContact CD2-CG 3.9Å; L89-V225 HydrophobicContact CD1-CG2 3.67Å; L89-T239 HydrophobicContact CD1-CG2 4.44Å; L89-T239 HydrophobicContact CD2-CG2 3.79Å; L89-L241 HydrophobicContact CD1-CB 4.17Å; L89-L241 HydrophobicContact CD2-CB 3.96Å; L89-L241 HydrophobicContact CD2-CD1 4.32Å; L89-L241 HydrophobicContact CG-CB 4.11Å; L89-L241 HydrophobicContact CG-CD2 4.45Å
90	G	95.9	Very high	97.1	Very high	53 Å²	53	64.6 Å²	64.6	55%	0.546	36%	0.362	S	S	.	.	H	α-helix	trans	-73.4	-32.2	177.7	0	0	0	0	0	113.2	I86 S87 I88 Q92	I86-G90 PolarHBondContact O-N 2.91Å; S87-G90 PolarHBondContact O-N 2.99Å; I88-G90 VanDerWaalsContact C-N 3.29Å; I88-G90 PolarHBondContact O-N 3.01Å; G90-Q92 PolarHBondContact O-N 3.14Å; G90-Q92 PolarHBondContact O-NE2 2.77Å
91	D	94.1	Very high	97	Very high	70 Å²	70	61.9 Å²	61.9	37%	0.374	35%	0.353	S	S	.	.			trans	-73.5	109.3	175.9	-176.7	-6.1	0	0	0	110.5	S87 I88 D93 W95 K110	S87-D91 PolarHBondContact O-N 3.25Å; I88-D91 PolarHBondContact O-N 3.06Å; D91-D93 VanDerWaalsContact C-N 3.35Å; D91-D93 PolarHBondContact OD1-N 3.06Å; D91-W95 PolarHBondContact O-NE1 2.9Å; D91-K110 IonicContact OD1-NZ 2.74Å; D91-K110 PolarHBondContact OD1-NZ 2.9Å; D91-K110 IonicContact OD2-NZ 3.29Å; D91-K110 PolarHBondContact OD2-NZ 2.78Å
92	Q	92.9	Very high	96.8	Very high	127 Å²	127	67.6 Å²	67.6	59%	0.593	40%	0.4	S	S	*	.			trans	-83.3	-9.8	-178.2	-58.5	-50	-60.3	0	0	113.5	L89 G90	L89-Q92 PolarHBondContact O-NE2 2.92Å; G90-Q92 PolarHBondContact O-N 3.14Å; G90-Q92 PolarHBondContact O-NE2 2.77Å
93	D	94.4	Very high	96.6	Very high	125 Å²	125	71.4 Å²	71.4	67%	0.668	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	152.1	-174.1	-66	-34.6	0	0	0	111.9	D91 W95 K110	D91-D93 VanDerWaalsContact C-N 3.35Å; D91-D93 PolarHBondContact OD1-N 3.06Å; D93-W95 VanDerWaalsContact C-N 3.3Å; D93-W95 PolarHBondContact O-N 2.7Å; D93-K110 WeakPolarHBondContact O-CE 3.45Å; D93-K110 PolarHBondContact O-NZ 2.94Å
94	G	95.3	Very high	96.5	Very high	59 Å²	59	67.5 Å²	67.5	61%	0.608	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	11.4	170.7	0	0	0	0	0	116.1
95	W	98	Very high	96.5	Very high	34 Å²	34	63.3 Å²	63.3	13%	0.129	40%	0.396	C	S	.	.			trans	-77	132.6	169.4	-67.1	95.8	0	0	0	111.1	I88 D91 D93 L108 S109 K110 V118 K120 L241	I88-W95 HydrophobicContact CG2-CH2 4.03Å; I88-W95 HydrophobicContact CG2-CZ2 3.98Å; D91-W95 PolarHBondContact O-NE1 2.9Å; D93-W95 VanDerWaalsContact C-N 3.3Å; D93-W95 PolarHBondContact O-N 2.7Å; W95-L108 HydrophobicContact CB-CB 4.24Å; W95-L108 HydrophobicContact CB-CD2 3.84Å; W95-L108 HydrophobicContact CE3-CB 3.9Å; W95-S109 WeakPolarHBondContact CA-O 3.42Å; W95-K110 HydrophobicContact CD2-CB 4.04Å; W95-K110 HydrophobicContact CD2-CD 4.25Å; W95-K110 HydrophobicContact CE3-CB 3.71Å; W95-K110 HydrophobicContact CH2-CB 4.24Å; W95-K110 HydrophobicContact CZ2-CD 4.33Å; W95-K110 HydrophobicContact CZ3-CB 3.81Å; W95-V118 HydrophobicContact CH2-CG2 3.85Å; W95-V118 HydrophobicContact CZ3-CG2 4.01Å; W95-K120 HydrophobicContact CE3-CB 4.01Å; W95-K120 HydrophobicContact CH2-CB 3.74Å; W95-K120 HydrophobicContact CH2-CD 4.21Å; W95-K120 HydrophobicContact CZ2-CD 4.17Å; W95-K120 HydrophobicContact CZ3-CB 3.43Å; W95-K120 VanDerWaalsContact CZ3-CB 3.43Å; W95-K120 HydrophobicContact CZ3-CD 4.43Å; W95-L241 HydrophobicContact CH2-CD1 3.96Å
96	T	98	Very high	96.5	Very high	87 Å²	87	67.5 Å²	67.5	53%	0.534	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.5	174.4	-59	0	0	0	0	109.3	E98 L108 S109	T96-E98 PolarHBondContact O-N 2.84Å; T96-L108 CarbonylContact O-C 3.42Å; T96-L108 WeakPolarHBondContact O-CA 3.49Å; T96-S109 PolarHBondContact N-O 2.91Å; T96-S109 PolarHBondContact O-N 3.22Å
97	T	97.9	Very high	96.6	Very high	72 Å²	72	64.5 Å²	64.5	44%	0.442	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	125.3	175.4	-55.9	0	0	0	0	110.7	I100	T97-I100 HydrophobicContact CG2-CD1 3.93Å; T97-I100 HydrophobicContact CG2-CG1 3.54Å
98	E	97.1	Very high	96.6	Very high	75 Å²	75	61.3 Å²	61.3	35%	0.35	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-42.2	175.5	-61.5	-75.6	177.6	0	0	111.1	T96 V107 S109 K117 F119	T96-E98 PolarHBondContact O-N 2.84Å; E98-V107 HydrophobicContact CB-CG1 4.39Å; E98-V107 WeakPolarHBondContact CB-O 3.07Å; E98-V107 PolarHBondContact N-O 3.08Å; E98-S109 VanDerWaalsContact OE1-CB 3.31Å; E98-S109 WeakPolarHBondContact OE1-CB 3.43Å; E98-S109 PolarHBondContact OE1-OG 2.89Å; E98-K117 WeakPolarHBondContact OE1-CE 2.97Å; E98-K117 IonicContact OE1-NZ 3.5Å; E98-K117 PolarHBondContact OE1-NZ 2.74Å; E98-F119 HydrophobicContact CG-CD1 4.48Å; E98-F119 HydrophobicContact CG-CE1 4.31Å
99	I	97.6	Very high	96.6	Very high	40 Å²	40	60.6 Å²	60.6	21%	0.205	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	138.1	-178.4	-56.3	176	0	0	0	109.5	K106 V107 V264	I99-K106 WeakPolarHBondContact O-CA 3.35Å; I99-V107 HydrophobicContact CB-CB 4.1Å; I99-V107 HydrophobicContact CB-CG2 4.41Å; I99-V107 HydrophobicContact CG1-CB 4.45Å; I99-V107 PolarHBondContact N-O 2.94Å; I99-V107 VanDerWaalsContact N-O 3.09Å; I99-V107 PolarHBondContact O-N 2.91Å; I99-V264 HydrophobicContact CD1-CG2 3.8Å; I99-V264 HydrophobicContact CG2-CG2 4.12Å
100	I	97.7	Very high	96.6	Very high	114 Å²	114	60.6 Å²	60.6	59%	0.585	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.8	114.2	160.3	-56.7	175.9	0	0	0	106.4	T97 D105 K106	T97-I100 HydrophobicContact CG2-CD1 3.93Å; T97-I100 HydrophobicContact CG2-CG1 3.54Å; I100-D105 CarbonylContact C-O 3.58Å; I100-D105 WeakPolarHBondContact CA-O 3.36Å; I100-K106 HydrophobicContact CG1-CG 4.41Å
101	A	95.6	Very high	96.7	Very high	24 Å²	24	63.3 Å²	63.3	20%	0.198	38%	0.377	C	S	.	.			trans	-80.2	160.4	176.1	0	0	0	0	0	111	N103 G104 D105	A101-N103 VanDerWaalsContact CB-OD1 3.25Å; A101-N103 WeakPolarHBondContact CB-OD1 3.19Å; A101-N103 PolarHBondContact O-N 3.5Å; A101-G104 PolarHBondContact O-N 3.37Å; A101-D105 HydrophobicContact CB-CB 4.03Å; A101-D105 PolarHBondContact N-O 2.72Å
102	A	94.5	Very high	96.8	Very high	120 Å²	120	61.2 Å²	61.2	99%	0.992	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.4	-177.8	0	0	0	0	0	113.6	G104	A102-G104 VanDerWaalsContact C-N 3.26Å; A102-G104 PolarHBondContact O-N 3.07Å
103	N	94.6	Very high	96.9	Very high	90 Å²	90	61.2 Å²	61.2	48%	0.481	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-0.2	175.8	66.6	-6	0	0	0	113.6	A101 D105 R271	A101-N103 VanDerWaalsContact CB-OD1 3.25Å; A101-N103 WeakPolarHBondContact CB-OD1 3.19Å; A101-N103 PolarHBondContact O-N 3.5Å; N103-D105 PolarHBondContact ND2-OD2 2.86Å; N103-D105 WeakPolarHBondContact OD1-CB 3.46Å; N103-D105 PolarHBondContact OD1-N 2.86Å; N103-D105 PolarHBondContact OD1-OD2 2.97Å; N103-R271 PolarHBondContact ND2-NH1 3.37Å; N103-R271 PolarHBondContact ND2-NH2 3.5Å
104	G	96.3	Very high	96.7	Very high	43 Å²	43	63.1 Å²	63.1	44%	0.443	39%	0.387	S	S	.	.	S	Bend	trans	94	-2.3	-179.8	0	0	0	0	0	115.6	A101 A102	A101-G104 PolarHBondContact O-N 3.37Å; A102-G104 VanDerWaalsContact C-N 3.26Å; A102-G104 PolarHBondContact O-N 3.07Å
105	D	98	Very high	96.7	Very high	6 Å²	6	62.6 Å²	62.6	3%	0.032	37%	0.372	C	S	.	.			trans	-62.2	142.8	175	-63.1	-18.3	0	0	0	110.9	I100 A101 N103 V123 R271	I100-D105 CarbonylContact C-O 3.58Å; I100-D105 WeakPolarHBondContact CA-O 3.36Å; A101-D105 HydrophobicContact CB-CB 4.03Å; A101-D105 PolarHBondContact N-O 2.72Å; N103-D105 PolarHBondContact ND2-OD2 2.86Å; N103-D105 WeakPolarHBondContact OD1-CB 3.46Å; N103-D105 PolarHBondContact OD1-N 2.86Å; N103-D105 PolarHBondContact OD1-OD2 2.97Å; D105-V123 HydrophobicContact CB-CG2 3.97Å; D105-V123 WeakPolarHBondContact OD1-CG1 3.33Å; D105-R271 IonicContact OD1-CZ 3.32Å; D105-R271 IonicContact OD1-NH1 2.7Å; D105-R271 IonicContact OD1-NH2 2.77Å; D105-R271 PolarHBondContact OD1-NH2 2.56Å; D105-R271 IonicContact OD2-CZ 2.83Å; D105-R271 IonicContact OD2-NH1 3.9Å; D105-R271 PolarHBondContact OD2-NH1 2.74Å; D105-R271 IonicContact OD2-NH2 3.88Å; D105-R271 PolarHBondContact OD2-NH2 2.77Å
106	K	98.5	Very high	96.6	Very high	88 Å²	88	62.4 Å²	62.4	38%	0.383	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138	-178.7	-59	-179.8	-173.9	171.6	0	111.2	I99 I100 L108 L121 E122	I99-K106 WeakPolarHBondContact O-CA 3.35Å; I100-K106 HydrophobicContact CG1-CG 4.41Å; K106-L108 HydrophobicContact CB-CD1 3.95Å; K106-L121 CarbonylContact O-C 3.5Å; K106-L121 WeakPolarHBondContact O-CA 3.38Å; K106-E122 PolarHBondContact N-O 2.71Å; K106-E122 PolarHBondContact O-N 2.71Å
107	V	98.6	Very high	96.5	Very high	1 Å²	1	61 Å²	61	1%	0.006	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	122.7	161.7	-179.7	0	0	0	0	107.8	E98 I99 F119 K120 L121 Q263 V264	E98-V107 HydrophobicContact CB-CG1 4.39Å; E98-V107 WeakPolarHBondContact CB-O 3.07Å; E98-V107 PolarHBondContact N-O 3.08Å; I99-V107 HydrophobicContact CB-CB 4.1Å; I99-V107 HydrophobicContact CB-CG2 4.41Å; I99-V107 HydrophobicContact CG1-CB 4.45Å; I99-V107 PolarHBondContact N-O 2.94Å; I99-V107 VanDerWaalsContact N-O 3.09Å; I99-V107 PolarHBondContact O-N 2.91Å; V107-F119 HydrophobicContact CG1-CB 4.46Å; V107-F119 HydrophobicContact CG1-CD1 4.15Å; V107-K120 CarbonylContact C-O 3.58Å; V107-K120 WeakPolarHBondContact CA-O 3.33Å; V107-L121 HydrophobicContact CG2-CD1 3.9Å; V107-Q263 HydrophobicContact CG2-CB 4.09Å; V107-V264 HydrophobicContact CG2-CG2 3.73Å
108	L	98.5	Very high	96.5	Very high	18 Å²	18	57.6 Å²	57.6	9%	0.094	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	159.8	174	-56.3	97.8	0	0	0	109.6	W95 T96 K106 F119 K120 E122	W95-L108 HydrophobicContact CB-CB 4.24Å; W95-L108 HydrophobicContact CB-CD2 3.84Å; W95-L108 HydrophobicContact CE3-CB 3.9Å; T96-L108 CarbonylContact O-C 3.42Å; T96-L108 WeakPolarHBondContact O-CA 3.49Å; K106-L108 HydrophobicContact CB-CD1 3.95Å; L108-F119 CarbonylContact O-C 3.58Å; L108-F119 VanDerWaalsContact O-CA 3.26Å; L108-F119 WeakPolarHBondContact O-CA 3.39Å; L108-K120 PolarHBondContact N-O 3.07Å; L108-K120 PolarHBondContact O-N 3.03Å; L108-E122 HydrophobicContact CD1-CG 4.19Å
109	S	98.2	Very high	96.6	Very high	5 Å²	5	54.1 Å²	54.1	4%	0.035	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	158	173.1	80.6	0	0	0	0	112.3	W95 T96 E98 K117 V118	W95-S109 WeakPolarHBondContact CA-O 3.42Å; T96-S109 PolarHBondContact N-O 2.91Å; T96-S109 PolarHBondContact O-N 3.22Å; E98-S109 VanDerWaalsContact OE1-CB 3.31Å; E98-S109 WeakPolarHBondContact OE1-CB 3.43Å; E98-S109 PolarHBondContact OE1-OG 2.89Å; S109-K117 WeakPolarHBondContact OG-CE 3.38Å; S109-V118 CarbonylContact C-O 3.58Å; S109-V118 WeakPolarHBondContact CA-O 3.36Å; S109-V118 WeakPolarHBondContact CB-O 3.27Å
110	K	97.7	Very high	96.6	Very high	21 Å²	21	52.5 Å²	52.5	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	144.9	175.6	-176.2	168	177.7	174	0	109.3	D91 D93 W95 L112 K117 V118	D91-K110 IonicContact OD1-NZ 2.74Å; D91-K110 PolarHBondContact OD1-NZ 2.9Å; D91-K110 IonicContact OD2-NZ 3.29Å; D91-K110 PolarHBondContact OD2-NZ 2.78Å; D93-K110 WeakPolarHBondContact O-CE 3.45Å; D93-K110 PolarHBondContact O-NZ 2.94Å; W95-K110 HydrophobicContact CD2-CB 4.04Å; W95-K110 HydrophobicContact CD2-CD 4.25Å; W95-K110 HydrophobicContact CE3-CB 3.71Å; W95-K110 HydrophobicContact CH2-CB 4.24Å; W95-K110 HydrophobicContact CZ2-CD 4.33Å; W95-K110 HydrophobicContact CZ3-CB 3.81Å; K110-L112 HydrophobicContact CD-CD2 3.96Å; K110-L112 HydrophobicContact CG-CD2 3.99Å; K110-L112 HydrophobicContact CG-CG 4.49Å; K110-K117 CarbonylContact O-C 3.57Å; K110-K117 WeakPolarHBondContact O-CA 3.43Å; K110-V118 HydrophobicContact CB-CG2 4.04Å; K110-V118 PolarHBondContact N-O 2.83Å; K110-V118 WeakPolarHBondContact O-CG2 3.47Å; K110-V118 PolarHBondContact O-N 3.16Å
111	V	97.2	Very high	96.7	Very high	110 Å²	110	47 Å²	47	67%	0.667	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	122.3	172.7	-178.5	0	0	0	0	108.4	K117	V111-K117 HydrophobicContact CG2-CB 4.18Å; V111-K117 HydrophobicContact CG2-CD 4.48Å; V111-K117 HydrophobicContact CG2-CG 4.14Å
112	L	96.8	Very high	96.8	Very high	26 Å²	26	48.9 Å²	48.9	14%	0.136	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.8	-179.4	-60.6	175	0	0	0	109.9	I88 K110 D114 V115 G116 V118	I88-L112 HydrophobicContact CB-CD1 4.4Å; I88-L112 HydrophobicContact CD1-CD1 3.53Å; I88-L112 HydrophobicContact CG1-CD1 3.6Å; I88-L112 HydrophobicContact CG2-CD1 3.89Å; K110-L112 HydrophobicContact CD-CD2 3.96Å; K110-L112 HydrophobicContact CG-CD2 3.99Å; K110-L112 HydrophobicContact CG-CG 4.49Å; L112-D114 PolarHBondContact O-N 3.13Å; L112-V115 HydrophobicContact CB-CB 4.05Å; L112-V115 HydrophobicContact CD1-CB 4.16Å; L112-V115 HydrophobicContact CD1-CG2 4.41Å; L112-V115 PolarHBondContact O-N 2.95Å; L112-G116 PolarHBondContact N-O 3.29Å; L112-G116 WeakPolarHBondContact O-CA 3.45Å; L112-G116 PolarHBondContact O-N 2.91Å; L112-V118 HydrophobicContact CD1-CG1 3.93Å; L112-V118 HydrophobicContact CD1-CG2 4.01Å; L112-V118 HydrophobicContact CG-CG2 4.34Å
113	P	94.1	Very high	97	Very high	128 Å²	128	43.7 Å²	43.7	83%	0.831	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-44.6	-177	-27.9	35.4	0	0	0	114.6
114	D	91.5	Very high	97.2	Very high	165 Å²	165	43.1 Å²	43.1	88%	0.882	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-7.7	-172.6	-55.6	-44.4	0	0	0	114	L112	L112-D114 PolarHBondContact O-N 3.13Å
115	V	94.4	Very high	97.3	Very high	48 Å²	48	41.3 Å²	41.3	29%	0.291	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-24.5	-174.6	179.5	0	0	0	0	112.2	L112 V118 P221 S243	L112-V115 HydrophobicContact CB-CB 4.05Å; L112-V115 HydrophobicContact CD1-CB 4.16Å; L112-V115 HydrophobicContact CD1-CG2 4.41Å; L112-V115 PolarHBondContact O-N 2.95Å; V115-V118 HydrophobicContact CB-CG1 4.48Å; V115-V118 HydrophobicContact CG1-CG1 3.6Å; V115-P221 HydrophobicContact CG1-CG 3.81Å; V115-P221 HydrophobicContact CG2-CG 3.99Å; V115-S243 WeakPolarHBondContact CG1-OG 3.26Å
116	G	95.1	Very high	97.2	Very high	30 Å²	30	46.1 Å²	46.1	31%	0.309	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.3	-152.5	-171.8	0	0	0	0	0	112.3	L112	L112-G116 PolarHBondContact N-O 3.29Å; L112-G116 WeakPolarHBondContact O-CA 3.45Å; L112-G116 PolarHBondContact O-N 2.91Å
117	K	97	Very high	97.1	Very high	58 Å²	58	43.6 Å²	43.6	25%	0.252	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	125.9	-177.8	-167.2	170.1	179.4	175.6	0	110.2	E98 S109 K110 V111 F119 N256	E98-K117 WeakPolarHBondContact OE1-CE 2.97Å; E98-K117 IonicContact OE1-NZ 3.5Å; E98-K117 PolarHBondContact OE1-NZ 2.74Å; S109-K117 WeakPolarHBondContact OG-CE 3.38Å; K110-K117 CarbonylContact O-C 3.57Å; K110-K117 WeakPolarHBondContact O-CA 3.43Å; V111-K117 HydrophobicContact CG2-CB 4.18Å; V111-K117 HydrophobicContact CG2-CD 4.48Å; V111-K117 HydrophobicContact CG2-CG 4.14Å; K117-F119 HydrophobicContact CD-CE2 4.28Å; K117-F119 HydrophobicContact CD-CZ 3.89Å; K117-F119 HydrophobicContact CG-CE2 4.1Å; K117-F119 HydrophobicContact CG-CZ 4.18Å; K117-N256 PolarHBondContact NZ-ND2 2.68Å
118	V	98.2	Very high	97	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	152.3	173.6	-56.6	0	0	0	0	109.9	I88 W95 S109 K110 L112 V115 L241 L242	I88-V118 HydrophobicContact CG2-CG2 4.27Å; W95-V118 HydrophobicContact CH2-CG2 3.85Å; W95-V118 HydrophobicContact CZ3-CG2 4.01Å; S109-V118 CarbonylContact C-O 3.58Å; S109-V118 WeakPolarHBondContact CA-O 3.36Å; S109-V118 WeakPolarHBondContact CB-O 3.27Å; K110-V118 HydrophobicContact CB-CG2 4.04Å; K110-V118 PolarHBondContact N-O 2.83Å; K110-V118 WeakPolarHBondContact O-CG2 3.47Å; K110-V118 PolarHBondContact O-N 3.16Å; L112-V118 HydrophobicContact CD1-CG1 3.93Å; L112-V118 HydrophobicContact CD1-CG2 4.01Å; L112-V118 HydrophobicContact CG-CG2 4.34Å; V115-V118 HydrophobicContact CB-CG1 4.48Å; V115-V118 HydrophobicContact CG1-CG1 3.6Å; V118-L241 HydrophobicContact CB-CD1 3.96Å; V118-L241 HydrophobicContact CG2-CD1 4.03Å; V118-L242 CarbonylContact C-O 3.53Å; V118-L242 WeakPolarHBondContact CA-O 3.23Å
119	F	98.5	Very high	96.9	Very high	1 Å²	1	49 Å²	49	0%	0.004	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.8	175.7	-62.9	-95.6	0	0	0	109.8	E98 V107 L108 K117 L241 L242 N256 L259 Q263	E98-F119 HydrophobicContact CG-CD1 4.48Å; E98-F119 HydrophobicContact CG-CE1 4.31Å; V107-F119 HydrophobicContact CG1-CB 4.46Å; V107-F119 HydrophobicContact CG1-CD1 4.15Å; L108-F119 CarbonylContact O-C 3.58Å; L108-F119 VanDerWaalsContact O-CA 3.26Å; L108-F119 WeakPolarHBondContact O-CA 3.39Å; K117-F119 HydrophobicContact CD-CE2 4.28Å; K117-F119 HydrophobicContact CD-CZ 3.89Å; K117-F119 HydrophobicContact CG-CE2 4.1Å; K117-F119 HydrophobicContact CG-CZ 4.18Å; F119-L241 CarbonylContact O-C 3.56Å; F119-L241 WeakPolarHBondContact O-CA 3.12Å; F119-L242 HydrophobicContact CB-CB 4.42Å; F119-L242 PolarHBondContact N-O 3.08Å; F119-L242 PolarHBondContact O-N 3.13Å; F119-N256 HydrophobicContact CZ-CB 3.91Å; F119-L259 HydrophobicContact CD2-CB 4.04Å; F119-L259 HydrophobicContact CD2-CD1 4.12Å; F119-L259 HydrophobicContact CE2-CB 3.91Å; F119-L259 HydrophobicContact CE2-CD1 3.74Å; F119-L259 HydrophobicContact CE2-CG 4.49Å; F119-L259 HydrophobicContact CZ-CB 4.32Å; F119-Q263 VanDerWaalsContact CB-OE1 3.28Å
120	K	98.6	Very high	96.8	Very high	6 Å²	6	51.9 Å²	51.9	3%	0.026	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	115.2	179.4	179	179.4	59.9	154.9	0	108.5	L89 W95 V107 L108 E122 T239 W240	L89-K120 HydrophobicContact CD2-CD 3.57Å; L89-K120 HydrophobicContact CD2-CG 3.9Å; W95-K120 HydrophobicContact CE3-CB 4.01Å; W95-K120 HydrophobicContact CH2-CB 3.74Å; W95-K120 HydrophobicContact CH2-CD 4.21Å; W95-K120 HydrophobicContact CZ2-CD 4.17Å; W95-K120 HydrophobicContact CZ3-CB 3.43Å; W95-K120 VanDerWaalsContact CZ3-CB 3.43Å; W95-K120 HydrophobicContact CZ3-CD 4.43Å; V107-K120 CarbonylContact C-O 3.58Å; V107-K120 WeakPolarHBondContact CA-O 3.33Å; L108-K120 PolarHBondContact N-O 3.07Å; L108-K120 PolarHBondContact O-N 3.03Å; K120-E122 HydrophobicContact CD-CG 4.33Å; K120-E122 VanDerWaalsContact CE-OE1 3.22Å; K120-E122 WeakPolarHBondContact CE-OE1 3.46Å; K120-E122 HydrophobicContact CG-CG 4.22Å; K120-E122 IonicContact NZ-OE1 3.45Å; K120-E122 PolarHBondContact NZ-OE1 3.38Å; K120-T239 HydrophobicContact CD-CG2 4.04Å; K120-T239 HydrophobicContact CG-CG2 3.83Å; K120-W240 CarbonylContact C-O 3.57Å; K120-W240 WeakPolarHBondContact CA-O 3.23Å
121	L	98.7	Very high	96.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	134.6	168.8	176.7	68.7	0	0	0	109.3	K106 V107 V123 F238 T239 W240 Q263 A267	K106-L121 CarbonylContact O-C 3.5Å; K106-L121 WeakPolarHBondContact O-CA 3.38Å; V107-L121 HydrophobicContact CG2-CD1 3.9Å; L121-V123 HydrophobicContact CD1-CG2 3.54Å; L121-V123 HydrophobicContact CD2-CG2 4.04Å; L121-V123 HydrophobicContact CG-CG2 3.66Å; L121-F238 HydrophobicContact CD2-CD1 4.29Å; L121-F238 HydrophobicContact CD2-CE1 4.02Å; L121-T239 CarbonylContact O-C 3.6Å; L121-T239 VanDerWaalsContact O-CA 3.23Å; L121-T239 WeakPolarHBondContact O-CA 3.4Å; L121-W240 HydrophobicContact CB-CB 4.17Å; L121-W240 HydrophobicContact CD2-CB 4.44Å; L121-W240 HydrophobicContact CD2-CE3 4.12Å; L121-W240 PolarHBondContact N-O 2.79Å; L121-W240 PolarHBondContact O-N 3.34Å; L121-Q263 HydrophobicContact CB-CB 4.07Å; L121-Q263 HydrophobicContact CB-CG 4.41Å; L121-Q263 HydrophobicContact CD1-CB 4.25Å; L121-Q263 HydrophobicContact CD2-CB 4.26Å; L121-Q263 WeakPolarHBondContact CD2-O 3.35Å; L121-Q263 HydrophobicContact CG-CB 4.42Å; L121-A267 HydrophobicContact CD2-CB 4.16Å
122	E	98.6	Very high	96.8	Very high	63 Å²	63	48.6 Å²	48.6	29%	0.294	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	119.9	171.7	-65.9	-178	166.8	0	0	109.7	K106 L108 K120 T239	K106-E122 PolarHBondContact N-O 2.71Å; K106-E122 PolarHBondContact O-N 2.71Å; L108-E122 HydrophobicContact CD1-CG 4.19Å; K120-E122 HydrophobicContact CD-CG 4.33Å; K120-E122 VanDerWaalsContact CE-OE1 3.22Å; K120-E122 WeakPolarHBondContact CE-OE1 3.46Å; K120-E122 HydrophobicContact CG-CG 4.22Å; K120-E122 IonicContact NZ-OE1 3.45Å; K120-E122 PolarHBondContact NZ-OE1 3.38Å; E122-T239 HydrophobicContact CG-CG2 4.45Å
123	V	98.3	Very high	96.8	Very high	10 Å²	10	49.6 Å²	49.6	6%	0.061	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	143.7	-173.1	175.7	0	0	0	0	110.3	D105 L121 L125 F238 A267	D105-V123 HydrophobicContact CB-CG2 3.97Å; D105-V123 WeakPolarHBondContact OD1-CG1 3.33Å; L121-V123 HydrophobicContact CD1-CG2 3.54Å; L121-V123 HydrophobicContact CD2-CG2 4.04Å; L121-V123 HydrophobicContact CG-CG2 3.66Å; V123-L125 HydrophobicContact CG1-CD2 3.55Å; V123-L125 HydrophobicContact CG1-CG 3.85Å; V123-F238 HydrophobicContact CB-CB 4.38Å; V123-F238 PolarHBondContact N-O 3.34Å; V123-F238 PolarHBondContact O-N 2.95Å; V123-A267 HydrophobicContact CG2-CB 3.95Å
124	L	98.2	Very high	96.9	Very high	79 Å²	79	47.3 Å²	47.3	41%	0.414	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.9	163.6	-171.1	69	0	0	0	108.7	K235 K237	L124-K235 HydrophobicContact CD1-CB 4.03Å; L124-K235 HydrophobicContact CD2-CD 4.13Å; L124-K235 HydrophobicContact CG-CB 4.43Å; L124-K235 HydrophobicContact CG-CD 4.41Å; L124-K237 HydrophobicContact CD1-CG 4.11Å
125	L	98.1	Very high	97.2	Very high	4 Å²	4	39.6 Å²	39.6	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	134.5	178	-63.1	175.3	0	0	0	109.9	V123 Q127 L132 K235 T236 F238 L270 R271	V123-L125 HydrophobicContact CG1-CD2 3.55Å; V123-L125 HydrophobicContact CG1-CG 3.85Å; L125-Q127 PolarHBondContact O-N 3.26Å; L125-L132 HydrophobicContact CB-CD1 4.27Å; L125-L132 HydrophobicContact CD1-CD1 3.71Å; L125-L132 HydrophobicContact CD1-CD2 3.83Å; L125-L132 HydrophobicContact CD1-CG 4.45Å; L125-K235 CarbonylContact O-C 3.56Å; L125-K235 VanDerWaalsContact O-CA 3.28Å; L125-K235 WeakPolarHBondContact O-CA 3.4Å; L125-K235 WeakPolarHBondContact O-CB 3.12Å; L125-T236 PolarHBondContact N-O 3.36Å; L125-T236 PolarHBondContact O-N 3.43Å; L125-F238 HydrophobicContact CD1-CB 3.83Å; L125-F238 HydrophobicContact CD1-CD2 3.9Å; L125-F238 HydrophobicContact CD1-CG 3.94Å; L125-F238 HydrophobicContact CG-CB 4.17Å; L125-L270 HydrophobicContact CD1-CD2 3.79Å; L125-L270 HydrophobicContact CD1-CG 4.44Å; L125-R271 HydrophobicContact CD2-CG 3.58Å
126	D	96.5	Very high	97.4	Very high	107 Å²	107	37.3 Å²	37.3	57%	0.572	19%	0.191	S	C	*	.	S	Bend	trans	-77.2	55.2	173.8	-63.5	-49	0	0	0	111.1	K235	D126-K235 VanDerWaalsContact OD1-CD 3.3Å; D126-K235 WeakPolarHBondContact OD1-CD 3.34Å; D126-K235 WeakPolarHBondContact OD1-CE 3.38Å; D126-K235 IonicContact OD1-NZ 2.72Å; D126-K235 PolarHBondContact OD1-NZ 2.86Å
127	Q	97	Very high	97.5	Very high	35 Å²	35	36.6 Å²	36.6	16%	0.164	18%	0.18	C	C	.	.	S	Bend	trans	-147.1	144.6	-179.2	-71.4	-63	-43.5	0	0	110.7	L125 N131 L132 N234 K235 T236 M274	L125-Q127 PolarHBondContact O-N 3.26Å; Q127-N131 PolarHBondContact OE1-ND2 3.29Å; Q127-L132 HydrophobicContact CB-CD1 4.14Å; Q127-L132 HydrophobicContact CB-CD2 4.06Å; Q127-L132 HydrophobicContact CB-CG 3.91Å; Q127-L132 HydrophobicContact CG-CD2 4.41Å; Q127-N234 CarbonylContact C-O 3.36Å; Q127-N234 PolarHBondContact N-O 3.47Å; Q127-K235 CarbonylContact O-C 3.47Å; Q127-T236 WeakPolarHBondContact O-CB 3.13Å; Q127-T236 PolarHBondContact O-N 3.36Å; Q127-T236 PolarHBondContact O-OG1 2.71Å; Q127-M274 HydrophobicContact CG-CB 3.66Å; Q127-M274 HydrophobicContact CG-CE 4.12Å; Q127-M274 HydrophobicContact CG-CG 4Å
128	R	96.6	Very high	97.4	Very high	127 Å²	127	36.5 Å²	36.5	48%	0.479	20%	0.196	S	C	.	.			trans	-65	144.4	169.9	-72.2	176.6	61.7	142.6	-1.2	110.4	D130 N131 L132 N234	R128-D130 PolarHBondContact O-N 3.46Å; R128-N131 PolarHBondContact O-N 2.82Å; R128-N131 VanDerWaalsContact O-N 3.08Å; R128-L132 PolarHBondContact O-N 2.88Å; R128-N234 PolarHBondContact N-O 3.39Å
129	S	96.8	Very high	97.4	Very high	5 Å²	5	39 Å²	39	4%	0.035	21%	0.209	C	C	.	.	H	α-helix	trans	-61.5	-28.5	-178.5	-56.7	0	0	0	0	112.7	Y133 P228 T236	S129-Y133 WeakPolarHBondContact O-CB 3.46Å; S129-Y133 PolarHBondContact O-N 2.93Å; S129-P228 WeakPolarHBondContact OG-CD 3.27Å; S129-T236 VanDerWaalsContact CA-OG1 3.28Å; S129-T236 WeakPolarHBondContact CA-OG1 3.26Å; S129-T236 PolarHBondContact N-OG1 2.9Å; S129-T236 WeakPolarHBondContact OG-CG2 3.1Å; S129-T236 PolarHBondContact OG-OG1 2.94Å
130	D	95.4	Very high	97.4	Very high	66 Å²	66	39 Å²	39	35%	0.353	21%	0.209	S	C	.	.	H	α-helix	trans	-68.2	-40	175.5	-65	-40.4	0	0	0	112.8	R128 L132 Y133 V134 R191	R128-D130 PolarHBondContact O-N 3.46Å; D130-L132 VanDerWaalsContact C-N 3.33Å; D130-L132 PolarHBondContact O-N 3.3Å; D130-Y133 PolarHBondContact O-N 3.19Å; D130-V134 WeakPolarHBondContact O-CG2 3.18Å; D130-V134 PolarHBondContact O-N 2.86Å; D130-R191 IonicContact OD1-CZ 2.74Å; D130-R191 IonicContact OD1-NH1 2.63Å; D130-R191 PolarHBondContact OD1-NH1 3.33Å; D130-R191 IonicContact OD1-NH2 2.71Å; D130-R191 PolarHBondContact OD1-NH2 3.43Å
131	N	96.6	Very high	97.3	Very high	63 Å²	63	42.9 Å²	42.9	34%	0.337	23%	0.227	S	C	.	.	H	α-helix	trans	-63.3	-44.1	177.1	-63.4	-0.3	0	0	0	110.3	Q127 R128 Y133 V134 E135 M274	Q127-N131 PolarHBondContact OE1-ND2 3.29Å; R128-N131 PolarHBondContact O-N 2.82Å; R128-N131 VanDerWaalsContact O-N 3.08Å; N131-Y133 VanDerWaalsContact C-N 3.33Å; N131-Y133 PolarHBondContact O-N 3.42Å; N131-V134 PolarHBondContact O-N 3.15Å; N131-E135 PolarHBondContact O-N 3.22Å; N131-E135 VanDerWaalsContact O-N 3.07Å; N131-M274 HydrophobicContact CB-CE 3.64Å
132	L	97.7	Very high	97.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-37.7	175.8	-65	170.5	0	0	0	111.8	L125 Q127 R128 D130 E135 L136 M226 T236 L270 M274	L125-L132 HydrophobicContact CB-CD1 4.27Å; L125-L132 HydrophobicContact CD1-CD1 3.71Å; L125-L132 HydrophobicContact CD1-CD2 3.83Å; L125-L132 HydrophobicContact CD1-CG 4.45Å; Q127-L132 HydrophobicContact CB-CD1 4.14Å; Q127-L132 HydrophobicContact CB-CD2 4.06Å; Q127-L132 HydrophobicContact CB-CG 3.91Å; Q127-L132 HydrophobicContact CG-CD2 4.41Å; R128-L132 PolarHBondContact O-N 2.88Å; D130-L132 VanDerWaalsContact C-N 3.33Å; D130-L132 PolarHBondContact O-N 3.3Å; L132-E135 PolarHBondContact O-N 3.2Å; L132-L136 VanDerWaalsContact O-CB 3.26Å; L132-L136 WeakPolarHBondContact O-CB 3.26Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.42Å; L132-L136 PolarHBondContact O-N 3.32Å; L132-M226 HydrophobicContact CB-CG 4.44Å; L132-M226 HydrophobicContact CB-SD 3.56Å; L132-M226 VanDerWaalsContact CB-SD 3.56Å; L132-T236 HydrophobicContact CD1-CG2 3.65Å; L132-L270 HydrophobicContact CD2-CD1 4.21Å; L132-L270 HydrophobicContact CD2-CD2 4.15Å; L132-L270 HydrophobicContact CD2-CG 4.25Å; L132-M274 HydrophobicContact CD2-CE 4.35Å; L132-M274 HydrophobicContact CD2-CG 3.89Å; L132-M274 HydrophobicContact CD2-SD 4.2Å
133	Y	97.2	Very high	97.3	Very high	46 Å²	46	44.1 Å²	44.1	18%	0.18	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-43.1	176.1	-176.1	-88.3	0	0	0	111.8	S129 D130 N131 E135 V137 G138 A189 C196 M226	S129-Y133 WeakPolarHBondContact O-CB 3.46Å; S129-Y133 PolarHBondContact O-N 2.93Å; D130-Y133 PolarHBondContact O-N 3.19Å; N131-Y133 VanDerWaalsContact C-N 3.33Å; N131-Y133 PolarHBondContact O-N 3.42Å; Y133-E135 VanDerWaalsContact C-N 3.34Å; Y133-E135 PolarHBondContact O-N 2.98Å; Y133-V137 HydrophobicContact CD1-CB 4.31Å; Y133-V137 HydrophobicContact CD2-CB 4.37Å; Y133-V137 HydrophobicContact CD2-CG2 3.72Å; Y133-V137 HydrophobicContact CE1-CB 4.12Å; Y133-V137 HydrophobicContact CE1-CG1 4.26Å; Y133-V137 HydrophobicContact CE1-CG2 4.46Å; Y133-V137 HydrophobicContact CE2-CB 4.2Å; Y133-V137 HydrophobicContact CE2-CG1 4.37Å; Y133-V137 HydrophobicContact CE2-CG2 3.68Å; Y133-V137 HydrophobicContact CG-CB 4.45Å; Y133-V137 HydrophobicContact CG-CG2 4.17Å; Y133-V137 WeakPolarHBondContact O-CA 3.03Å; Y133-V137 WeakPolarHBondContact O-CB 3.37Å; Y133-V137 PolarHBondContact O-N 2.97Å; Y133-G138 PolarHBondContact O-N 3.1Å; Y133-A189 HydrophobicContact CE2-CB 4.44Å; Y133-C196 HydrophobicContact CD2-CB 3.65Å; Y133-C196 HydrophobicContact CE2-CB 4.23Å; Y133-M226 HydrophobicContact CD2-CE 3.99Å
134	V	97.1	Very high	97.2	Very high	80 Å²	80	44.9 Å²	44.9	49%	0.485	24%	0.243	S	C	.	.	I	π-helix	trans	-59.5	-47	174.9	171.8	0	0	0	0	110.2	D130 N131 G138 N139	D130-V134 WeakPolarHBondContact O-CG2 3.18Å; D130-V134 PolarHBondContact O-N 2.86Å; N131-V134 PolarHBondContact O-N 3.15Å; V134-G138 CarbonylContact O-C 3.57Å; V134-G138 WeakPolarHBondContact O-CA 3.43Å; V134-G138 PolarHBondContact O-N 3.24Å; V134-N139 PolarHBondContact O-N 3.38Å
135	E	97.5	Very high	97.2	Very high	3 Å²	3	47.2 Å²	47.2	1%	0.014	26%	0.256	C	S	.	.	I	π-helix	trans	-67.3	-44.2	-179.2	-171.3	60.8	-165.6	0	0	112.8	N131 L132 Y133 N139 W146 R273 M274	N131-E135 PolarHBondContact O-N 3.22Å; N131-E135 VanDerWaalsContact O-N 3.07Å; L132-E135 PolarHBondContact O-N 3.2Å; Y133-E135 VanDerWaalsContact C-N 3.34Å; Y133-E135 PolarHBondContact O-N 2.98Å; E135-N139 CarbonylContact O-C 3.44Å; E135-N139 PolarHBondContact OE2-ND2 3.19Å; E135-W146 PolarHBondContact OE1-NE1 2.68Å; E135-R273 HydrophobicContact CG-CG 4.24Å; E135-R273 IonicContact OE1-CZ 3.59Å; E135-R273 IonicContact OE1-NE 3.69Å; E135-R273 PolarHBondContact OE1-NE 3.27Å; E135-R273 IonicContact OE1-NH2 3.53Å; E135-R273 PolarHBondContact OE1-NH2 2.63Å; E135-R273 IonicContact OE2-NE 3.7Å; E135-R273 IonicContact OE2-NH2 3.34Å; E135-M274 HydrophobicContact CB-SD 3.87Å; E135-M274 HydrophobicContact CG-SD 3.98Å
136	L	97.7	Very high	97.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	I	π-helix	trans	-87.3	-21.3	-172.1	-63.3	176.4	0	0	0	114.4	L132 M143 W146 I224 M226 F238 F266 L270	L132-L136 VanDerWaalsContact O-CB 3.26Å; L132-L136 WeakPolarHBondContact O-CB 3.26Å; L132-L136 VanDerWaalsContact O-CG 3.27Å; L132-L136 WeakPolarHBondContact O-CG 3.42Å; L132-L136 PolarHBondContact O-N 3.32Å; L136-M143 HydrophobicContact CD2-CE 4.3Å; L136-W146 HydrophobicContact CD2-CH2 4.22Å; L136-W146 HydrophobicContact CD2-CZ2 4.25Å; L136-I224 HydrophobicContact CD1-CD1 4.48Å; L136-I224 HydrophobicContact CD1-CG2 4.44Å; L136-M226 HydrophobicContact CD1-SD 3.97Å; L136-F238 HydrophobicContact CD1-CE2 3.62Å; L136-F238 HydrophobicContact CD1-CZ 4.31Å; L136-F266 HydrophobicContact CD2-CE2 4.47Å; L136-F266 HydrophobicContact CD2-CZ 3.77Å; L136-L270 HydrophobicContact CD1-CD2 4.19Å; L136-L270 HydrophobicContact CD2-CD1 4.07Å; L136-L270 HydrophobicContact CD2-CD2 4.44Å
137	V	97.2	Very high	97.1	Very high	15 Å²	15	43.4 Å²	43.4	9%	0.091	23%	0.234	C	C	.	.	I	π-helix	trans	-114.3	-48.6	179.9	-172.8	0	0	0	0	111.1	Y133 M140 M164 A189 L198	Y133-V137 HydrophobicContact CD1-CB 4.31Å; Y133-V137 HydrophobicContact CD2-CB 4.37Å; Y133-V137 HydrophobicContact CD2-CG2 3.72Å; Y133-V137 HydrophobicContact CE1-CB 4.12Å; Y133-V137 HydrophobicContact CE1-CG1 4.26Å; Y133-V137 HydrophobicContact CE1-CG2 4.46Å; Y133-V137 HydrophobicContact CE2-CB 4.2Å; Y133-V137 HydrophobicContact CE2-CG1 4.37Å; Y133-V137 HydrophobicContact CE2-CG2 3.68Å; Y133-V137 HydrophobicContact CG-CB 4.45Å; Y133-V137 HydrophobicContact CG-CG2 4.17Å; Y133-V137 WeakPolarHBondContact O-CA 3.03Å; Y133-V137 WeakPolarHBondContact O-CB 3.37Å; Y133-V137 PolarHBondContact O-N 2.97Å; V137-M140 HydrophobicContact CG1-CE 4.3Å; V137-M140 WeakPolarHBondContact O-CE 3.01Å; V137-M164 HydrophobicContact CG1-CE 4.33Å; V137-A189 HydrophobicContact CG1-CB 3.75Å; V137-A189 HydrophobicContact CG2-CB 4.47Å; V137-L198 HydrophobicContact CG2-CB 4.33Å; V137-L198 HydrophobicContact CG2-CD1 4.31Å; V137-L198 HydrophobicContact CG2-CD2 4.27Å
138	G	95.7	Very high	97.1	Very high	56 Å²	56	45.4 Å²	45.4	58%	0.577	25%	0.25	S	S	*	.	I	π-helix	trans	-69.6	-45.4	179.4	0	0	0	0	0	112.6	Y133 V134	Y133-G138 PolarHBondContact O-N 3.1Å; V134-G138 CarbonylContact O-C 3.57Å; V134-G138 WeakPolarHBondContact O-CA 3.43Å; V134-G138 PolarHBondContact O-N 3.24Å
139	N	97.5	Very high	97	Very high	54 Å²	54	40.8 Å²	40.8	29%	0.289	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.7	27.9	-174.5	-56.6	-24	0	0	0	113.1	V134 E135 E141 Q142	V134-N139 PolarHBondContact O-N 3.38Å; E135-N139 CarbonylContact O-C 3.44Å; E135-N139 PolarHBondContact OE2-ND2 3.19Å; N139-E141 PolarHBondContact O-N 3.26Å; N139-Q142 WeakPolarHBondContact O-CB 3.22Å; N139-Q142 PolarHBondContact O-N 3.01Å; N139-Q142 PolarHBondContact O-OE1 2.89Å
140	M	97.5	Very high	97	Very high	1 Å²	1	41 Å²	41	1%	0.005	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-64.7	-26.5	-173	70.7	170.6	63.2	0	0	113.8	V137 Q142 M143 V153 I155 M164 T166 L198	V137-M140 HydrophobicContact CG1-CE 4.3Å; V137-M140 WeakPolarHBondContact O-CE 3.01Å; M140-Q142 PolarHBondContact O-N 3.36Å; M140-M143 VanDerWaalsContact O-CB 3.22Å; M140-M143 WeakPolarHBondContact O-CB 3.25Å; M140-M143 PolarHBondContact O-N 3.39Å; M140-V153 HydrophobicContact CG-CG1 4.33Å; M140-V153 WeakPolarHBondContact O-CB 3.43Å; M140-I155 HydrophobicContact CG-CD1 4.1Å; M140-I155 HydrophobicContact CG-CG1 4.31Å; M140-I155 HydrophobicContact SD-CD1 4.17Å; M140-I155 HydrophobicContact SD-CG1 4.1Å; M140-M164 HydrophobicContact CE-CE 4.1Å; M140-M164 HydrophobicContact CE-SD 3.31Å; M140-M164 WeakPolarHBondContact CE-SD 3.24Å; M140-M164 HydrophobicContact SD-SD 3.63Å; M140-M164 VanDerWaalsContact SD-SD 3.63Å; M140-T166 HydrophobicContact SD-CG2 3.81Å; M140-L198 HydrophobicContact CE-CD1 4.5Å
141	E	98.3	Very high	97.1	Very high	86 Å²	86	45.3 Å²	45.3	40%	0.402	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-70.4	-21.4	176.7	-64.1	-171	115	0	0	112.1	N139 M143 V153 K154 I155	N139-E141 PolarHBondContact O-N 3.26Å; E141-M143 VanDerWaalsContact C-N 3.29Å; E141-V153 WeakPolarHBondContact CA-O 3.49Å; E141-K154 WeakPolarHBondContact OE1-CA 3.41Å; E141-I155 HydrophobicContact CG-CD1 4.09Å; E141-I155 HydrophobicContact CG-CG1 3.89Å; E141-I155 PolarHBondContact OE1-N 3.32Å
142	Q	97.9	Very high	97.2	Very high	73 Å²	73	45.8 Å²	45.8	34%	0.341	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-85.5	2.8	174.6	-64.3	74.4	24.1	0	0	112.9	N139 M140 G144 D145	N139-Q142 WeakPolarHBondContact O-CB 3.22Å; N139-Q142 PolarHBondContact O-N 3.01Å; N139-Q142 PolarHBondContact O-OE1 2.89Å; M140-Q142 PolarHBondContact O-N 3.36Å; Q142-G144 PolarHBondContact O-N 3.31Å; Q142-D145 VanDerWaalsContact O-CB 3.3Å; Q142-D145 WeakPolarHBondContact O-CB 3.29Å; Q142-D145 PolarHBondContact O-N 3.46Å
143	M	98	Very high	97.2	Very high	16 Å²	16	46 Å²	46	8%	0.079	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-58.8	-33.7	-176.8	-173.4	172.1	-62.3	0	0	112.9	L136 M140 E141 D145 W146 N147 V150 V153 F266	L136-M143 HydrophobicContact CD2-CE 4.3Å; M140-M143 VanDerWaalsContact O-CB 3.22Å; M140-M143 WeakPolarHBondContact O-CB 3.25Å; M140-M143 PolarHBondContact O-N 3.39Å; E141-M143 VanDerWaalsContact C-N 3.29Å; M143-D145 PolarHBondContact O-N 3.5Å; M143-W146 HydrophobicContact CB-CZ2 4.38Å; M143-W146 HydrophobicContact CE-CZ2 4.35Å; M143-W146 HydrophobicContact CG-CH2 4.18Å; M143-W146 HydrophobicContact CG-CZ2 3.79Å; M143-W146 PolarHBondContact O-N 2.89Å; M143-N147 HydrophobicContact CG-CB 3.98Å; M143-N147 VanDerWaalsContact O-CB 3.27Å; M143-N147 WeakPolarHBondContact O-CB 3.39Å; M143-N147 PolarHBondContact O-N 3.47Å; M143-V150 HydrophobicContact CB-CG1 4.46Å; M143-V150 HydrophobicContact CG-CB 4.35Å; M143-V150 HydrophobicContact CG-CG1 4.32Å; M143-V150 HydrophobicContact CG-CG2 4.34Å; M143-V150 HydrophobicContact SD-CG2 4.06Å; M143-V153 HydrophobicContact CB-CG2 4.18Å; M143-F266 HydrophobicContact SD-CE2 4.37Å
144	G	97.2	Very high	97.3	Very high	26 Å²	26	47.9 Å²	47.9	27%	0.268	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-66.5	-17.1	177.5	0	0	0	0	0	114.5	Q142 W146 V150	Q142-G144 PolarHBondContact O-N 3.31Å; G144-W146 VanDerWaalsContact C-N 3.3Å; G144-W146 PolarHBondContact O-N 3.09Å; G144-V150 WeakPolarHBondContact CA-O 3.4Å
145	D	97	Very high	97.3	Very high	129 Å²	129	45.6 Å²	45.6	69%	0.69	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-74.5	-23.4	179.8	-60.4	-24	0	0	0	112.3	Q142 M143	Q142-D145 VanDerWaalsContact O-CB 3.3Å; Q142-D145 WeakPolarHBondContact O-CB 3.29Å; Q142-D145 PolarHBondContact O-N 3.46Å; M143-D145 PolarHBondContact O-N 3.5Å
146	W	97	Very high	97.4	Very high	25 Å²	25	47.5 Å²	47.5	10%	0.095	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-14.1	-174.3	61	-98.9	0	0	0	114.5	E135 L136 M143 G144 P148 F266 H269 L270 R273	E135-W146 PolarHBondContact OE1-NE1 2.68Å; L136-W146 HydrophobicContact CD2-CH2 4.22Å; L136-W146 HydrophobicContact CD2-CZ2 4.25Å; M143-W146 HydrophobicContact CB-CZ2 4.38Å; M143-W146 HydrophobicContact CE-CZ2 4.35Å; M143-W146 HydrophobicContact CG-CH2 4.18Å; M143-W146 HydrophobicContact CG-CZ2 3.79Å; M143-W146 PolarHBondContact O-N 2.89Å; G144-W146 VanDerWaalsContact C-N 3.3Å; G144-W146 PolarHBondContact O-N 3.09Å; W146-P148 WeakPolarHBondContact O-CD 3.41Å; W146-F266 HydrophobicContact CH2-CD2 4.43Å; W146-F266 AromaticContact CH2-CE2 3.81Å; W146-F266 HydrophobicContact CH2-CE2 3.81Å; W146-F266 HydrophobicContact CH2-CZ 4.22Å; W146-F266 HydrophobicContact CZ3-CE2 4.36Å; W146-H269 HydrophobicContact CE3-CB 3.91Å; W146-H269 HydrophobicContact CZ3-CB 4.1Å; W146-L270 HydrophobicContact CH2-CB 4.33Å; W146-L270 HydrophobicContact CH2-CD1 4.07Å; W146-L270 HydrophobicContact CZ2-CD1 4.49Å; W146-L270 HydrophobicContact CZ3-CB 4.07Å; W146-L270 HydrophobicContact CZ3-CD1 4.47Å; W146-R273 HydrophobicContact CB-CB 4.16Å; W146-R273 HydrophobicContact CB-CG 4.21Å; W146-R273 HydrophobicContact CD2-CB 3.98Å; W146-R273 HydrophobicContact CD2-CG 3.9Å; W146-R273 HydrophobicContact CE3-CB 4.15Å; W146-R273 HydrophobicContact CG-CB 3.99Å; W146-R273 HydrophobicContact CG-CG 3.72Å
147	N	97.1	Very high	97.4	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.027	27%	0.267	C	S	.	.			trans	-112.5	100.2	177.5	-178.5	6.3	0	0	0	111	M143 N149 V150	M143-N147 HydrophobicContact CG-CB 3.98Å; M143-N147 VanDerWaalsContact O-CB 3.27Å; M143-N147 WeakPolarHBondContact O-CB 3.39Å; M143-N147 PolarHBondContact O-N 3.47Å; N147-N149 PolarHBondContact O-N 2.91Å; N147-N149 WeakPolarHBondContact OD1-CB 3.45Å; N147-N149 PolarHBondContact OD1-N 3.43Å; N147-N149 VanDerWaalsContact OD1-N 3.16Å; N147-V150 HydrophobicContact CB-CB 4.47Å; N147-V150 WeakPolarHBondContact ND2-CG2 3.43Å; N147-V150 PolarHBondContact O-N 2.92Å
148	P	95.9	Very high	97.4	Very high	78 Å²	78	55.9 Å²	55.9	51%	0.506	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.3	-179.7	-25.3	34.8	0	0	0	115.2	W146 V150 H269	W146-P148 WeakPolarHBondContact O-CD 3.41Å; P148-V150 PolarHBondContact O-N 2.77Å; P148-H269 WeakPolarHBondContact CD-NE2 3.39Å
149	N	94.9	Very high	97.5	Very high	30 Å²	30	53.3 Å²	53.3	16%	0.16	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-7.3	175.7	-67.2	-44.7	0	0	0	112.8	N147 G171 T262	N147-N149 PolarHBondContact O-N 2.91Å; N147-N149 WeakPolarHBondContact OD1-CB 3.45Å; N147-N149 PolarHBondContact OD1-N 3.43Å; N147-N149 VanDerWaalsContact OD1-N 3.16Å; N149-G171 VanDerWaalsContact C-N 3.34Å; N149-G171 PolarHBondContact O-N 3.46Å; N149-T262 HydrophobicContact CB-CG2 4.39Å
150	V	97	Very high	97.3	Very high	8 Å²	8	52.4 Å²	52.4	5%	0.048	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	121.7	179	174.8	0	0	0	0	108	M143 G144 N147 P148 V153 E168	M143-V150 HydrophobicContact CB-CG1 4.46Å; M143-V150 HydrophobicContact CG-CB 4.35Å; M143-V150 HydrophobicContact CG-CG1 4.32Å; M143-V150 HydrophobicContact CG-CG2 4.34Å; M143-V150 HydrophobicContact SD-CG2 4.06Å; G144-V150 WeakPolarHBondContact CA-O 3.4Å; N147-V150 HydrophobicContact CB-CB 4.47Å; N147-V150 WeakPolarHBondContact ND2-CG2 3.43Å; N147-V150 PolarHBondContact O-N 2.92Å; P148-V150 PolarHBondContact O-N 2.77Å; V150-V153 HydrophobicContact CG1-CG2 3.58Å; V150-E168 HydrophobicContact CG1-CG 4.27Å
151	K	97.3	Very high	97.1	Very high	158 Å²	158	61.2 Å²	61.2	69%	0.687	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	-43.9	175.9	-179.3	-179.1	176.5	-175.9	0	111.2	V169	K151-V169 HydrophobicContact CB-CB 4.27Å; K151-V169 HydrophobicContact CB-CG1 4.16Å; K151-V169 WeakPolarHBondContact CB-O 3.32Å; K151-V169 HydrophobicContact CD-CG1 4.06Å; K151-V169 PolarHBondContact N-O 2.87Å
152	E	97.8	Very high	97	Very high	73 Å²	73	60.8 Å²	60.8	34%	0.341	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	143.5	-174.8	-171.3	178.5	-125	0	0	109.7	K154 E168 V169	E152-K154 HydrophobicContact CG-CG 4.13Å; E152-K154 WeakPolarHBondContact OE1-CE 3.46Å; E152-K154 IonicContact OE1-NZ 2.71Å; E152-K154 PolarHBondContact OE1-NZ 2.98Å; E152-K154 WeakPolarHBondContact OE2-CE 3.48Å; E152-K154 IonicContact OE2-NZ 2.72Å; E152-K154 PolarHBondContact OE2-NZ 3.05Å; E152-E168 CarbonylContact O-C 3.54Å; E152-E168 WeakPolarHBondContact O-CA 3.29Å; E152-V169 HydrophobicContact CB-CB 4.45Å; E152-V169 PolarHBondContact N-O 3.21Å; E152-V169 PolarHBondContact O-N 2.88Å
153	V	98.6	Very high	97	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.2	166.2	178.8	0	0	0	0	107.5	M140 E141 M143 V150 H167 E168	M140-V153 HydrophobicContact CG-CG1 4.33Å; M140-V153 WeakPolarHBondContact O-CB 3.43Å; E141-V153 WeakPolarHBondContact CA-O 3.49Å; M143-V153 HydrophobicContact CB-CG2 4.18Å; V150-V153 HydrophobicContact CG1-CG2 3.58Å; V153-H167 CarbonylContact C-O 3.58Å; V153-H167 WeakPolarHBondContact CA-O 3.49Å; V153-E168 HydrophobicContact CG2-CB 4.4Å; V153-E168 HydrophobicContact CG2-CG 4.04Å
154	K	98.4	Very high	97	Very high	86 Å²	86	57.5 Å²	57.5	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.6	174.8	-71.6	-176.9	169.5	133.7	0	110.5	E141 E152 L156 T166 H167	E141-K154 WeakPolarHBondContact OE1-CA 3.41Å; E152-K154 HydrophobicContact CG-CG 4.13Å; E152-K154 WeakPolarHBondContact OE1-CE 3.46Å; E152-K154 IonicContact OE1-NZ 2.71Å; E152-K154 PolarHBondContact OE1-NZ 2.98Å; E152-K154 WeakPolarHBondContact OE2-CE 3.48Å; E152-K154 IonicContact OE2-NZ 2.72Å; E152-K154 PolarHBondContact OE2-NZ 3.05Å; K154-L156 PolarHBondContact O-N 2.85Å; K154-T166 CarbonylContact O-C 3.57Å; K154-T166 VanDerWaalsContact O-CA 3.26Å; K154-T166 WeakPolarHBondContact O-CA 3.2Å; K154-H167 PolarHBondContact N-O 3.35Å; K154-H167 PolarHBondContact O-N 3.02Å
155	I	98.5	Very high	97.1	Very high	33 Å²	33	56.2 Å²	56.2	17%	0.169	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	109.9	168.9	-60.5	172.5	0	0	0	107.8	M140 E141 K158 M164 T166	M140-I155 HydrophobicContact CG-CD1 4.1Å; M140-I155 HydrophobicContact CG-CG1 4.31Å; M140-I155 HydrophobicContact SD-CD1 4.17Å; M140-I155 HydrophobicContact SD-CG1 4.1Å; E141-I155 HydrophobicContact CG-CD1 4.09Å; E141-I155 HydrophobicContact CG-CG1 3.89Å; E141-I155 PolarHBondContact OE1-N 3.32Å; I155-K158 HydrophobicContact CG2-CD 4.45Å; I155-K158 HydrophobicContact CG2-CG 3.63Å; I155-M164 HydrophobicContact CD1-SD 4.26Å; I155-M164 HydrophobicContact CG2-CB 4.23Å; I155-T166 HydrophobicContact CG1-CG2 4.28Å
156	L	98.4	Very high	97.2	Very high	43 Å²	43	50.1 Å²	50.1	23%	0.225	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	-37.7	179.4	-59.6	-177.8	0	0	0	112.1	K154 V165 H167 V184 H205 M208	K154-L156 PolarHBondContact O-N 2.85Å; L156-V165 HydrophobicContact CD1-CG1 4.23Å; L156-V165 PolarHBondContact N-O 2.8Å; L156-H167 HydrophobicContact CD1-CB 4.01Å; L156-H167 HydrophobicContact CD2-CB 3.86Å; L156-H167 HydrophobicContact CG-CB 3.96Å; L156-V184 HydrophobicContact CD1-CG1 4.35Å; L156-H205 HydrophobicContact CD1-CB 3.8Å; L156-M208 HydrophobicContact CD1-CB 3.55Å; L156-M208 HydrophobicContact CD1-CG 4.04Å; L156-M208 HydrophobicContact CD2-CB 4.49Å; L156-M208 HydrophobicContact CD2-CE 3.76Å
157	Q	98	Very high	97.2	Very high	45 Å²	45	49.6 Å²	49.6	21%	0.21	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	136.8	-178	-172	179	3.9	0	0	109.4	E71 I159 M164 V165 H205	E71-Q157 PolarHBondContact OE1-NE2 3.2Å; Q157-I159 HydrophobicContact CB-CD1 4.26Å; Q157-I159 HydrophobicContact CG-CD1 3.85Å; Q157-I159 HydrophobicContact CG-CG1 4.09Å; Q157-M164 CarbonylContact O-C 3.57Å; Q157-M164 WeakPolarHBondContact O-CA 3.32Å; Q157-M164 WeakPolarHBondContact O-CB 3.38Å; Q157-V165 HydrophobicContact CB-CB 4.39Å; Q157-V165 PolarHBondContact N-O 3.23Å; Q157-V165 PolarHBondContact O-N 3.17Å; Q157-H205 PolarHBondContact OE1-NE2 3.45Å
158	K	97.8	Very high	97.3	Very high	145 Å²	145	51 Å²	51	63%	0.63	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.4	166.1	-66.6	-174.7	178.2	179.2	0	108.4	I155 M164	I155-K158 HydrophobicContact CG2-CD 4.45Å; I155-K158 HydrophobicContact CG2-CG 3.63Å; K158-M164 HydrophobicContact CG-CB 4.47Å
159	I	97.4	Very high	97.4	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	100.4	178	-54.3	94.2	0	0	0	107.5	Y67 E71 Y74 V75 Q157 T163 V165	Y67-I159 HydrophobicContact CD1-CG2 4.01Å; Y67-I159 HydrophobicContact CD2-CG2 4.44Å; Y67-I159 HydrophobicContact CE1-CG2 3.69Å; Y67-I159 HydrophobicContact CE2-CG2 4.16Å; Y67-I159 HydrophobicContact CG-CG2 4.36Å; E71-I159 HydrophobicContact CB-CG1 4.34Å; E71-I159 HydrophobicContact CB-CG2 3.84Å; E71-I159 HydrophobicContact CG-CG1 3.97Å; E71-I159 HydrophobicContact CG-CG2 4.16Å; Y74-I159 HydrophobicContact CD2-CD1 4.17Å; V75-I159 HydrophobicContact CG2-CB 4.44Å; V75-I159 HydrophobicContact CG2-CG2 3.68Å; Q157-I159 HydrophobicContact CB-CD1 4.26Å; Q157-I159 HydrophobicContact CG-CD1 3.85Å; Q157-I159 HydrophobicContact CG-CG1 4.09Å; I159-T163 CarbonylContact C-O 3.53Å; I159-T163 HydrophobicContact CB-CG2 4.32Å; I159-T163 HydrophobicContact CD1-CG2 4.23Å; I159-T163 PolarHBondContact N-O 2.81Å; I159-T163 WeakPolarHBondContact O-CB 3.25Å; I159-T163 PolarHBondContact O-N 3.49Å; I159-T163 VanDerWaalsContact O-O 3.09Å; I159-V165 HydrophobicContact CD1-CG2 4.06Å
160	G	94.3	Very high	97.5	Very high	36 Å²	36	48.4 Å²	48.4	37%	0.371	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.6	-147.8	-171.8	0	0	0	0	0	112.9	Y67	Y67-G160 WeakPolarHBondContact OH-CA 3.42Å; Y67-G160 PolarHBondContact OH-N 3.28Å
161	Q	92.6	Very high	97.4	Very high	186 Å²	186	48.4 Å²	48.4	87%	0.869	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-26.7	-177.7	-65.8	-174.8	-21.3	0	0	113.7
162	E	95.2	Very high	97.1	Very high	77 Å²	77	45.6 Å²	45.6	36%	0.36	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	-23.7	-168.5	-62.2	-167.4	141.6	0	0	113.4	C188 A189 K190	E162-C188 CarbonylContact O-C 3.6Å; E162-C188 WeakPolarHBondContact O-CA 3.4Å; E162-A189 VanDerWaalsContact CB-O 3.29Å; E162-A189 WeakPolarHBondContact CB-O 3.5Å; E162-A189 WeakPolarHBondContact CG-O 3.36Å; E162-A189 PolarHBondContact O-N 3.33Å; E162-K190 WeakPolarHBondContact OE2-CD 3.4Å; E162-K190 WeakPolarHBondContact OE2-CE 3.5Å; E162-K190 IonicContact OE2-NZ 2.68Å; E162-K190 PolarHBondContact OE2-NZ 2.9Å
163	T	98.3	Very high	96.5	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.037	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	139.8	-171.1	-57.6	0	0	0	0	111.3	V75 I159 V186 R187	V75-T163 HydrophobicContact CG2-CG2 4.23Å; I159-T163 CarbonylContact C-O 3.53Å; I159-T163 HydrophobicContact CB-CG2 4.32Å; I159-T163 HydrophobicContact CD1-CG2 4.23Å; I159-T163 PolarHBondContact N-O 2.81Å; I159-T163 WeakPolarHBondContact O-CB 3.25Å; I159-T163 PolarHBondContact O-N 3.49Å; I159-T163 VanDerWaalsContact O-O 3.09Å; T163-V186 HydrophobicContact CG2-CG2 3.83Å; T163-R187 WeakPolarHBondContact CA-O 3.28Å
164	M	98.3	Very high	95.7	Very high	13 Å²	13	47.9 Å²	47.9	6%	0.064	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	153.1	174	63.4	-162.5	81.5	0	0	111.1	V137 M140 I155 Q157 K158 T166 V186 R187	V137-M164 HydrophobicContact CG1-CE 4.33Å; M140-M164 HydrophobicContact CE-CE 4.1Å; M140-M164 HydrophobicContact CE-SD 3.31Å; M140-M164 WeakPolarHBondContact CE-SD 3.24Å; M140-M164 HydrophobicContact SD-SD 3.63Å; M140-M164 VanDerWaalsContact SD-SD 3.63Å; I155-M164 HydrophobicContact CD1-SD 4.26Å; I155-M164 HydrophobicContact CG2-CB 4.23Å; Q157-M164 CarbonylContact O-C 3.57Å; Q157-M164 WeakPolarHBondContact O-CA 3.32Å; Q157-M164 WeakPolarHBondContact O-CB 3.38Å; K158-M164 HydrophobicContact CG-CB 4.47Å; M164-T166 HydrophobicContact CG-CG2 4.12Å; M164-T166 HydrophobicContact SD-CG2 4.48Å; M164-V186 CarbonylContact O-C 3.59Å; M164-V186 WeakPolarHBondContact O-CA 3.33Å; M164-R187 HydrophobicContact CG-CB 3.92Å; M164-R187 PolarHBondContact N-O 3.03Å; M164-R187 PolarHBondContact O-N 2.86Å
165	V	98.8	Very high	95	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.6	169.5	-174.4	0	0	0	0	108	Y74 L156 Q157 I159 V184 S185 T203 H205	Y74-V165 HydrophobicContact CD1-CG2 3.76Å; Y74-V165 HydrophobicContact CD2-CG2 3.9Å; Y74-V165 HydrophobicContact CE1-CG2 3.88Å; Y74-V165 HydrophobicContact CE2-CG2 4.01Å; Y74-V165 HydrophobicContact CG-CG2 3.79Å; L156-V165 HydrophobicContact CD1-CG1 4.23Å; L156-V165 PolarHBondContact N-O 2.8Å; Q157-V165 HydrophobicContact CB-CB 4.39Å; Q157-V165 PolarHBondContact N-O 3.23Å; Q157-V165 PolarHBondContact O-N 3.17Å; I159-V165 HydrophobicContact CD1-CG2 4.06Å; V165-V184 HydrophobicContact CG1-CG1 4.06Å; V165-S185 WeakPolarHBondContact CA-O 3.42Å; V165-T203 HydrophobicContact CG1-CG2 3.79Å; V165-H205 HydrophobicContact CG1-CB 4.09Å
166	T	98.7	Very high	94.4	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	145.9	-175.8	54.1	0	0	0	0	111	M140 K154 I155 M164 V184 S185 R187	M140-T166 HydrophobicContact SD-CG2 3.81Å; K154-T166 CarbonylContact O-C 3.57Å; K154-T166 VanDerWaalsContact O-CA 3.26Å; K154-T166 WeakPolarHBondContact O-CA 3.2Å; I155-T166 HydrophobicContact CG1-CG2 4.28Å; M164-T166 HydrophobicContact CG-CG2 4.12Å; M164-T166 HydrophobicContact SD-CG2 4.48Å; T166-V184 WeakPolarHBondContact O-CA 3.31Å; T166-S185 PolarHBondContact N-O 3.01Å; T166-S185 PolarHBondContact O-N 2.92Å; T166-S185 PolarHBondContact OG1-O 2.86Å; T166-S185 VanDerWaalsContact OG1-O 3.1Å; T166-R187 HydrophobicContact CG2-CG 4.38Å; T166-R187 PolarHBondContact OG1-NE 3.33Å; T166-R187 VanDerWaalsContact OG1-NE 3.11Å
167	H	98.7	Very high	93.9	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.065	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	128.2	163.2	179.9	-122.2	0	0	0	108.5	V153 K154 L156 D182 F183 M208	V153-H167 CarbonylContact C-O 3.58Å; V153-H167 WeakPolarHBondContact CA-O 3.49Å; K154-H167 PolarHBondContact N-O 3.35Å; K154-H167 PolarHBondContact O-N 3.02Å; L156-H167 HydrophobicContact CD1-CB 4.01Å; L156-H167 HydrophobicContact CD2-CB 3.86Å; L156-H167 HydrophobicContact CG-CB 3.96Å; H167-D182 IonicContact CD2-OD2 3.21Å; H167-D182 IonicContact CE1-OD2 2.62Å; H167-D182 WeakPolarHBondContact NE2-CB 3.43Å; H167-D182 IonicContact NE2-OD2 2.71Å; H167-D182 PolarHBondContact NE2-OD2 3.09Å; H167-F183 CarbonylContact C-O 3.58Å; H167-F183 VanDerWaalsContact CA-O 3.27Å; H167-F183 WeakPolarHBondContact CA-O 3.44Å; H167-F183 PolarHBondContact CD2-O 3.47Å; H167-M208 HydrophobicContact CB-CE 4.39Å; H167-M208 HydrophobicContact CB-CG 4.23Å
168	E	98.5	Very high	93.5	Very high	34 Å²	34	51.8 Å²	51.8	16%	0.159	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.4	178.8	176.7	177	147.7	0	0	109.4	V150 E152 V153 D182 F183 R187	V150-E168 HydrophobicContact CG1-CG 4.27Å; E152-E168 CarbonylContact O-C 3.54Å; E152-E168 WeakPolarHBondContact O-CA 3.29Å; V153-E168 HydrophobicContact CG2-CB 4.4Å; V153-E168 HydrophobicContact CG2-CG 4.04Å; E168-D182 CarbonylContact O-C 2.98Å; E168-D182 WeakPolarHBondContact O-CA 3.38Å; E168-D182 WeakPolarHBondContact O-CB 3.16Å; E168-F183 HydrophobicContact CB-CB 4.38Å; E168-F183 PolarHBondContact N-O 3.11Å; E168-F183 PolarHBondContact O-N 3.2Å; E168-R187 IonicContact OE2-CZ 3.97Å; E168-R187 IonicContact OE2-NH2 2.71Å; E168-R187 PolarHBondContact OE2-NH2 3.08Å
169	V	98.1	Very high	93.1	Very high	24 Å²	24	46.4 Å²	46.4	15%	0.145	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.5	176	-175.8	0	0	0	0	108.5	K151 E152 D182	K151-V169 HydrophobicContact CB-CB 4.27Å; K151-V169 HydrophobicContact CB-CG1 4.16Å; K151-V169 WeakPolarHBondContact CB-O 3.32Å; K151-V169 HydrophobicContact CD-CG1 4.06Å; K151-V169 PolarHBondContact N-O 2.87Å; E152-V169 HydrophobicContact CB-CB 4.45Å; E152-V169 PolarHBondContact N-O 3.21Å; E152-V169 PolarHBondContact O-N 2.88Å; V169-D182 HydrophobicContact CG2-CB 4.33Å
170	S	96.3	Very high	93	Very high	30 Å²	30	50 Å²	50	21%	0.21	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	141	179.1	68.5	0	0	0	0	111.1	R181	S170-R181 PolarHBondContact N-O 2.93Å; S170-R181 PolarHBondContact OG-N 2.82Å; S170-R181 VanDerWaalsContact OG-N 3.15Å; S170-R181 PolarHBondContact OG-O 2.8Å; S170-R181 VanDerWaalsContact OG-O 3.1Å
171	G	94.7	Very high	93.1	Very high	7 Å²	7	49.4 Å²	49.4	7%	0.072	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-65.8	172	163.5	0	0	0	0	0	112.3	N149	N149-G171 VanDerWaalsContact C-N 3.34Å; N149-G171 PolarHBondContact O-N 3.46Å
172	P	91	Very high	93.4	Very high	99 Å²	99	40.6 Å²	40.6	64%	0.643	26%	0.261	S	S	*	.	P	Polyproline II helix	trans	-66.2	137.9	175.9	29.1	-33.6	0	0	0	110.6
173	T	86.1	Confident	93.5	Very high	23 Å²	23	37.5 Å²	37.5	14%	0.141	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-82.4	154.2	170.9	54.4	0	0	0	0	110.8	G175 N176 V177 V178 V258	T173-G175 PolarHBondContact O-N 3.44Å; T173-N176 WeakPolarHBondContact O-CA 3.46Å; T173-N176 PolarHBondContact O-N 3.22Å; T173-V177 PolarHBondContact OG1-N 3.39Å; T173-V178 HydrophobicContact CG2-CB 3.91Å; T173-V178 HydrophobicContact CG2-CG2 4.36Å; T173-V178 PolarHBondContact OG1-N 2.89Å; T173-V178 PolarHBondContact OG1-O 3.33Å; T173-V178 VanDerWaalsContact OG1-O 3.04Å; T173-V258 HydrophobicContact CG2-CG1 4.37Å
174	P	80.8	Confident	93.6	Very high	101 Å²	101	37.2 Å²	37.2	66%	0.656	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-52.3	125.2	176.7	-28.2	35.3	0	0	0	112.1	N176 V177	P174-N176 PolarHBondContact O-N 3.4Å; P174-V177 WeakPolarHBondContact O-CG2 3.33Å
175	G	84.1	Confident	93.6	Very high	76 Å²	76	36.8 Å²	36.8	78%	0.784	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	66.4	13	-177.2	0	0	0	0	0	115.1	T173 V177	T173-G175 PolarHBondContact O-N 3.44Å; G175-V177 PolarHBondContact O-N 2.62Å
176	N	85.8	Confident	93.6	Very high	121 Å²	121	36.8 Å²	36.8	65%	0.647	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	54.9	32.3	-176.1	-59.3	-49.4	0	0	0	113.8	T173 P174 V178	T173-N176 WeakPolarHBondContact O-CA 3.46Å; T173-N176 PolarHBondContact O-N 3.22Å; P174-N176 PolarHBondContact O-N 3.4Å; N176-V178 PolarHBondContact O-N 2.94Å
177	V	87.7	Confident	93.6	Very high	83 Å²	83	38 Å²	38	50%	0.503	25%	0.247	S	C	.	.			trans	-63	-23.7	-178.7	-66.3	0	0	0	0	113.1	T173 P174 G175 V258	T173-V177 PolarHBondContact OG1-N 3.39Å; P174-V177 WeakPolarHBondContact O-CG2 3.33Å; G175-V177 PolarHBondContact O-N 2.62Å; V177-V258 HydrophobicContact CG2-CG2 4.3Å
178	V	89.5	Confident	93.6	Very high	10 Å²	10	37.4 Å²	37.4	6%	0.061	24%	0.244	C	C	.	.	S	Bend	trans	-121.1	123.4	169.6	-176.4	0	0	0	0	108.3	T173 N176 L246 I250	T173-V178 HydrophobicContact CG2-CB 3.91Å; T173-V178 HydrophobicContact CG2-CG2 4.36Å; T173-V178 PolarHBondContact OG1-N 2.89Å; T173-V178 PolarHBondContact OG1-O 3.33Å; T173-V178 VanDerWaalsContact OG1-O 3.04Å; N176-V178 PolarHBondContact O-N 2.94Å; V178-L246 HydrophobicContact CG1-CD1 4.37Å; V178-L246 HydrophobicContact CG2-CD1 4.36Å; V178-I250 HydrophobicContact CB-CD1 4.44Å; V178-I250 HydrophobicContact CG1-CD1 3.79Å; V178-I250 HydrophobicContact CG2-CD1 4.07Å
179	G	90.6	Very high	93.6	Very high	31 Å²	31	35.9 Å²	35.9	32%	0.32	24%	0.237	S	C	.	.			trans	-68.2	176.5	175.8	0	0	0	0	0	113.1	R181	G179-R181 WeakPolarHBondContact O-CD 3.4Å; G179-R181 PolarHBondContact O-N 2.94Å; G179-R181 PolarHBondContact O-NH1 3.27Å
180	P	94.6	Very high	93.5	Very high	79 Å²	79	36.8 Å²	36.8	51%	0.513	24%	0.24	S	C	.	.			trans	-58.4	128.7	-172.3	-23.8	33.7	0	0	0	113.8	V214 V215	P180-V214 HydrophobicContact CB-CG1 4.42Å; P180-V214 HydrophobicContact CB-CG2 4.31Å; P180-V215 PolarHBondContact O-N 2.89Å
181	R	97	Very high	93.5	Very high	22 Å²	22	40.5 Å²	40.5	8%	0.083	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.2	173.7	-89	63.8	-175.2	149.7	3.2	110.7	S170 G179 F183 V215 A217 L246 K247	S170-R181 PolarHBondContact N-O 2.93Å; S170-R181 PolarHBondContact OG-N 2.82Å; S170-R181 VanDerWaalsContact OG-N 3.15Å; S170-R181 PolarHBondContact OG-O 2.8Å; S170-R181 VanDerWaalsContact OG-O 3.1Å; G179-R181 WeakPolarHBondContact O-CD 3.4Å; G179-R181 PolarHBondContact O-N 2.94Å; G179-R181 PolarHBondContact O-NH1 3.27Å; R181-F183 HydrophobicContact CB-CE2 4.26Å; R181-V215 WeakPolarHBondContact CA-O 3.39Å; R181-V215 HydrophobicContact CG-CB 4.33Å; R181-A217 HydrophobicContact CB-CB 4.01Å; R181-A217 HydrophobicContact CG-CB 3.62Å; R181-L246 HydrophobicContact CG-CD2 4.42Å; R181-L246 PolarHBondContact NE-O 2.98Å; R181-K247 PolarHBondContact NH2-O 3.49Å
182	D	98.2	Very high	93.4	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	162.2	162.4	76.5	-18.7	0	0	0	111	H167 E168 V169 V214 V215 R216 A217	H167-D182 IonicContact CD2-OD2 3.21Å; H167-D182 IonicContact CE1-OD2 2.62Å; H167-D182 WeakPolarHBondContact NE2-CB 3.43Å; H167-D182 IonicContact NE2-OD2 2.71Å; H167-D182 PolarHBondContact NE2-OD2 3.09Å; E168-D182 CarbonylContact O-C 2.98Å; E168-D182 WeakPolarHBondContact O-CA 3.38Å; E168-D182 WeakPolarHBondContact O-CB 3.16Å; V169-D182 HydrophobicContact CG2-CB 4.33Å; D182-V214 HydrophobicContact CB-CG1 3.75Å; D182-V215 PolarHBondContact N-O 3.34Å; D182-R216 VanDerWaalsContact CG-NE 3.33Å; D182-R216 CarbonylContact O-C 3.5Å; D182-R216 WeakPolarHBondContact O-CA 3.39Å; D182-R216 WeakPolarHBondContact OD1-CA 3.42Å; D182-R216 IonicContact OD1-CZ 2.78Å; D182-R216 IonicContact OD1-NE 2.84Å; D182-R216 PolarHBondContact OD1-NE 2.9Å; D182-R216 IonicContact OD1-NH2 3.87Å; D182-R216 IonicContact OD2-CZ 2.9Å; D182-R216 IonicContact OD2-NE 3.76Å; D182-R216 PolarHBondContact OD2-NE 3.4Å; D182-R216 IonicContact OD2-NH2 2.7Å; D182-R216 PolarHBondContact OD2-NH2 3.37Å; D182-A217 PolarHBondContact O-N 3.16Å
183	F	98.6	Very high	93.6	Very high	12 Å²	12	48.8 Å²	48.8	5%	0.053	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	136.3	-179.6	-57.6	-96.5	0	0	0	108.5	H167 E168 R181 A217 I244 L246	H167-F183 CarbonylContact C-O 3.58Å; H167-F183 VanDerWaalsContact CA-O 3.27Å; H167-F183 WeakPolarHBondContact CA-O 3.44Å; H167-F183 PolarHBondContact CD2-O 3.47Å; E168-F183 HydrophobicContact CB-CB 4.38Å; E168-F183 PolarHBondContact N-O 3.11Å; E168-F183 PolarHBondContact O-N 3.2Å; R181-F183 HydrophobicContact CB-CE2 4.26Å; F183-A217 HydrophobicContact CD1-CB 3.78Å; F183-A217 HydrophobicContact CE1-CB 3.25Å; F183-A217 HydrophobicContact CE2-CB 4.26Å; F183-A217 HydrophobicContact CG-CB 4.49Å; F183-A217 HydrophobicContact CZ-CB 3.52Å; F183-I244 HydrophobicContact CE1-CD1 4.44Å; F183-I244 HydrophobicContact CE1-CG2 3.93Å; F183-I244 HydrophobicContact CZ-CD1 4.46Å; F183-I244 HydrophobicContact CZ-CG2 4.24Å; F183-L246 HydrophobicContact CZ-CD2 4.33Å
184	V	98.8	Very high	93.9	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	120.7	162.4	175.7	0	0	0	0	106.7	L156 V165 T166 S202 T203 H205 M208 R216	L156-V184 HydrophobicContact CD1-CG1 4.35Å; V165-V184 HydrophobicContact CG1-CG1 4.06Å; T166-V184 WeakPolarHBondContact O-CA 3.31Å; V184-S202 WeakPolarHBondContact O-CA 3.31Å; V184-T203 HydrophobicContact CG1-CG2 4Å; V184-T203 WeakPolarHBondContact CG1-O 3.42Å; V184-T203 PolarHBondContact O-N 3.44Å; V184-H205 HydrophobicContact CG1-CB 3.95Å; V184-M208 HydrophobicContact CG2-CB 4.07Å; V184-M208 HydrophobicContact CG2-CG 3.61Å; V184-R216 VanDerWaalsContact CG2-CZ 3.47Å
185	S	98.8	Very high	94.7	Very high	4 Å²	4	47.4 Å²	47.4	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	136.2	-172.4	-64.6	0	0	0	0	111.3	V165 T166 M201 N219	V165-S185 WeakPolarHBondContact CA-O 3.42Å; T166-S185 PolarHBondContact N-O 3.01Å; T166-S185 PolarHBondContact O-N 2.92Å; T166-S185 PolarHBondContact OG1-O 2.86Å; T166-S185 VanDerWaalsContact OG1-O 3.1Å; S185-M201 CarbonylContact C-O 3.54Å; S185-M201 VanDerWaalsContact CA-O 3.23Å; S185-M201 WeakPolarHBondContact CA-O 3.47Å; S185-M201 WeakPolarHBondContact CB-O 3.24Å; S185-N219 PolarHBondContact OG-ND2 2.9Å
186	V	98.8	Very high	95.4	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	138	163.3	66.2	0	0	0	0	108	Y74 Q77 T163 M164 G200 M201 T203	Y74-V186 HydrophobicContact CD1-CB 4.48Å; Y74-V186 HydrophobicContact CD1-CG2 4.46Å; Y74-V186 WeakPolarHBondContact O-CG2 3.49Å; Q77-V186 HydrophobicContact CB-CG1 4.03Å; Q77-V186 HydrophobicContact CG-CG1 3.73Å; T163-V186 HydrophobicContact CG2-CG2 3.83Å; M164-V186 CarbonylContact O-C 3.59Å; M164-V186 WeakPolarHBondContact O-CA 3.33Å; V186-G200 CarbonylContact O-C 3.55Å; V186-G200 WeakPolarHBondContact O-CA 3.3Å; V186-M201 HydrophobicContact CG1-CG 4.14Å; V186-M201 PolarHBondContact N-O 2.9Å; V186-M201 PolarHBondContact O-N 3.5Å; V186-M201 VanDerWaalsContact O-N 3.13Å; V186-T203 HydrophobicContact CB-CG2 4.03Å; V186-T203 VanDerWaalsContact N-CG2 3.34Å
187	R	98.7	Very high	96	Very high	27 Å²	27	39 Å²	39	10%	0.102	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.3	177.4	-61.6	-171.5	178.6	170.8	-0.8	109.8	T163 M164 T166 E168 L198 A199	T163-R187 WeakPolarHBondContact CA-O 3.28Å; M164-R187 HydrophobicContact CG-CB 3.92Å; M164-R187 PolarHBondContact N-O 3.03Å; M164-R187 PolarHBondContact O-N 2.86Å; T166-R187 HydrophobicContact CG2-CG 4.38Å; T166-R187 PolarHBondContact OG1-NE 3.33Å; T166-R187 VanDerWaalsContact OG1-NE 3.11Å; E168-R187 IonicContact OE2-CZ 3.97Å; E168-R187 IonicContact OE2-NH2 2.71Å; E168-R187 PolarHBondContact OE2-NH2 3.08Å; R187-L198 HydrophobicContact CB-CD1 4.13Å; R187-A199 CarbonylContact C-O 3.57Å; R187-A199 WeakPolarHBondContact CA-O 3.41Å
188	C	98.4	Very high	96.5	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	111.4	179.2	-171.4	0	0	0	0	109	G78 E162 K190 A199	G78-C188 WeakPolarHBondContact O-CB 3.26Å; E162-C188 CarbonylContact O-C 3.6Å; E162-C188 WeakPolarHBondContact O-CA 3.4Å; C188-K190 WeakPolarHBondContact SG-CE 3.33Å; C188-A199 PolarHBondContact N-O 3.22Å; C188-A199 PolarHBondContact O-N 2.87Å
189	A	98.2	Very high	97	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	110.7	176.9	0	0	0	0	0	109.5	Y133 V137 E162 F197 L198	Y133-A189 HydrophobicContact CE2-CB 4.44Å; V137-A189 HydrophobicContact CG1-CB 3.75Å; V137-A189 HydrophobicContact CG2-CB 4.47Å; E162-A189 VanDerWaalsContact CB-O 3.29Å; E162-A189 WeakPolarHBondContact CB-O 3.5Å; E162-A189 WeakPolarHBondContact CG-O 3.36Å; E162-A189 PolarHBondContact O-N 3.33Å; A189-F197 CarbonylContact C-O 3.56Å; A189-F197 VanDerWaalsContact CA-O 3.25Å; A189-F197 WeakPolarHBondContact CA-O 3.28Å; A189-L198 HydrophobicContact CB-CD1 4.14Å
190	K	96.9	Very high	97.3	Very high	44 Å²	44	33.9 Å²	33.9	19%	0.191	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	158.6	-179.7	-63.4	-150.8	-179.2	-156.4	0	111.8	E79 L82 E162 C188 F197	E79-K190 IonicContact OE1-NZ 3.91Å; E79-K190 PolarHBondContact OE1-NZ 3.22Å; L82-K190 HydrophobicContact CD2-CB 4.07Å; L82-K190 HydrophobicContact CD2-CD 3.75Å; L82-K190 HydrophobicContact CD2-CG 3.91Å; E162-K190 WeakPolarHBondContact OE2-CD 3.4Å; E162-K190 WeakPolarHBondContact OE2-CE 3.5Å; E162-K190 IonicContact OE2-NZ 2.68Å; E162-K190 PolarHBondContact OE2-NZ 2.9Å; C188-K190 WeakPolarHBondContact SG-CE 3.33Å; K190-F197 PolarHBondContact N-O 3.29Å; K190-F197 PolarHBondContact O-N 3.38Å
191	R	95.5	Very high	97.5	Very high	108 Å²	108	31.2 Å²	31.2	41%	0.408	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	139.4	171.9	-69.9	-179.1	174	-111.6	2.7	110.6	D130 T195 C196	D130-R191 IonicContact OD1-CZ 2.74Å; D130-R191 IonicContact OD1-NH1 2.63Å; D130-R191 PolarHBondContact OD1-NH1 3.33Å; D130-R191 IonicContact OD1-NH2 2.71Å; D130-R191 PolarHBondContact OD1-NH2 3.43Å; R191-T195 WeakPolarHBondContact CA-O 3.48Å; R191-C196 HydrophobicContact CG-CB 4.38Å; R191-C196 PolarHBondContact NH1-SG 3.36Å
192	R	94.1	Very high	97.6	Very high	204 Å²	204	31.2 Å²	31.2	77%	0.77	17%	0.165	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131	104.1	169.7	-174.6	-176.3	175.1	-176.2	-1	108.9	S194 T195 F197	R192-S194 PolarHBondContact O-N 3.3Å; R192-T195 PolarHBondContact N-O 3.49Å; R192-T195 PolarHBondContact O-N 2.84Å; R192-T195 VanDerWaalsContact O-N 3.08Å; R192-F197 HydrophobicContact CB-CE2 3.9Å
193	G	93.5	Very high	97.6	Very high	76 Å²	76	32.3 Å²	32.3	78%	0.784	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.5	-128.3	-168.5	0	0	0	0	0	109.8
194	S	94.4	Very high	97.6	Very high	78 Å²	78	39.7 Å²	39.7	55%	0.545	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-4.3	176.9	61.1	0	0	0	0	114.7	R192 P228	R192-S194 PolarHBondContact O-N 3.3Å; S194-P228 VanDerWaalsContact O-CD 3.31Å; S194-P228 WeakPolarHBondContact O-CD 3.41Å
195	T	97.3	Very high	97.5	Very high	17 Å²	17	40.6 Å²	40.6	10%	0.104	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	129.8	177.5	-54.3	0	0	0	0	110.3	R191 R192 F197 V225 M226 R227	R191-T195 WeakPolarHBondContact CA-O 3.48Å; R192-T195 PolarHBondContact N-O 3.49Å; R192-T195 PolarHBondContact O-N 2.84Å; R192-T195 VanDerWaalsContact O-N 3.08Å; T195-F197 HydrophobicContact CG2-CD2 4.37Å; T195-F197 HydrophobicContact CG2-CE1 3.95Å; T195-F197 HydrophobicContact CG2-CE2 3.61Å; T195-F197 HydrophobicContact CG2-CZ 3.36Å; T195-V225 HydrophobicContact CG2-CG1 3.66Å; T195-M226 WeakPolarHBondContact CA-O 3.36Å; T195-R227 HydrophobicContact CG2-CB 4.13Å; T195-R227 PolarHBondContact OG1-NE 3.44Å
196	C	97.9	Very high	97.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146	175.4	-52	0	0	0	0	110.6	Y133 R191 M226	Y133-C196 HydrophobicContact CD2-CB 3.65Å; Y133-C196 HydrophobicContact CE2-CB 4.23Å; R191-C196 HydrophobicContact CG-CB 4.38Å; R191-C196 PolarHBondContact NH1-SG 3.36Å; C196-M226 HydrophobicContact CB-CB 4.27Å; C196-M226 HydrophobicContact CB-CE 3.95Å; C196-M226 PolarHBondContact N-O 3.07Å; C196-M226 PolarHBondContact O-N 3.45Å
197	F	98.4	Very high	97.3	Very high	19 Å²	19	50.7 Å²	50.7	8%	0.083	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.2	-178.8	-56.4	-92.5	0	0	0	109.5	L82 I86 A189 K190 R192 T195 I224 V225	L82-F197 HydrophobicContact CD1-CB 3.69Å; L82-F197 HydrophobicContact CD1-CD1 4.02Å; L82-F197 HydrophobicContact CD1-CG 3.97Å; I86-F197 HydrophobicContact CD1-CD1 4.1Å; I86-F197 HydrophobicContact CD1-CE1 3.88Å; I86-F197 HydrophobicContact CD1-CZ 4.42Å; I86-F197 HydrophobicContact CG1-CD1 4.38Å; I86-F197 HydrophobicContact CG1-CE1 4.18Å; A189-F197 CarbonylContact C-O 3.56Å; A189-F197 VanDerWaalsContact CA-O 3.25Å; A189-F197 WeakPolarHBondContact CA-O 3.28Å; K190-F197 PolarHBondContact N-O 3.29Å; K190-F197 PolarHBondContact O-N 3.38Å; R192-F197 HydrophobicContact CB-CE2 3.9Å; T195-F197 HydrophobicContact CG2-CD2 4.37Å; T195-F197 HydrophobicContact CG2-CE1 3.95Å; T195-F197 HydrophobicContact CG2-CE2 3.61Å; T195-F197 HydrophobicContact CG2-CZ 3.36Å; F197-I224 CarbonylContact C-O 3.41Å; F197-I224 VanDerWaalsContact CA-O 3.32Å; F197-I224 WeakPolarHBondContact CA-O 3.34Å; F197-V225 HydrophobicContact CD1-CB 4.49Å; F197-V225 HydrophobicContact CD1-CG1 4.23Å; F197-V225 HydrophobicContact CD1-CG2 3.92Å; F197-V225 HydrophobicContact CE1-CG1 3.86Å; F197-V225 HydrophobicContact CE1-CG2 4.04Å
198	L	98.6	Very high	97.3	Very high	15 Å²	15	50.9 Å²	50.9	8%	0.079	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	97.9	162.7	177.6	66.2	0	0	0	107.2	V137 M140 R187 A189 C223 I224	V137-L198 HydrophobicContact CG2-CB 4.33Å; V137-L198 HydrophobicContact CG2-CD1 4.31Å; V137-L198 HydrophobicContact CG2-CD2 4.27Å; M140-L198 HydrophobicContact CE-CD1 4.5Å; R187-L198 HydrophobicContact CB-CD1 4.13Å; A189-L198 HydrophobicContact CB-CD1 4.14Å; L198-C223 CarbonylContact O-C 3.54Å; L198-C223 WeakPolarHBondContact O-CA 3.32Å; L198-I224 HydrophobicContact CB-CB 4.35Å; L198-I224 PolarHBondContact N-O 2.76Å; L198-I224 PolarHBondContact O-N 2.83Å
199	A	98.7	Very high	97.2	Very high	2 Å²	2	54.8 Å²	54.8	2%	0.017	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	162.5	178.2	0	0	0	0	0	111.3	L82 R187 C188 T222 C223	L82-A199 VanDerWaalsContact CA-CB 3.47Å; L82-A199 HydrophobicContact CB-CB 3.72Å; L82-A199 HydrophobicContact CD1-CB 3.73Å; L82-A199 HydrophobicContact CG-CB 4.34Å; R187-A199 CarbonylContact C-O 3.57Å; R187-A199 WeakPolarHBondContact CA-O 3.41Å; C188-A199 PolarHBondContact N-O 3.22Å; C188-A199 PolarHBondContact O-N 2.87Å; A199-T222 CarbonylContact C-O 3.57Å; A199-T222 VanDerWaalsContact CA-O 3.24Å; A199-T222 WeakPolarHBondContact CA-O 3.4Å; A199-C223 HydrophobicContact CB-CB 4.11Å
200	G	98.6	Very high	97.2	Very high	1 Å²	1	61 Å²	61	1%	0.01	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	172.9	173.4	0	0	0	0	0	113.6	A81 V186 T222	A81-G200 WeakPolarHBondContact CB-O 3.38Å; V186-G200 CarbonylContact O-C 3.55Å; V186-G200 WeakPolarHBondContact O-CA 3.3Å; G200-T222 PolarHBondContact N-O 2.9Å; G200-T222 WeakPolarHBondContact O-CG2 3.4Å; G200-T222 PolarHBondContact O-N 3.36Å
201	M	98.6	Very high	97.2	Very high	22 Å²	22	63.1 Å²	63.1	11%	0.108	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	168.5	170.1	65	171.1	70.4	0	0	110	Q77 E80 A81 K84 S185 V186	Q77-M201 HydrophobicContact CG-CG 3.85Å; Q77-M201 HydrophobicContact CG-SD 3.63Å; E80-M201 HydrophobicContact CB-CE 4.46Å; E80-M201 HydrophobicContact CG-CE 4.35Å; A81-M201 HydrophobicContact CB-CB 4.2Å; A81-M201 HydrophobicContact CB-CE 3.49Å; A81-M201 VanDerWaalsContact CB-CE 3.49Å; A81-M201 HydrophobicContact CB-CG 4.05Å; K84-M201 HydrophobicContact CD-CE 4.46Å; S185-M201 CarbonylContact C-O 3.54Å; S185-M201 VanDerWaalsContact CA-O 3.23Å; S185-M201 WeakPolarHBondContact CA-O 3.47Å; S185-M201 WeakPolarHBondContact CB-O 3.24Å; V186-M201 HydrophobicContact CG1-CG 4.14Å; V186-M201 PolarHBondContact N-O 2.9Å; V186-M201 PolarHBondContact O-N 3.5Å; V186-M201 VanDerWaalsContact O-N 3.13Å
202	S	98.6	Very high	97.1	Very high	23 Å²	23	70.2 Å²	70.2	16%	0.161	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	141.2	176.4	-58.4	0	0	0	0	112.3	Q77 V184 E218 N219	Q77-S202 PolarHBondContact NE2-O 3.24Å; V184-S202 WeakPolarHBondContact O-CA 3.31Å; S202-E218 WeakPolarHBondContact OG-CA 3.42Å; S202-E218 WeakPolarHBondContact OG-CB 3.3Å; S202-N219 WeakPolarHBondContact CB-O 3.34Å; S202-N219 PolarHBondContact N-O 2.82Å; S202-N219 WeakPolarHBondContact OG-CA 3.45Å; S202-N219 PolarHBondContact OG-N 2.84Å; S202-N219 PolarHBondContact OG-O 3.44Å
203	T	98.5	Very high	97.1	Very high	24 Å²	24	63.8 Å²	63.8	15%	0.147	37%	0.365	C	S	.	.			trans	-144.8	176.5	173.1	-158.7	0	0	0	0	110.3	Y74 Q77 V165 V184 V186	Y74-T203 HydrophobicContact CD1-CG2 4.28Å; Y74-T203 HydrophobicContact CE1-CG2 3.9Å; Y74-T203 WeakPolarHBondContact CE1-OG1 3.5Å; Q77-T203 PolarHBondContact OE1-OG1 3.36Å; V165-T203 HydrophobicContact CG1-CG2 3.79Å; V184-T203 HydrophobicContact CG1-CG2 4Å; V184-T203 WeakPolarHBondContact CG1-O 3.42Å; V184-T203 PolarHBondContact O-N 3.44Å; V186-T203 HydrophobicContact CB-CG2 4.03Å; V186-T203 VanDerWaalsContact N-CG2 3.34Å
204	Q	97.9	Very high	97.2	Very high	166 Å²	166	62.2 Å²	62.2	78%	0.776	34%	0.34	S	S	*	.			trans	-110	145.5	172.7	-62.7	-180	6.8	0	0	109	Y74	Y74-Q204 WeakPolarHBondContact CE1-O 3.39Å; Y74-Q204 PolarHBondContact OH-O 3.32Å
205	H	98.1	Very high	97.4	Very high	20 Å²	20	61 Å²	61	9%	0.093	33%	0.329	C	S	.	.			trans	-132.8	128.8	173.9	-167.5	-93.3	0	0	0	109.5	L156 Q157 V165 V184 T207 M208	L156-H205 HydrophobicContact CD1-CB 3.8Å; Q157-H205 PolarHBondContact OE1-NE2 3.45Å; V165-H205 HydrophobicContact CG1-CB 4.09Å; V184-H205 HydrophobicContact CG1-CB 3.95Å; H205-T207 PolarHBondContact CE1-OG1 3.12Å; H205-T207 PolarHBondContact ND1-N 3.07Å; H205-T207 PolarHBondContact ND1-OG1 3.41Å; H205-T207 PolarHBondContact O-N 3.13Å; H205-T207 VanDerWaalsContact O-N 3.14Å; H205-M208 HydrophobicContact CB-CB 4.35Å; H205-M208 CarbonylContact O-C 3.48Å; H205-M208 PolarHBondContact O-N 3.44Å
206	P	96.3	Very high	97.4	Very high	116 Å²	116	61.3 Å²	61.3	75%	0.753	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-32.9	-174.5	-27.9	35.2	0	0	0	114.4	M208	P206-M208 VanDerWaalsContact C-N 3.32Å
207	T	96.6	Very high	97.4	Very high	101 Å²	101	61.3 Å²	61.3	62%	0.62	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-2.4	179.7	72.8	0	0	0	0	113.8	H205 P209	H205-T207 PolarHBondContact CE1-OG1 3.12Å; H205-T207 PolarHBondContact ND1-N 3.07Å; H205-T207 PolarHBondContact ND1-OG1 3.41Å; H205-T207 PolarHBondContact O-N 3.13Å; H205-T207 VanDerWaalsContact O-N 3.14Å; T207-P209 VanDerWaalsContact C-CD 3.44Å
208	M	97.8	Very high	97.4	Very high	31 Å²	31	64.5 Å²	64.5	15%	0.153	34%	0.344	C	S	.	.			trans	-131.8	63.1	-178.7	-163.6	55	67.4	0	0	112.5	L156 H167 V184 H205 P206 R216	L156-M208 HydrophobicContact CD1-CB 3.55Å; L156-M208 HydrophobicContact CD1-CG 4.04Å; L156-M208 HydrophobicContact CD2-CB 4.49Å; L156-M208 HydrophobicContact CD2-CE 3.76Å; H167-M208 HydrophobicContact CB-CE 4.39Å; H167-M208 HydrophobicContact CB-CG 4.23Å; V184-M208 HydrophobicContact CG2-CB 4.07Å; V184-M208 HydrophobicContact CG2-CG 3.61Å; H205-M208 HydrophobicContact CB-CB 4.35Å; H205-M208 CarbonylContact O-C 3.48Å; H205-M208 PolarHBondContact O-N 3.44Å; P206-M208 VanDerWaalsContact C-N 3.32Å; M208-R216 PolarHBondContact O-NH1 2.96Å; M208-R216 PolarHBondContact O-NH2 2.96Å
209	P	97.5	Very high	97.3	Very high	81 Å²	81	64.6 Å²	64.6	53%	0.526	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-63	169.9	170.7	30.3	-35.6	0	0	0	111.2	T207 Q211 R216	T207-P209 VanDerWaalsContact C-CD 3.44Å; P209-Q211 PolarHBondContact O-NE2 3.17Å; P209-R216 PolarHBondContact O-NH2 2.78Å; P209-R216 VanDerWaalsContact O-NH2 3.07Å
210	E	97.6	Very high	97.3	Very high	133 Å²	133	65.5 Å²	65.5	62%	0.621	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-59.2	138.4	174.2	-60.5	-169.1	156.4	0	0	111	R216	E210-R216 HydrophobicContact CG-CB 3.82Å; E210-R216 HydrophobicContact CG-CG 4.25Å; E210-R216 WeakPolarHBondContact OE1-CB 3.32Å
211	Q	95.9	Very high	97.3	Very high	89 Å²	89	66 Å²	66	42%	0.416	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-103.7	141	-174.7	-60.1	-60.3	-50.9	0	0	111	P209 G213 V214	P209-Q211 PolarHBondContact O-NE2 3.17Å; Q211-G213 PolarHBondContact O-N 2.66Å; Q211-V214 PolarHBondContact O-N 2.87Å
212	R	94.7	Very high	97.3	Very high	257 Å²	257	66 Å²	66	97%	0.97	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	131.4	179.1	-173.6	179.2	179.7	-175.2	0	110.7	V214	R212-V214 VanDerWaalsContact C-N 3.31Å
213	G	93.9	Very high	97.3	Very high	68 Å²	68	64.9 Å²	64.9	70%	0.701	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	-0.6	177.2	0	0	0	0	0	114.7	Q211	Q211-G213 PolarHBondContact O-N 2.66Å
214	V	95.9	Very high	97.3	Very high	43 Å²	43	64.5 Å²	64.5	26%	0.261	35%	0.347	S	S	.	.	S	Bend	trans	-125	135.3	174.8	-176.5	0	0	0	0	108.4	P180 D182 Q211 R212	P180-V214 HydrophobicContact CB-CG1 4.42Å; P180-V214 HydrophobicContact CB-CG2 4.31Å; D182-V214 HydrophobicContact CB-CG1 3.75Å; Q211-V214 PolarHBondContact O-N 2.87Å; R212-V214 VanDerWaalsContact C-N 3.31Å
215	V	97.1	Very high	97.3	Very high	52 Å²	52	57 Å²	57	32%	0.315	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.8	178.5	176.3	0	0	0	0	109.4	P180 R181 D182 A217 K247	P180-V215 PolarHBondContact O-N 2.89Å; R181-V215 WeakPolarHBondContact CA-O 3.39Å; R181-V215 HydrophobicContact CG-CB 4.33Å; D182-V215 PolarHBondContact N-O 3.34Å; V215-A217 PolarHBondContact O-N 2.94Å; V215-K247 HydrophobicContact CG1-CB 3.79Å
216	R	98.4	Very high	97.3	Very high	25 Å²	25	56 Å²	56	9%	0.094	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	95.8	172.9	179.4	58.6	53.5	78.2	0.8	110.9	D182 V184 M208 P209 E210 K247	D182-R216 VanDerWaalsContact CG-NE 3.33Å; D182-R216 CarbonylContact O-C 3.5Å; D182-R216 WeakPolarHBondContact O-CA 3.39Å; D182-R216 WeakPolarHBondContact OD1-CA 3.42Å; D182-R216 IonicContact OD1-CZ 2.78Å; D182-R216 IonicContact OD1-NE 2.84Å; D182-R216 PolarHBondContact OD1-NE 2.9Å; D182-R216 IonicContact OD1-NH2 3.87Å; D182-R216 IonicContact OD2-CZ 2.9Å; D182-R216 IonicContact OD2-NE 3.76Å; D182-R216 PolarHBondContact OD2-NE 3.4Å; D182-R216 IonicContact OD2-NH2 2.7Å; D182-R216 PolarHBondContact OD2-NH2 3.37Å; V184-R216 VanDerWaalsContact CG2-CZ 3.47Å; M208-R216 PolarHBondContact O-NH1 2.96Å; M208-R216 PolarHBondContact O-NH2 2.96Å; P209-R216 PolarHBondContact O-NH2 2.78Å; P209-R216 VanDerWaalsContact O-NH2 3.07Å; E210-R216 HydrophobicContact CG-CB 3.82Å; E210-R216 HydrophobicContact CG-CG 4.25Å; E210-R216 WeakPolarHBondContact OE1-CB 3.32Å; R216-K247 WeakPolarHBondContact O-CD 3.41Å; R216-K247 WeakPolarHBondContact O-CE 3.45Å; R216-K247 PolarHBondContact O-NZ 3.2Å
217	A	97.8	Very high	97.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	160.9	172.2	0	0	0	0	0	111	R181 D182 F183 V215 D245	R181-A217 HydrophobicContact CB-CB 4.01Å; R181-A217 HydrophobicContact CG-CB 3.62Å; D182-A217 PolarHBondContact O-N 3.16Å; F183-A217 HydrophobicContact CD1-CB 3.78Å; F183-A217 HydrophobicContact CE1-CB 3.25Å; F183-A217 HydrophobicContact CE2-CB 4.26Å; F183-A217 HydrophobicContact CG-CB 4.49Å; F183-A217 HydrophobicContact CZ-CB 3.52Å; V215-A217 PolarHBondContact O-N 2.94Å; A217-D245 WeakPolarHBondContact CA-O 3.47Å; A217-D245 WeakPolarHBondContact CB-O 3.33Å
218	E	98.1	Very high	97.5	Very high	85 Å²	85	52.5 Å²	52.5	40%	0.397	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.3	-174.7	-75.5	178	-162.2	0	0	111.1	S202 I244 D245 K247	S202-E218 WeakPolarHBondContact OG-CA 3.42Å; S202-E218 WeakPolarHBondContact OG-CB 3.3Å; E218-I244 CarbonylContact O-C 3.56Å; E218-I244 WeakPolarHBondContact O-CA 3.4Å; E218-D245 HydrophobicContact CB-CB 4.47Å; E218-D245 PolarHBondContact N-O 3.05Å; E218-D245 PolarHBondContact O-N 3.33Å; E218-K247 VanDerWaalsContact OE1-CE 3.26Å; E218-K247 WeakPolarHBondContact OE1-CE 3.39Å; E218-K247 IonicContact OE1-NZ 3.48Å; E218-K247 PolarHBondContact OE1-NZ 3.33Å
219	N	97.7	Very high	97.5	Very high	18 Å²	18	51.3 Å²	51.3	10%	0.096	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.4	159	-71.7	-56.1	0	0	0	110	S185 S202 T222 S243 I244	S185-N219 PolarHBondContact OG-ND2 2.9Å; S202-N219 WeakPolarHBondContact CB-O 3.34Å; S202-N219 PolarHBondContact N-O 2.82Å; S202-N219 WeakPolarHBondContact OG-CA 3.45Å; S202-N219 PolarHBondContact OG-N 2.84Å; S202-N219 PolarHBondContact OG-O 3.44Å; N219-T222 HydrophobicContact CB-CG2 4.34Å; N219-S243 CarbonylContact C-O 3.43Å; N219-S243 WeakPolarHBondContact CA-O 3.38Å; N219-I244 WeakPolarHBondContact OD1-CG1 3.17Å
220	G	98	Very high	97.4	Very high	21 Å²	21	52 Å²	52	22%	0.216	28%	0.28	C	S	.	.			trans	-68.9	-163.5	153.5	0	0	0	0	0	110.8	T222 S243	G220-T222 PolarHBondContact O-N 3.15Å; G220-T222 VanDerWaalsContact O-N 3.11Å; G220-S243 PolarHBondContact N-O 3.18Å
221	P	98.1	Very high	97.3	Very high	12 Å²	12	52.5 Å²	52.5	8%	0.078	29%	0.287	C	S	.	.	S	Bend	trans	-63.3	115.7	173.6	26.4	-31.2	0	0	0	110.1	K84 I88 V115	K84-P221 HydrophobicContact CB-CB 4.1Å; I88-P221 HydrophobicContact CD1-CG 4.03Å; V115-P221 HydrophobicContact CG1-CG 3.81Å; V115-P221 HydrophobicContact CG2-CG 3.99Å
222	T	98.4	Very high	97.4	Very high	21 Å²	21	50.6 Å²	50.6	13%	0.129	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.5	177.9	178.5	0	0	0	0	109.8	S85 A199 G200 N219 G220 W240 L241	S85-T222 PolarHBondContact OG-N 3.42Å; S85-T222 PolarHBondContact OG-O 2.83Å; A199-T222 CarbonylContact C-O 3.57Å; A199-T222 VanDerWaalsContact CA-O 3.24Å; A199-T222 WeakPolarHBondContact CA-O 3.4Å; G200-T222 PolarHBondContact N-O 2.9Å; G200-T222 WeakPolarHBondContact O-CG2 3.4Å; G200-T222 PolarHBondContact O-N 3.36Å; N219-T222 HydrophobicContact CB-CG2 4.34Å; G220-T222 PolarHBondContact O-N 3.15Å; G220-T222 VanDerWaalsContact O-N 3.11Å; T222-W240 PolarHBondContact OG1-NE1 3.48Å; T222-L241 VanDerWaalsContact CA-O 3.3Å; T222-L241 WeakPolarHBondContact CA-O 3.3Å; T222-L241 WeakPolarHBondContact CB-O 3.45Å; T222-L241 PolarHBondContact OG1-O 2.97Å
223	C	98.7	Very high	97.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	129.5	176.7	-174.5	0	0	0	0	112.6	L198 A199 W240 L241	L198-C223 CarbonylContact O-C 3.54Å; L198-C223 WeakPolarHBondContact O-CA 3.32Å; A199-C223 HydrophobicContact CB-CB 4.11Å; C223-W240 WeakPolarHBondContact O-CA 3.43Å; C223-L241 PolarHBondContact N-O 3.2Å; C223-L241 PolarHBondContact O-N 3.35Å
224	I	98.7	Very high	97.5	Very high	16 Å²	16	43.8 Å²	43.8	8%	0.082	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.2	164.4	-65.8	172.4	0	0	0	108.3	L136 F197 L198 M226 F238 T239 W240	L136-I224 HydrophobicContact CD1-CD1 4.48Å; L136-I224 HydrophobicContact CD1-CG2 4.44Å; F197-I224 CarbonylContact C-O 3.41Å; F197-I224 VanDerWaalsContact CA-O 3.32Å; F197-I224 WeakPolarHBondContact CA-O 3.34Å; L198-I224 HydrophobicContact CB-CB 4.35Å; L198-I224 PolarHBondContact N-O 2.76Å; L198-I224 PolarHBondContact O-N 2.83Å; I224-M226 HydrophobicContact CG2-CE 4.28Å; I224-M226 HydrophobicContact CG2-CG 3.98Å; I224-M226 HydrophobicContact CG2-SD 4.46Å; I224-F238 HydrophobicContact CB-CZ 4.37Å; I224-F238 HydrophobicContact CD1-CZ 4.07Å; I224-F238 HydrophobicContact CG1-CZ 4.04Å; I224-F238 HydrophobicContact CG2-CD2 4.12Å; I224-F238 HydrophobicContact CG2-CE1 4.45Å; I224-F238 HydrophobicContact CG2-CE2 3.3Å; I224-F238 HydrophobicContact CG2-CZ 3.5Å; I224-F238 VanDerWaalsContact CG2-CZ 3.5Å; I224-T239 CarbonylContact C-O 3.6Å; I224-T239 WeakPolarHBondContact CA-O 3.35Å; I224-W240 HydrophobicContact CG1-CB 4.1Å; I224-W240 HydrophobicContact CG1-CD2 4.5Å; I224-W240 HydrophobicContact CG1-CG 3.8Å
225	V	98.7	Very high	97.6	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.042	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.6	173	-174	0	0	0	0	108.2	L89 T195 F197 T239	L89-V225 HydrophobicContact CD1-CG2 3.67Å; T195-V225 HydrophobicContact CG2-CG1 3.66Å; F197-V225 HydrophobicContact CD1-CB 4.49Å; F197-V225 HydrophobicContact CD1-CG1 4.23Å; F197-V225 HydrophobicContact CD1-CG2 3.92Å; F197-V225 HydrophobicContact CE1-CG1 3.86Å; F197-V225 HydrophobicContact CE1-CG2 4.04Å; V225-T239 PolarHBondContact N-O 3.47Å; V225-T239 PolarHBondContact O-N 3.03Å
226	M	98.5	Very high	97.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	108.1	175.1	-66.7	168.3	-78.3	0	0	108.2	L132 Y133 L136 T195 C196 I224 T236 F238	L132-M226 HydrophobicContact CB-CG 4.44Å; L132-M226 HydrophobicContact CB-SD 3.56Å; L132-M226 VanDerWaalsContact CB-SD 3.56Å; Y133-M226 HydrophobicContact CD2-CE 3.99Å; L136-M226 HydrophobicContact CD1-SD 3.97Å; T195-M226 WeakPolarHBondContact CA-O 3.36Å; C196-M226 HydrophobicContact CB-CB 4.27Å; C196-M226 HydrophobicContact CB-CE 3.95Å; C196-M226 PolarHBondContact N-O 3.07Å; C196-M226 PolarHBondContact O-N 3.45Å; I224-M226 HydrophobicContact CG2-CE 4.28Å; I224-M226 HydrophobicContact CG2-CG 3.98Å; I224-M226 HydrophobicContact CG2-SD 4.46Å; M226-T236 HydrophobicContact CB-CG2 3.94Å; M226-T236 HydrophobicContact CG-CG2 4.39Å; M226-F238 HydrophobicContact CG-CD2 3.95Å; M226-F238 HydrophobicContact CG-CE2 4.21Å
227	R	98	Very high	97.6	Very high	111 Å²	111	45.2 Å²	45.2	42%	0.419	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	132.8	179.8	-176.3	180	-63.2	121.6	-1	110	T195 S229 T236 K237	T195-R227 HydrophobicContact CG2-CB 4.13Å; T195-R227 PolarHBondContact OG1-NE 3.44Å; R227-S229 PolarHBondContact O-N 2.92Å; R227-T236 CarbonylContact O-C 3.46Å; R227-T236 WeakPolarHBondContact O-CA 3.35Å; R227-K237 PolarHBondContact N-O 3.1Å; R227-K237 VanDerWaalsContact N-O 3.1Å; R227-K237 PolarHBondContact O-N 2.88Å
228	P	98.1	Very high	97.7	Very high	32 Å²	32	45.4 Å²	45.4	21%	0.208	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	139.8	171.6	-26.3	34.7	0	0	0	111.4	S129 S194	S129-P228 WeakPolarHBondContact OG-CD 3.27Å; S194-P228 VanDerWaalsContact O-CD 3.31Å; S194-P228 WeakPolarHBondContact O-CD 3.41Å
229	S	97.6	Very high	97.7	Very high	7 Å²	7	42.5 Å²	42.5	5%	0.049	24%	0.239	C	C	.	.			trans	-66.1	140.5	174.2	-168.2	0	0	0	0	109.8	R227 D231 D232 K235 K237	R227-S229 PolarHBondContact O-N 2.92Å; S229-D231 PolarHBondContact O-N 2.77Å; S229-D231 PolarHBondContact OG-N 2.88Å; S229-D232 VanDerWaalsContact CB-O 3.29Å; S229-D232 WeakPolarHBondContact CB-O 3.25Å; S229-D232 CarbonylContact O-C 3.41Å; S229-K235 PolarHBondContact N-O 3.32Å; S229-K237 WeakPolarHBondContact OG-CE 3.48Å
230	A	95.9	Very high	97.8	Very high	95 Å²	95	43 Å²	43	79%	0.785	24%	0.24	S	C	*	.	S	Bend	trans	-66.4	-28.9	174	0	0	0	0	0	111.6
231	D	96.2	Very high	97.8	Very high	143 Å²	143	42 Å²	42	77%	0.765	23%	0.23	S	C	*	.	S	Bend	trans	-84.3	-27.8	-177.6	-49.1	-53.8	0	0	0	112.3	S229	S229-D231 PolarHBondContact O-N 2.77Å; S229-D231 PolarHBondContact OG-N 2.88Å
232	D	96.8	Very high	97.8	Very high	50 Å²	50	41.7 Å²	41.7	27%	0.267	23%	0.227	S	C	.	.			trans	-154.4	109.2	179	-176.4	-8.3	0	0	0	110.4	S229 N234 K235	S229-D232 VanDerWaalsContact CB-O 3.29Å; S229-D232 WeakPolarHBondContact CB-O 3.25Å; S229-D232 CarbonylContact O-C 3.41Å; D232-N234 PolarHBondContact O-N 3.48Å; D232-N234 VanDerWaalsContact O-N 3.15Å; D232-N234 WeakPolarHBondContact OD1-CB 3.46Å; D232-N234 PolarHBondContact OD1-N 3.34Å; D232-N234 PolarHBondContact OD1-ND2 3.49Å; D232-K235 HydrophobicContact CB-CB 4.37Å; D232-K235 HydrophobicContact CB-CD 4.14Å; D232-K235 HydrophobicContact CB-CG 4Å; D232-K235 PolarHBondContact O-N 2.97Å; D232-K235 VanDerWaalsContact OD2-CE 3.23Å; D232-K235 WeakPolarHBondContact OD2-CE 3.38Å
233	P	94.6	Very high	97.7	Very high	89 Å²	89	41 Å²	41	58%	0.578	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-11.3	-179.1	29	-35.5	0	0	0	113.9	K235	P233-K235 VanDerWaalsContact C-N 3.27Å
234	N	95.9	Very high	97.6	Very high	92 Å²	92	42.6 Å²	42.6	49%	0.492	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.2	171.6	-59.9	-54	0	0	0	112.8	Q127 R128 D232	Q127-N234 CarbonylContact C-O 3.36Å; Q127-N234 PolarHBondContact N-O 3.47Å; R128-N234 PolarHBondContact N-O 3.39Å; D232-N234 PolarHBondContact O-N 3.48Å; D232-N234 VanDerWaalsContact O-N 3.15Å; D232-N234 WeakPolarHBondContact OD1-CB 3.46Å; D232-N234 PolarHBondContact OD1-N 3.34Å; D232-N234 PolarHBondContact OD1-ND2 3.49Å
235	K	98	Very high	97.4	Very high	63 Å²	63	45.9 Å²	45.9	27%	0.274	25%	0.249	S	C	.	.	S	Bend	trans	-107.4	153.5	173.4	-56.5	-172.4	-173.8	-141.6	0	110.8	L124 L125 D126 Q127 S229 D232 P233	L124-K235 HydrophobicContact CD1-CB 4.03Å; L124-K235 HydrophobicContact CD2-CD 4.13Å; L124-K235 HydrophobicContact CG-CB 4.43Å; L124-K235 HydrophobicContact CG-CD 4.41Å; L125-K235 CarbonylContact O-C 3.56Å; L125-K235 VanDerWaalsContact O-CA 3.28Å; L125-K235 WeakPolarHBondContact O-CA 3.4Å; L125-K235 WeakPolarHBondContact O-CB 3.12Å; D126-K235 VanDerWaalsContact OD1-CD 3.3Å; D126-K235 WeakPolarHBondContact OD1-CD 3.34Å; D126-K235 WeakPolarHBondContact OD1-CE 3.38Å; D126-K235 IonicContact OD1-NZ 2.72Å; D126-K235 PolarHBondContact OD1-NZ 2.86Å; Q127-K235 CarbonylContact O-C 3.47Å; S229-K235 PolarHBondContact N-O 3.32Å; D232-K235 HydrophobicContact CB-CB 4.37Å; D232-K235 HydrophobicContact CB-CD 4.14Å; D232-K235 HydrophobicContact CB-CG 4Å; D232-K235 PolarHBondContact O-N 2.97Å; D232-K235 VanDerWaalsContact OD2-CE 3.23Å; D232-K235 WeakPolarHBondContact OD2-CE 3.38Å; P233-K235 VanDerWaalsContact C-N 3.27Å
236	T	98.5	Very high	97.2	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.5	178.9	-64.7	0	0	0	0	110.7	L125 Q127 S129 L132 M226 R227 F238	L125-T236 PolarHBondContact N-O 3.36Å; L125-T236 PolarHBondContact O-N 3.43Å; Q127-T236 WeakPolarHBondContact O-CB 3.13Å; Q127-T236 PolarHBondContact O-N 3.36Å; Q127-T236 PolarHBondContact O-OG1 2.71Å; S129-T236 VanDerWaalsContact CA-OG1 3.28Å; S129-T236 WeakPolarHBondContact CA-OG1 3.26Å; S129-T236 PolarHBondContact N-OG1 2.9Å; S129-T236 WeakPolarHBondContact OG-CG2 3.1Å; S129-T236 PolarHBondContact OG-OG1 2.94Å; L132-T236 HydrophobicContact CD1-CG2 3.65Å; M226-T236 HydrophobicContact CB-CG2 3.94Å; M226-T236 HydrophobicContact CG-CG2 4.39Å; R227-T236 CarbonylContact O-C 3.46Å; R227-T236 WeakPolarHBondContact O-CA 3.35Å; T236-F238 PolarHBondContact O-N 3.46Å
237	K	98.3	Very high	96.9	Very high	88 Å²	88	48.9 Å²	48.9	38%	0.383	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	101.3	159.7	-68.5	-176.7	179	-179.2	0	107.4	L124 R227 S229	L124-K237 HydrophobicContact CD1-CG 4.11Å; R227-K237 PolarHBondContact N-O 3.1Å; R227-K237 VanDerWaalsContact N-O 3.1Å; R227-K237 PolarHBondContact O-N 2.88Å; S229-K237 WeakPolarHBondContact OG-CE 3.48Å
238	F	98.7	Very high	96.5	Very high	3 Å²	3	46.3 Å²	46.3	1%	0.013	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.8	179.3	-175.9	-84.1	0	0	0	109.3	L121 V123 L125 L136 I224 M226 T236 W240 F266 L270	L121-F238 HydrophobicContact CD2-CD1 4.29Å; L121-F238 HydrophobicContact CD2-CE1 4.02Å; V123-F238 HydrophobicContact CB-CB 4.38Å; V123-F238 PolarHBondContact N-O 3.34Å; V123-F238 PolarHBondContact O-N 2.95Å; L125-F238 HydrophobicContact CD1-CB 3.83Å; L125-F238 HydrophobicContact CD1-CD2 3.9Å; L125-F238 HydrophobicContact CD1-CG 3.94Å; L125-F238 HydrophobicContact CG-CB 4.17Å; L136-F238 HydrophobicContact CD1-CE2 3.62Å; L136-F238 HydrophobicContact CD1-CZ 4.31Å; I224-F238 HydrophobicContact CB-CZ 4.37Å; I224-F238 HydrophobicContact CD1-CZ 4.07Å; I224-F238 HydrophobicContact CG1-CZ 4.04Å; I224-F238 HydrophobicContact CG2-CD2 4.12Å; I224-F238 HydrophobicContact CG2-CE1 4.45Å; I224-F238 HydrophobicContact CG2-CE2 3.3Å; I224-F238 HydrophobicContact CG2-CZ 3.5Å; I224-F238 VanDerWaalsContact CG2-CZ 3.5Å; M226-F238 HydrophobicContact CG-CD2 3.95Å; M226-F238 HydrophobicContact CG-CE2 4.21Å; T236-F238 PolarHBondContact O-N 3.46Å; F238-W240 HydrophobicContact CE1-CB 3.7Å; F238-W240 HydrophobicContact CZ-CB 4.28Å; F238-F266 HydrophobicContact CE1-CE1 4.1Å; F238-F266 AromaticContact CZ-CE1 3.66Å; F238-F266 HydrophobicContact CZ-CE1 3.66Å; F238-F266 HydrophobicContact CZ-CZ 4.45Å; F238-L270 HydrophobicContact CE2-CD2 4.18Å; F238-L270 HydrophobicContact CZ-CD2 4.48Å
239	T	98.6	Very high	96.1	Very high	24 Å²	24	57.4 Å²	57.4	15%	0.147	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.1	174.8	-54.5	0	0	0	0	109.6	L89 K120 L121 E122 I224 V225	L89-T239 HydrophobicContact CD1-CG2 4.44Å; L89-T239 HydrophobicContact CD2-CG2 3.79Å; K120-T239 HydrophobicContact CD-CG2 4.04Å; K120-T239 HydrophobicContact CG-CG2 3.83Å; L121-T239 CarbonylContact O-C 3.6Å; L121-T239 VanDerWaalsContact O-CA 3.23Å; L121-T239 WeakPolarHBondContact O-CA 3.4Å; E122-T239 HydrophobicContact CG-CG2 4.45Å; I224-T239 CarbonylContact C-O 3.6Å; I224-T239 WeakPolarHBondContact CA-O 3.35Å; V225-T239 PolarHBondContact N-O 3.47Å; V225-T239 PolarHBondContact O-N 3.03Å
240	W	98.8	Very high	95.7	Very high	30 Å²	30	58.4 Å²	58.4	11%	0.114	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	111.7	176.9	176.7	28.4	0	0	0	111.5	K120 L121 T222 C223 I224 F238 L242 Q263 F266	K120-W240 CarbonylContact C-O 3.57Å; K120-W240 WeakPolarHBondContact CA-O 3.23Å; L121-W240 HydrophobicContact CB-CB 4.17Å; L121-W240 HydrophobicContact CD2-CB 4.44Å; L121-W240 HydrophobicContact CD2-CE3 4.12Å; L121-W240 PolarHBondContact N-O 2.79Å; L121-W240 PolarHBondContact O-N 3.34Å; T222-W240 PolarHBondContact OG1-NE1 3.48Å; C223-W240 WeakPolarHBondContact O-CA 3.43Å; I224-W240 HydrophobicContact CG1-CB 4.1Å; I224-W240 HydrophobicContact CG1-CD2 4.5Å; I224-W240 HydrophobicContact CG1-CG 3.8Å; F238-W240 HydrophobicContact CE1-CB 3.7Å; F238-W240 HydrophobicContact CZ-CB 4.28Å; W240-L242 HydrophobicContact CH2-CD1 4.31Å; W240-L242 HydrophobicContact CH2-CD2 4.22Å; W240-L242 HydrophobicContact CZ2-CB 4.5Å; W240-L242 HydrophobicContact CZ2-CD1 3.48Å; W240-L242 VanDerWaalsContact CZ2-CD1 3.48Å; W240-L242 HydrophobicContact CZ2-CD2 4.15Å; W240-L242 HydrophobicContact CZ2-CG 4.26Å; W240-Q263 HydrophobicContact CE3-CB 4.36Å; W240-Q263 HydrophobicContact CE3-CG 3.86Å; W240-Q263 HydrophobicContact CH2-CG 4.49Å; W240-Q263 HydrophobicContact CZ3-CB 4.32Å; W240-Q263 HydrophobicContact CZ3-CG 3.83Å; W240-Q263 PolarHBondContact O-NE2 3.48Å; W240-F266 AromaticContact CE3-CD1 3.96Å; W240-F266 HydrophobicContact CE3-CD1 3.96Å; W240-F266 HydrophobicContact CE3-CE1 4.46Å; W240-F266 HydrophobicContact CE3-CG 4.23Å; W240-F266 HydrophobicContact CH2-CG 4.43Å; W240-F266 HydrophobicContact CZ3-CB 3.76Å; W240-F266 AromaticContact CZ3-CD1 3.9Å; W240-F266 HydrophobicContact CZ3-CD1 3.9Å; W240-F266 HydrophobicContact CZ3-CD2 4.21Å; W240-F266 AromaticContact CZ3-CG 3.68Å; W240-F266 HydrophobicContact CZ3-CG 3.68Å
241	L	98.7	Very high	95.5	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	124.7	168	-177.7	70.4	0	0	0	109.5	I88 L89 W95 V118 F119 T222 C223	I88-L241 HydrophobicContact CB-CD2 4.04Å; I88-L241 HydrophobicContact CD1-CD2 4.07Å; I88-L241 HydrophobicContact CG2-CD1 3.73Å; I88-L241 HydrophobicContact CG2-CD2 3.98Å; L89-L241 HydrophobicContact CD1-CB 4.17Å; L89-L241 HydrophobicContact CD2-CB 3.96Å; L89-L241 HydrophobicContact CD2-CD1 4.32Å; L89-L241 HydrophobicContact CG-CB 4.11Å; L89-L241 HydrophobicContact CG-CD2 4.45Å; W95-L241 HydrophobicContact CH2-CD1 3.96Å; V118-L241 HydrophobicContact CB-CD1 3.96Å; V118-L241 HydrophobicContact CG2-CD1 4.03Å; F119-L241 CarbonylContact O-C 3.56Å; F119-L241 WeakPolarHBondContact O-CA 3.12Å; T222-L241 VanDerWaalsContact CA-O 3.3Å; T222-L241 WeakPolarHBondContact CA-O 3.3Å; T222-L241 WeakPolarHBondContact CB-O 3.45Å; T222-L241 PolarHBondContact OG1-O 2.97Å; C223-L241 PolarHBondContact N-O 3.2Å; C223-L241 PolarHBondContact O-N 3.35Å
242	L	98.2	Very high	95.3	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.021	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.7	178.9	-172.8	62.7	0	0	0	110.6	V118 F119 W240 I244 L259 Q263	V118-L242 CarbonylContact C-O 3.53Å; V118-L242 WeakPolarHBondContact CA-O 3.23Å; F119-L242 HydrophobicContact CB-CB 4.42Å; F119-L242 PolarHBondContact N-O 3.08Å; F119-L242 PolarHBondContact O-N 3.13Å; W240-L242 HydrophobicContact CH2-CD1 4.31Å; W240-L242 HydrophobicContact CH2-CD2 4.22Å; W240-L242 HydrophobicContact CZ2-CB 4.5Å; W240-L242 HydrophobicContact CZ2-CD1 3.48Å; W240-L242 VanDerWaalsContact CZ2-CD1 3.48Å; W240-L242 HydrophobicContact CZ2-CD2 4.15Å; W240-L242 HydrophobicContact CZ2-CG 4.26Å; L242-I244 HydrophobicContact CD1-CD1 3.49Å; L242-I244 VanDerWaalsContact CD1-CD1 3.49Å; L242-I244 HydrophobicContact CD1-CG1 3.77Å; L242-I244 HydrophobicContact CD2-CD1 4.18Å; L242-I244 HydrophobicContact CG-CD1 3.98Å; L242-I244 HydrophobicContact CG-CG1 4.15Å; L242-L259 HydrophobicContact CD2-CD2 4.3Å; L242-Q263 HydrophobicContact CD2-CG 3.8Å
243	S	97.1	Very high	95	Very high	7 Å²	7	61.4 Å²	61.4	5%	0.049	32%	0.315	C	S	.	.			trans	-140.7	115.3	173.5	-178.9	0	0	0	0	107.4	V115 N219 G220	V115-S243 WeakPolarHBondContact CG1-OG 3.26Å; N219-S243 CarbonylContact C-O 3.43Å; N219-S243 WeakPolarHBondContact CA-O 3.38Å; G220-S243 PolarHBondContact N-O 3.18Å
244	I	96.3	Very high	94.8	Very high	34 Å²	34	60.3 Å²	60.3	17%	0.174	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	131.3	-175.2	-68.5	177.5	0	0	0	109.9	F183 E218 N219 L242 L246 L259	F183-I244 HydrophobicContact CE1-CD1 4.44Å; F183-I244 HydrophobicContact CE1-CG2 3.93Å; F183-I244 HydrophobicContact CZ-CD1 4.46Å; F183-I244 HydrophobicContact CZ-CG2 4.24Å; E218-I244 CarbonylContact O-C 3.56Å; E218-I244 WeakPolarHBondContact O-CA 3.4Å; N219-I244 WeakPolarHBondContact OD1-CG1 3.17Å; L242-I244 HydrophobicContact CD1-CD1 3.49Å; L242-I244 VanDerWaalsContact CD1-CD1 3.49Å; L242-I244 HydrophobicContact CD1-CG1 3.77Å; L242-I244 HydrophobicContact CD2-CD1 4.18Å; L242-I244 HydrophobicContact CG-CD1 3.98Å; L242-I244 HydrophobicContact CG-CG1 4.15Å; I244-L246 HydrophobicContact CG2-CD2 3.59Å; I244-L246 HydrophobicContact CG2-CG 3.8Å; I244-L259 HydrophobicContact CB-CD1 4.34Å; I244-L259 HydrophobicContact CB-CD2 4.01Å; I244-L259 HydrophobicContact CD1-CD2 3.93Å; I244-L259 HydrophobicContact CG1-CD2 4.43Å; I244-L259 HydrophobicContact CG2-CD2 4.37Å
245	D	94.8	Very high	94.6	Very high	85 Å²	85	57.3 Å²	57.3	46%	0.455	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	106.7	156.6	-175.4	3.5	0	0	0	109.8	A217 E218 K247	A217-D245 WeakPolarHBondContact CA-O 3.47Å; A217-D245 WeakPolarHBondContact CB-O 3.33Å; E218-D245 HydrophobicContact CB-CB 4.47Å; E218-D245 PolarHBondContact N-O 3.05Å; E218-D245 PolarHBondContact O-N 3.33Å; D245-K247 PolarHBondContact O-N 2.95Å; D245-K247 WeakPolarHBondContact OD1-CA 3.44Å; D245-K247 PolarHBondContact OD1-N 3.35Å
246	L	93.7	Very high	94.4	Very high	15 Å²	15	56.2 Å²	56.2	8%	0.079	29%	0.285	C	S	.	.			trans	-73	-10.5	177.7	-69.4	175.8	0	0	0	113.4	V178 R181 F183 I244 I250 I255	V178-L246 HydrophobicContact CG1-CD1 4.37Å; V178-L246 HydrophobicContact CG2-CD1 4.36Å; R181-L246 HydrophobicContact CG-CD2 4.42Å; R181-L246 PolarHBondContact NE-O 2.98Å; F183-L246 HydrophobicContact CZ-CD2 4.33Å; I244-L246 HydrophobicContact CG2-CD2 3.59Å; I244-L246 HydrophobicContact CG2-CG 3.8Å; L246-I250 HydrophobicContact CB-CD1 4.25Å; L246-I255 HydrophobicContact CD1-CG1 4.43Å; L246-I255 HydrophobicContact CD1-CG2 4.24Å
247	K	92.7	Very high	94.1	Very high	54 Å²	54	63.8 Å²	63.8	24%	0.235	32%	0.318	C	S	.	.			trans	52.9	164.6	-172.7	-59.6	-168.8	-171.9	159.4	0	114.8	R181 V215 R216 E218 D245	R181-K247 PolarHBondContact NH2-O 3.49Å; V215-K247 HydrophobicContact CG1-CB 3.79Å; R216-K247 WeakPolarHBondContact O-CD 3.41Å; R216-K247 WeakPolarHBondContact O-CE 3.45Å; R216-K247 PolarHBondContact O-NZ 3.2Å; E218-K247 VanDerWaalsContact OE1-CE 3.26Å; E218-K247 WeakPolarHBondContact OE1-CE 3.39Å; E218-K247 IonicContact OE1-NZ 3.48Å; E218-K247 PolarHBondContact OE1-NZ 3.33Å; D245-K247 PolarHBondContact O-N 2.95Å; D245-K247 WeakPolarHBondContact OD1-CA 3.44Å; D245-K247 PolarHBondContact OD1-N 3.35Å
248	G	89.7	Confident	93.8	Very high	57 Å²	57	60.7 Å²	60.7	59%	0.588	31%	0.306	S	S	*	.	S	Bend	trans	84.6	-171.6	-179.5	0	0	0	0	0	113.7	I250	G248-I250 PolarHBondContact O-N 2.89Å
249	W	88.6	Confident	93.5	Very high	265 Å²	265	61 Å²	61	100%	1.004	31%	0.308	S	S	*	.	S	Bend	trans	-93.6	68.9	-171.7	-74.9	64.3	0	0	0	111.5
250	I	89	Confident	93.4	Very high	29 Å²	29	60.3 Å²	60.3	15%	0.149	30%	0.304	C	S	.	.			trans	-111.8	127.5	179.2	-51.8	165.2	0	0	0	109	V178 L246 G248 K252 I254 I255	V178-I250 HydrophobicContact CB-CD1 4.44Å; V178-I250 HydrophobicContact CG1-CD1 3.79Å; V178-I250 HydrophobicContact CG2-CD1 4.07Å; L246-I250 HydrophobicContact CB-CD1 4.25Å; G248-I250 PolarHBondContact O-N 2.89Å; I250-K252 PolarHBondContact O-N 3.06Å; I250-I254 HydrophobicContact CG2-CB 4.21Å; I250-I254 HydrophobicContact CG2-CG2 4.11Å; I250-I255 HydrophobicContact CB-CD1 4.06Å; I250-I255 HydrophobicContact CB-CG1 3.95Å; I250-I255 HydrophobicContact CG2-CD1 4.3Å; I250-I255 HydrophobicContact CG2-CG1 3.63Å
251	P	92.5	Very high	93.2	Very high	70 Å²	70	62.7 Å²	62.7	46%	0.455	32%	0.317	S	S	.	.			trans	-55.4	133.3	174.4	-27	34.3	0	0	0	112.7	T253 I254 I255	P251-T253 PolarHBondContact O-N 3.34Å; P251-T253 VanDerWaalsContact O-N 3.13Å; P251-I254 HydrophobicContact CB-CD1 4.16Å; P251-I254 HydrophobicContact CB-CG1 4.18Å; P251-I254 HydrophobicContact CG-CD1 3.93Å; P251-I254 HydrophobicContact CG-CG1 4.5Å; P251-I254 WeakPolarHBondContact O-CB 3.29Å; P251-I254 PolarHBondContact O-N 3.09Å; P251-I255 PolarHBondContact O-N 3.34Å; P251-I255 VanDerWaalsContact O-N 3.07Å
252	K	91.9	Very high	93	Very high	169 Å²	169	64.3 Å²	64.3	74%	0.735	33%	0.326	S	S	*	.	H	α-helix	trans	-56.6	-32.1	-178.7	-69.4	-175.4	177.7	-179.1	0	113.6	I250 I254 I255 N256	I250-K252 PolarHBondContact O-N 3.06Å; K252-I254 VanDerWaalsContact C-N 3.34Å; K252-I255 PolarHBondContact O-N 3.35Å; K252-N256 WeakPolarHBondContact O-CB 3.48Å; K252-N256 PolarHBondContact O-N 2.7Å; K252-N256 PolarHBondContact O-ND2 3.08Å; K252-N256 PolarHBondContact O-OD1 3.24Å
253	T	91.3	Very high	92.9	Very high	111 Å²	111	64.1 Å²	64.1	68%	0.681	33%	0.325	S	S	*	.	H	α-helix	trans	-64	-39.5	175.9	47.8	0	0	0	0	112	P251 K257	P251-T253 PolarHBondContact O-N 3.34Å; P251-T253 VanDerWaalsContact O-N 3.13Å; T253-K257 WeakPolarHBondContact O-CB 3.26Å; T253-K257 PolarHBondContact O-N 2.84Å; T253-K257 VanDerWaalsContact O-N 3.16Å
254	I	90.1	Very high	92.9	Very high	66 Å²	66	64.4 Å²	64.4	34%	0.338	33%	0.327	S	S	.	.	H	α-helix	trans	-68.6	-48.2	175.6	-62.4	179.3	0	0	0	109.5	I250 P251 K252 N256 K257 V258	I250-I254 HydrophobicContact CG2-CB 4.21Å; I250-I254 HydrophobicContact CG2-CG2 4.11Å; P251-I254 HydrophobicContact CB-CD1 4.16Å; P251-I254 HydrophobicContact CB-CG1 4.18Å; P251-I254 HydrophobicContact CG-CD1 3.93Å; P251-I254 HydrophobicContact CG-CG1 4.5Å; P251-I254 WeakPolarHBondContact O-CB 3.29Å; P251-I254 PolarHBondContact O-N 3.09Å; K252-I254 VanDerWaalsContact C-N 3.34Å; I254-N256 VanDerWaalsContact C-N 3.32Å; I254-N256 PolarHBondContact O-N 3.16Å; I254-K257 PolarHBondContact O-N 2.9Å; I254-V258 HydrophobicContact CG2-CG2 4.23Å; I254-V258 VanDerWaalsContact O-CG2 3.31Å; I254-V258 WeakPolarHBondContact O-CG2 3.3Å; I254-V258 PolarHBondContact O-N 3.35Å
255	I	91.4	Very high	92.9	Very high	29 Å²	29	64.5 Å²	64.5	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-53.8	-51.2	176.7	-62.4	174.7	0	0	0	110.3	L246 I250 P251 K252 K257 V258 L259	L246-I255 HydrophobicContact CD1-CG1 4.43Å; L246-I255 HydrophobicContact CD1-CG2 4.24Å; I250-I255 HydrophobicContact CB-CD1 4.06Å; I250-I255 HydrophobicContact CB-CG1 3.95Å; I250-I255 HydrophobicContact CG2-CD1 4.3Å; I250-I255 HydrophobicContact CG2-CG1 3.63Å; P251-I255 PolarHBondContact O-N 3.34Å; P251-I255 VanDerWaalsContact O-N 3.07Å; K252-I255 PolarHBondContact O-N 3.35Å; I255-K257 VanDerWaalsContact C-N 3.33Å; I255-K257 PolarHBondContact O-N 2.9Å; I255-V258 PolarHBondContact O-N 2.71Å; I255-L259 HydrophobicContact CG2-CD1 3.68Å; I255-L259 HydrophobicContact CG2-CG 4.11Å; I255-L259 WeakPolarHBondContact O-CB 3.46Å; I255-L259 WeakPolarHBondContact O-CG 3.22Å; I255-L259 PolarHBondContact O-N 2.83Å
256	N	92.8	Very high	93	Very high	41 Å²	41	60.8 Å²	60.8	22%	0.219	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-41.6	-176.9	-69.5	-12.5	0	0	0	112.5	K117 F119 K252 I254 S260	K117-N256 PolarHBondContact NZ-ND2 2.68Å; F119-N256 HydrophobicContact CZ-CB 3.91Å; K252-N256 WeakPolarHBondContact O-CB 3.48Å; K252-N256 PolarHBondContact O-N 2.7Å; K252-N256 PolarHBondContact O-ND2 3.08Å; K252-N256 PolarHBondContact O-OD1 3.24Å; I254-N256 VanDerWaalsContact C-N 3.32Å; I254-N256 PolarHBondContact O-N 3.16Å; N256-S260 PolarHBondContact O-N 2.82Å; N256-S260 PolarHBondContact O-OG 2.96Å; N256-S260 VanDerWaalsContact O-OG 3.09Å
257	K	92.7	Very high	93.3	Very high	159 Å²	159	60.2 Å²	60.2	69%	0.691	31%	0.305	S	S	*	.	H	α-helix	trans	-67.1	-41.6	177.5	-177.9	174.8	-179.1	179.3	0	111.8	T253 I254 I255 S260 Q261	T253-K257 WeakPolarHBondContact O-CB 3.26Å; T253-K257 PolarHBondContact O-N 2.84Å; T253-K257 VanDerWaalsContact O-N 3.16Å; I254-K257 PolarHBondContact O-N 2.9Å; I255-K257 VanDerWaalsContact C-N 3.33Å; I255-K257 PolarHBondContact O-N 2.9Å; K257-S260 PolarHBondContact O-OG 2.82Å; K257-Q261 VanDerWaalsContact O-CB 3.26Å; K257-Q261 WeakPolarHBondContact O-CB 3.47Å; K257-Q261 PolarHBondContact O-N 2.85Å; K257-Q261 VanDerWaalsContact O-N 3.08Å
258	V	91.8	Very high	93.5	Very high	23 Å²	23	61 Å²	61	14%	0.139	31%	0.311	C	S	.	.	H	α-helix	trans	-62.6	-51.1	177	170.1	0	0	0	0	109.7	T173 V177 I254 I255 S260 Q261 T262	T173-V258 HydrophobicContact CG2-CG1 4.37Å; V177-V258 HydrophobicContact CG2-CG2 4.3Å; I254-V258 HydrophobicContact CG2-CG2 4.23Å; I254-V258 VanDerWaalsContact O-CG2 3.31Å; I254-V258 WeakPolarHBondContact O-CG2 3.3Å; I254-V258 PolarHBondContact O-N 3.35Å; I255-V258 PolarHBondContact O-N 2.71Å; V258-S260 PolarHBondContact O-N 2.76Å; V258-Q261 PolarHBondContact O-N 2.94Å; V258-T262 WeakPolarHBondContact O-CB 3.39Å; V258-T262 PolarHBondContact O-N 3.45Å; V258-T262 PolarHBondContact O-OG1 3.48Å
259	L	93.7	Very high	93.9	Very high	9 Å²	9	60.4 Å²	60.4	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-42.6	-177.3	-67.2	179.7	0	0	0	113	F119 L242 I244 I255 T262 Q263	F119-L259 HydrophobicContact CD2-CB 4.04Å; F119-L259 HydrophobicContact CD2-CD1 4.12Å; F119-L259 HydrophobicContact CE2-CB 3.91Å; F119-L259 HydrophobicContact CE2-CD1 3.74Å; F119-L259 HydrophobicContact CE2-CG 4.49Å; F119-L259 HydrophobicContact CZ-CB 4.32Å; L242-L259 HydrophobicContact CD2-CD2 4.3Å; I244-L259 HydrophobicContact CB-CD1 4.34Å; I244-L259 HydrophobicContact CB-CD2 4.01Å; I244-L259 HydrophobicContact CD1-CD2 3.93Å; I244-L259 HydrophobicContact CG1-CD2 4.43Å; I244-L259 HydrophobicContact CG2-CD2 4.37Å; I255-L259 HydrophobicContact CG2-CD1 3.68Å; I255-L259 HydrophobicContact CG2-CG 4.11Å; I255-L259 WeakPolarHBondContact O-CB 3.46Å; I255-L259 WeakPolarHBondContact O-CG 3.22Å; I255-L259 PolarHBondContact O-N 2.83Å; L259-T262 PolarHBondContact O-N 3.42Å; L259-Q263 PolarHBondContact O-N 3.31Å
260	S	95.3	Very high	94.4	Very high	9 Å²	9	47.8 Å²	47.8	6%	0.063	25%	0.245	C	C	.	.	H	α-helix	trans	-67	-40.8	177.4	61.7	0	0	0	0	112.1	N256 K257 V258 Q263 V264	N256-S260 PolarHBondContact O-N 2.82Å; N256-S260 PolarHBondContact O-OG 2.96Å; N256-S260 VanDerWaalsContact O-OG 3.09Å; K257-S260 PolarHBondContact O-OG 2.82Å; V258-S260 PolarHBondContact O-N 2.76Å; S260-Q263 PolarHBondContact O-N 3.45Å; S260-V264 PolarHBondContact O-N 2.99Å
261	Q	94.3	Very high	94.8	Very high	81 Å²	81	49.6 Å²	49.6	38%	0.379	25%	0.25	S	S	.	.	H	α-helix	trans	-66	-41.5	176.5	-171.4	60.4	49.6	0	0	111.8	K257 V258 Q263 V264 D265	K257-Q261 VanDerWaalsContact O-CB 3.26Å; K257-Q261 WeakPolarHBondContact O-CB 3.47Å; K257-Q261 PolarHBondContact O-N 2.85Å; K257-Q261 VanDerWaalsContact O-N 3.08Å; V258-Q261 PolarHBondContact O-N 2.94Å; Q261-Q263 PolarHBondContact O-N 3.26Å; Q261-V264 WeakPolarHBondContact O-CB 3.47Å; Q261-V264 PolarHBondContact O-N 3.48Å; Q261-D265 PolarHBondContact NE2-OD1 3.29Å; Q261-D265 VanDerWaalsContact O-CG 3.26Å; Q261-D265 PolarHBondContact O-N 3.44Å
262	T	94.3	Very high	95	Very high	33 Å²	33	51.9 Å²	51.9	20%	0.202	26%	0.255	C	S	.	.	H	α-helix	trans	-56.6	-36	176.6	-64.1	0	0	0	0	112.1	N149 V258 L259 F266	N149-T262 HydrophobicContact CB-CG2 4.39Å; V258-T262 WeakPolarHBondContact O-CB 3.39Å; V258-T262 PolarHBondContact O-N 3.45Å; V258-T262 PolarHBondContact O-OG1 3.48Å; L259-T262 PolarHBondContact O-N 3.42Å; T262-F266 VanDerWaalsContact O-CB 3.24Å; T262-F266 WeakPolarHBondContact O-CB 3.4Å; T262-F266 PolarHBondContact O-N 3.4Å
263	Q	97.6	Very high	95.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-68.3	-40.7	175.3	-69.1	-163.6	-58.1	0	0	112.9	V107 F119 L121 W240 L242 L259 S260 Q261 F266 A267	V107-Q263 HydrophobicContact CG2-CB 4.09Å; F119-Q263 VanDerWaalsContact CB-OE1 3.28Å; L121-Q263 HydrophobicContact CB-CB 4.07Å; L121-Q263 HydrophobicContact CB-CG 4.41Å; L121-Q263 HydrophobicContact CD1-CB 4.25Å; L121-Q263 HydrophobicContact CD2-CB 4.26Å; L121-Q263 WeakPolarHBondContact CD2-O 3.35Å; L121-Q263 HydrophobicContact CG-CB 4.42Å; W240-Q263 HydrophobicContact CE3-CB 4.36Å; W240-Q263 HydrophobicContact CE3-CG 3.86Å; W240-Q263 HydrophobicContact CH2-CG 4.49Å; W240-Q263 HydrophobicContact CZ3-CB 4.32Å; W240-Q263 HydrophobicContact CZ3-CG 3.83Å; W240-Q263 PolarHBondContact O-NE2 3.48Å; L242-Q263 HydrophobicContact CD2-CG 3.8Å; L259-Q263 PolarHBondContact O-N 3.31Å; S260-Q263 PolarHBondContact O-N 3.45Å; Q261-Q263 PolarHBondContact O-N 3.26Å; Q263-F266 PolarHBondContact O-N 2.98Å; Q263-A267 PolarHBondContact O-N 3.36Å; Q263-A267 VanDerWaalsContact O-N 3.12Å
264	V	97	Very high	95.5	Very high	13 Å²	13	41.7 Å²	41.7	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-64.1	-47.2	175.3	177	0	0	0	0	110.4	I99 V107 S260 Q261 F266 A267 N268	I99-V264 HydrophobicContact CD1-CG2 3.8Å; I99-V264 HydrophobicContact CG2-CG2 4.12Å; V107-V264 HydrophobicContact CG2-CG2 3.73Å; S260-V264 PolarHBondContact O-N 2.99Å; Q261-V264 WeakPolarHBondContact O-CB 3.47Å; Q261-V264 PolarHBondContact O-N 3.48Å; V264-F266 VanDerWaalsContact C-N 3.33Å; V264-F266 PolarHBondContact O-N 3.48Å; V264-A267 WeakPolarHBondContact O-CB 3.49Å; V264-A267 PolarHBondContact O-N 3.43Å; V264-N268 PolarHBondContact O-N 2.82Å; V264-N268 VanDerWaalsContact O-N 3.09Å; V264-N268 PolarHBondContact O-ND2 3.34Å
265	D	96.1	Very high	95.6	Very high	36 Å²	36	40.7 Å²	40.7	19%	0.193	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-45.1	178.8	-65	-14.6	0	0	0	110.5	Q261 A267 N268 H269	Q261-D265 PolarHBondContact NE2-OD1 3.29Å; Q261-D265 VanDerWaalsContact O-CG 3.26Å; Q261-D265 PolarHBondContact O-N 3.44Å; D265-A267 VanDerWaalsContact C-N 3.32Å; D265-A267 PolarHBondContact O-N 2.93Å; D265-N268 PolarHBondContact O-N 3.49Å; D265-N268 VanDerWaalsContact O-N 3.16Å; D265-H269 PolarHBondContact O-N 3.2Å; D265-H269 PolarHBondContact O-ND1 2.85Å
266	F	97.6	Very high	95.4	Very high	8 Å²	8	43.4 Å²	43.4	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-55.4	-46.2	175.5	177.2	-89.4	0	0	0	112	L136 M143 W146 F238 W240 T262 Q263 V264 N268 H269 L270	L136-F266 HydrophobicContact CD2-CE2 4.47Å; L136-F266 HydrophobicContact CD2-CZ 3.77Å; M143-F266 HydrophobicContact SD-CE2 4.37Å; W146-F266 HydrophobicContact CH2-CD2 4.43Å; W146-F266 AromaticContact CH2-CE2 3.81Å; W146-F266 HydrophobicContact CH2-CE2 3.81Å; W146-F266 HydrophobicContact CH2-CZ 4.22Å; W146-F266 HydrophobicContact CZ3-CE2 4.36Å; F238-F266 HydrophobicContact CE1-CE1 4.1Å; F238-F266 AromaticContact CZ-CE1 3.66Å; F238-F266 HydrophobicContact CZ-CE1 3.66Å; F238-F266 HydrophobicContact CZ-CZ 4.45Å; W240-F266 AromaticContact CE3-CD1 3.96Å; W240-F266 HydrophobicContact CE3-CD1 3.96Å; W240-F266 HydrophobicContact CE3-CE1 4.46Å; W240-F266 HydrophobicContact CE3-CG 4.23Å; W240-F266 HydrophobicContact CH2-CG 4.43Å; W240-F266 HydrophobicContact CZ3-CB 3.76Å; W240-F266 AromaticContact CZ3-CD1 3.9Å; W240-F266 HydrophobicContact CZ3-CD1 3.9Å; W240-F266 HydrophobicContact CZ3-CD2 4.21Å; W240-F266 AromaticContact CZ3-CG 3.68Å; W240-F266 HydrophobicContact CZ3-CG 3.68Å; T262-F266 VanDerWaalsContact O-CB 3.24Å; T262-F266 WeakPolarHBondContact O-CB 3.4Å; T262-F266 PolarHBondContact O-N 3.4Å; Q263-F266 PolarHBondContact O-N 2.98Å; V264-F266 VanDerWaalsContact C-N 3.33Å; V264-F266 PolarHBondContact O-N 3.48Å; F266-N268 VanDerWaalsContact C-N 3.31Å; F266-N268 PolarHBondContact O-N 3.39Å; F266-H269 PolarHBondContact O-N 3.48Å; F266-L270 HydrophobicContact CE1-CD2 3.85Å; F266-L270 HydrophobicContact CZ-CD2 4.27Å; F266-L270 VanDerWaalsContact O-CB 3.25Å; F266-L270 WeakPolarHBondContact O-CB 3.31Å; F266-L270 PolarHBondContact O-N 3.03Å
267	A	98.1	Very high	95	Very high	2 Å²	2	43.4 Å²	43.4	2%	0.017	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-40.8	178.2	0	0	0	0	0	112.2	L121 V123 Q263 V264 D265 R271	L121-A267 HydrophobicContact CD2-CB 4.16Å; V123-A267 HydrophobicContact CG2-CB 3.95Å; Q263-A267 PolarHBondContact O-N 3.36Å; Q263-A267 VanDerWaalsContact O-N 3.12Å; V264-A267 WeakPolarHBondContact O-CB 3.49Å; V264-A267 PolarHBondContact O-N 3.43Å; D265-A267 VanDerWaalsContact C-N 3.32Å; D265-A267 PolarHBondContact O-N 2.93Å; A267-R271 WeakPolarHBondContact O-CG 3.21Å; A267-R271 PolarHBondContact O-N 3.09Å
268	N	97.7	Very high	94.2	Very high	71 Å²	71	37.4 Å²	37.4	38%	0.38	20%	0.195	S	C	.	.	H	α-helix	trans	-68.1	-47.2	178.9	-67.9	-28.4	0	0	0	112	V264 D265 F266 L270 R271 Q272	V264-N268 PolarHBondContact O-N 2.82Å; V264-N268 VanDerWaalsContact O-N 3.09Å; V264-N268 PolarHBondContact O-ND2 3.34Å; D265-N268 PolarHBondContact O-N 3.49Å; D265-N268 VanDerWaalsContact O-N 3.16Å; F266-N268 VanDerWaalsContact C-N 3.31Å; F266-N268 PolarHBondContact O-N 3.39Å; N268-L270 VanDerWaalsContact C-N 3.34Å; N268-L270 PolarHBondContact O-N 2.94Å; N268-R271 PolarHBondContact O-N 2.85Å; N268-R271 PolarHBondContact OD1-NH1 3.47Å; N268-Q272 PolarHBondContact O-N 2.82Å; N268-Q272 VanDerWaalsContact O-N 3.09Å
269	H	98	Very high	93.1	Very high	44 Å²	44	40.1 Å²	40.1	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-39.5	177.6	-64.3	115.5	0	0	0	111.8	W146 P148 D265 F266 R271 Q272 R273	W146-H269 HydrophobicContact CE3-CB 3.91Å; W146-H269 HydrophobicContact CZ3-CB 4.1Å; P148-H269 WeakPolarHBondContact CD-NE2 3.39Å; D265-H269 PolarHBondContact O-N 3.2Å; D265-H269 PolarHBondContact O-ND1 2.85Å; F266-H269 PolarHBondContact O-N 3.48Å; H269-R271 PolarHBondContact O-N 2.95Å; H269-Q272 PolarHBondContact O-N 2.71Å; H269-R273 WeakPolarHBondContact O-CB 3.45Å; H269-R273 PolarHBondContact O-N 3.03Å
270	L	98.1	Very high	91.8	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-42.7	175.4	-179.7	58.9	0	0	0	111.4	L125 L132 L136 W146 F238 F266 N268 Q272 R273 M274	L125-L270 HydrophobicContact CD1-CD2 3.79Å; L125-L270 HydrophobicContact CD1-CG 4.44Å; L132-L270 HydrophobicContact CD2-CD1 4.21Å; L132-L270 HydrophobicContact CD2-CD2 4.15Å; L132-L270 HydrophobicContact CD2-CG 4.25Å; L136-L270 HydrophobicContact CD1-CD2 4.19Å; L136-L270 HydrophobicContact CD2-CD1 4.07Å; L136-L270 HydrophobicContact CD2-CD2 4.44Å; W146-L270 HydrophobicContact CH2-CB 4.33Å; W146-L270 HydrophobicContact CH2-CD1 4.07Å; W146-L270 HydrophobicContact CZ2-CD1 4.49Å; W146-L270 HydrophobicContact CZ3-CB 4.07Å; W146-L270 HydrophobicContact CZ3-CD1 4.47Å; F238-L270 HydrophobicContact CE2-CD2 4.18Å; F238-L270 HydrophobicContact CZ-CD2 4.48Å; F266-L270 HydrophobicContact CE1-CD2 3.85Å; F266-L270 HydrophobicContact CZ-CD2 4.27Å; F266-L270 VanDerWaalsContact O-CB 3.25Å; F266-L270 WeakPolarHBondContact O-CB 3.31Å; F266-L270 PolarHBondContact O-N 3.03Å; N268-L270 VanDerWaalsContact C-N 3.34Å; N268-L270 PolarHBondContact O-N 2.94Å; L270-Q272 VanDerWaalsContact C-N 3.35Å; L270-Q272 PolarHBondContact O-N 2.75Å; L270-R273 PolarHBondContact O-N 2.98Å; L270-M274 HydrophobicContact CD1-CG 3.97Å; L270-M274 HydrophobicContact CD1-SD 4.31Å; L270-M274 HydrophobicContact CG-CG 4.42Å; L270-M274 WeakPolarHBondContact O-CG 3.34Å; L270-M274 PolarHBondContact O-N 3.45Å
271	R	97.5	Very high	90.3	Very high	67 Å²	67	48.4 Å²	48.4	25%	0.253	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-47.1	174.5	-77.6	-178.3	-176.4	104.7	-5.7	112.3	N103 D105 L125 A267 N268 H269 M274 A275	N103-R271 PolarHBondContact ND2-NH1 3.37Å; N103-R271 PolarHBondContact ND2-NH2 3.5Å; D105-R271 IonicContact OD1-CZ 3.32Å; D105-R271 IonicContact OD1-NH1 2.7Å; D105-R271 IonicContact OD1-NH2 2.77Å; D105-R271 PolarHBondContact OD1-NH2 2.56Å; D105-R271 IonicContact OD2-CZ 2.83Å; D105-R271 IonicContact OD2-NH1 3.9Å; D105-R271 PolarHBondContact OD2-NH1 2.74Å; D105-R271 IonicContact OD2-NH2 3.88Å; D105-R271 PolarHBondContact OD2-NH2 2.77Å; L125-R271 HydrophobicContact CD2-CG 3.58Å; A267-R271 WeakPolarHBondContact O-CG 3.21Å; A267-R271 PolarHBondContact O-N 3.09Å; N268-R271 PolarHBondContact O-N 2.85Å; N268-R271 PolarHBondContact OD1-NH1 3.47Å; H269-R271 PolarHBondContact O-N 2.95Å; R271-M274 PolarHBondContact O-N 2.81Å; R271-A275 WeakPolarHBondContact O-CB 3.34Å; R271-A275 PolarHBondContact O-N 3.43Å
272	Q	97	Very high	88.5	Confident	118 Å²	118	51.2 Å²	51.2	55%	0.551	27%	0.271	S	S	*	.	H	α-helix	trans	-60.5	-50	178.7	-176.6	177.2	0.6	0	0	110.8	N268 H269 L270 M274 A275 D276	N268-Q272 PolarHBondContact O-N 2.82Å; N268-Q272 VanDerWaalsContact O-N 3.09Å; H269-Q272 PolarHBondContact O-N 2.71Å; L270-Q272 VanDerWaalsContact C-N 3.35Å; L270-Q272 PolarHBondContact O-N 2.75Å; Q272-M274 VanDerWaalsContact C-N 3.27Å; Q272-M274 PolarHBondContact O-N 3.29Å; Q272-A275 PolarHBondContact O-N 2.72Å; Q272-A275 VanDerWaalsContact O-N 3.1Å; Q272-D276 PolarHBondContact O-N 3.41Å
273	R	97.2	Very high	86	Confident	57 Å²	57	55.7 Å²	55.7	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-53.6	-44.8	177.4	176.4	55.7	170.7	-175.7	-2.2	112.5	E135 W146 H269 L270 N277	E135-R273 HydrophobicContact CG-CG 4.24Å; E135-R273 IonicContact OE1-CZ 3.59Å; E135-R273 IonicContact OE1-NE 3.69Å; E135-R273 PolarHBondContact OE1-NE 3.27Å; E135-R273 IonicContact OE1-NH2 3.53Å; E135-R273 PolarHBondContact OE1-NH2 2.63Å; E135-R273 IonicContact OE2-NE 3.7Å; E135-R273 IonicContact OE2-NH2 3.34Å; W146-R273 HydrophobicContact CB-CB 4.16Å; W146-R273 HydrophobicContact CB-CG 4.21Å; W146-R273 HydrophobicContact CD2-CB 3.98Å; W146-R273 HydrophobicContact CD2-CG 3.9Å; W146-R273 HydrophobicContact CE3-CB 4.15Å; W146-R273 HydrophobicContact CG-CB 3.99Å; W146-R273 HydrophobicContact CG-CG 3.72Å; H269-R273 WeakPolarHBondContact O-CB 3.45Å; H269-R273 PolarHBondContact O-N 3.03Å; L270-R273 PolarHBondContact O-N 2.98Å; R273-N277 PolarHBondContact O-N 2.97Å; R273-N277 VanDerWaalsContact O-N 3.15Å
274	M	96.2	Very high	83.8	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-72.4	-32.1	-178.8	-63.7	-53.3	-61.5	0	0	112.9	Q127 N131 L132 E135 L270 R271 Q272 S278	Q127-M274 HydrophobicContact CG-CB 3.66Å; Q127-M274 HydrophobicContact CG-CE 4.12Å; Q127-M274 HydrophobicContact CG-CG 4Å; N131-M274 HydrophobicContact CB-CE 3.64Å; L132-M274 HydrophobicContact CD2-CE 4.35Å; L132-M274 HydrophobicContact CD2-CG 3.89Å; L132-M274 HydrophobicContact CD2-SD 4.2Å; E135-M274 HydrophobicContact CB-SD 3.87Å; E135-M274 HydrophobicContact CG-SD 3.98Å; L270-M274 HydrophobicContact CD1-CG 3.97Å; L270-M274 HydrophobicContact CD1-SD 4.31Å; L270-M274 HydrophobicContact CG-CG 4.42Å; L270-M274 WeakPolarHBondContact O-CG 3.34Å; L270-M274 PolarHBondContact O-N 3.45Å; R271-M274 PolarHBondContact O-N 2.81Å; Q272-M274 VanDerWaalsContact C-N 3.27Å; Q272-M274 PolarHBondContact O-N 3.29Å; M274-S278 PolarHBondContact O-N 2.81Å; M274-S278 VanDerWaalsContact O-N 3.14Å; M274-S278 PolarHBondContact O-OG 3.34Å
275	A	93.5	Very high	81.8	Confident	44 Å²	44	62.6 Å²	62.6	36%	0.364	35%	0.35	S	S	.	.	H	α-helix	trans	-67.5	-43.2	173.9	0	0	0	0	0	111.7	R271 Q272 N277 S278 V279	R271-A275 WeakPolarHBondContact O-CB 3.34Å; R271-A275 PolarHBondContact O-N 3.43Å; Q272-A275 PolarHBondContact O-N 2.72Å; Q272-A275 VanDerWaalsContact O-N 3.1Å; A275-N277 VanDerWaalsContact C-N 3.32Å; A275-N277 PolarHBondContact O-N 3.5Å; A275-S278 WeakPolarHBondContact CA-OG 3.37Å; A275-S278 PolarHBondContact O-N 3.33Å; A275-S278 PolarHBondContact O-OG 3.02Å; A275-V279 PolarHBondContact O-N 3.26Å
276	D	87.4	Confident	79.9	Confident	86 Å²	86	65.1 Å²	65.1	46%	0.46	38%	0.376	S	S	.	.	H	α-helix	trans	-63.5	-38.9	178.2	-64.9	-17.9	0	0	0	111.6	Q272 V279 S280	Q272-D276 PolarHBondContact O-N 3.41Å; D276-V279 PolarHBondContact O-N 3.16Å; D276-S280 PolarHBondContact O-N 3.31Å; D276-S280 VanDerWaalsContact O-N 3.12Å; D276-S280 PolarHBondContact O-OG 3.45Å
277	N	83.3	Confident	78	Confident	41 Å²	41	72.9 Å²	72.9	22%	0.219	43%	0.429	C	S	.	.	H	α-helix	trans	-66.4	-37.5	175.2	-74.8	-9.4	0	0	0	112.3	R273 A275 S280 M281	R273-N277 PolarHBondContact O-N 2.97Å; R273-N277 VanDerWaalsContact O-N 3.15Å; A275-N277 VanDerWaalsContact C-N 3.32Å; A275-N277 PolarHBondContact O-N 3.5Å; N277-S280 PolarHBondContact O-N 2.95Å; N277-M281 WeakPolarHBondContact O-CG 3.47Å; N277-M281 PolarHBondContact O-N 3.41Å
278	S	77	Confident	77	Confident	34 Å²	34	76.4 Å²	76.4	24%	0.238	45%	0.449	C	S	.	.	H	α-helix	trans	-64.5	-43.1	176.4	48	0	0	0	0	112.8	M274 A275 S280 M281 E282	M274-S278 PolarHBondContact O-N 2.81Å; M274-S278 VanDerWaalsContact O-N 3.14Å; M274-S278 PolarHBondContact O-OG 3.34Å; A275-S278 WeakPolarHBondContact CA-OG 3.37Å; A275-S278 PolarHBondContact O-N 3.33Å; A275-S278 PolarHBondContact O-OG 3.02Å; S278-S280 VanDerWaalsContact C-N 3.3Å; S278-S280 PolarHBondContact O-N 3.37Å; S278-M281 PolarHBondContact O-N 3.5Å; S278-E282 WeakPolarHBondContact O-CG 3.22Å; S278-E282 PolarHBondContact O-N 3.31Å
279	V	68.4	Low	75.9	Confident	79 Å²	79	76.7 Å²	76.7	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-62.6	-41.5	177.1	175.9	0	0	0	0	110.7	A275 D276 M281 E282 M283	A275-V279 PolarHBondContact O-N 3.26Å; D276-V279 PolarHBondContact O-N 3.16Å; V279-M281 VanDerWaalsContact C-N 3.35Å; V279-M281 PolarHBondContact O-N 3.34Å; V279-E282 PolarHBondContact O-N 2.95Å; V279-M283 HydrophobicContact CG1-SD 4.25Å; V279-M283 WeakPolarHBondContact O-CG 3.37Å; V279-M283 PolarHBondContact O-N 3.29Å
280	S	66.8	Low	74.6	Confident	76 Å²	76	78.5 Å²	78.5	53%	0.531	47%	0.467	S	S	.	.	H	α-helix	trans	-62.8	-39.6	177.9	-57.9	0	0	0	0	112.5	D276 N277 S278 A284	D276-S280 PolarHBondContact O-N 3.31Å; D276-S280 VanDerWaalsContact O-N 3.12Å; D276-S280 PolarHBondContact O-OG 3.45Å; N277-S280 PolarHBondContact O-N 2.95Å; S278-S280 VanDerWaalsContact C-N 3.3Å; S278-S280 PolarHBondContact O-N 3.37Å; S280-A284 WeakPolarHBondContact O-CB 3.42Å; S280-A284 PolarHBondContact O-N 3.46Å
281	M	62.8	Low	73.2	Confident	117 Å²	117	83.1 Å²	83.1	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-70.2	-38.9	177	-72.2	-175.5	-66.4	0	0	112.6	N277 S278 V279 A284 A285	N277-M281 WeakPolarHBondContact O-CG 3.47Å; N277-M281 PolarHBondContact O-N 3.41Å; S278-M281 PolarHBondContact O-N 3.5Å; V279-M281 VanDerWaalsContact C-N 3.35Å; V279-M281 PolarHBondContact O-N 3.34Å; M281-A284 PolarHBondContact O-N 3.47Å; M281-A285 WeakPolarHBondContact O-CB 3.37Å; M281-A285 PolarHBondContact O-N 2.91Å
282	E	58	Low	71.7	Confident	139 Å²	139	84.1 Å²	84.1	65%	0.65	51%	0.51	S	S	*	.	H	α-helix	trans	-65.5	-42.2	176.1	-73.6	176.2	-179.3	0	0	111.8	S278 V279 A285 A286	S278-E282 WeakPolarHBondContact O-CG 3.22Å; S278-E282 PolarHBondContact O-N 3.31Å; V279-E282 PolarHBondContact O-N 2.95Å; E282-A285 PolarHBondContact O-N 3.33Å; E282-A286 PolarHBondContact O-N 3.08Å
283	M	40.8	Very low	70	Confident	128 Å²	128	81.9 Å²	81.9	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-64	-41.6	174.8	-72.2	-175.4	68.7	0	0	112.2	V279 A285 A286 C287	V279-M283 HydrophobicContact CG1-SD 4.25Å; V279-M283 WeakPolarHBondContact O-CG 3.37Å; V279-M283 PolarHBondContact O-N 3.29Å; M283-A285 VanDerWaalsContact C-N 3.29Å; M283-A285 PolarHBondContact O-N 3.47Å; M283-A286 PolarHBondContact O-N 3.28Å; M283-C287 PolarHBondContact O-N 3.43Å
284	A	51.7	Low	68.1	Low	71 Å²	71	83.6 Å²	83.6	59%	0.587	53%	0.528	S	S	*	.	H	α-helix	trans	-66.3	-29.8	177.9	0	0	0	0	0	113.1	S280 M281	S280-A284 WeakPolarHBondContact O-CB 3.42Å; S280-A284 PolarHBondContact O-N 3.46Å; M281-A284 PolarHBondContact O-N 3.47Å
285	A	53.9	Low	65.9	Low	87 Å²	87	89.3 Å²	89.3	72%	0.719	56%	0.564	S	S	*	*	H	α-helix	trans	-79.5	-18.1	175.4	0	0	0	0	0	113.5	M281 E282 M283	M281-A285 WeakPolarHBondContact O-CB 3.37Å; M281-A285 PolarHBondContact O-N 2.91Å; E282-A285 PolarHBondContact O-N 3.33Å; M283-A285 VanDerWaalsContact C-N 3.29Å; M283-A285 PolarHBondContact O-N 3.47Å
286	A	58	Low	63.6	Low	89 Å²	89	93.1 Å²	93.1	74%	0.736	58%	0.581	S	S	*	*	H	α-helix	trans	-91.5	-11.2	179.9	0	0	0	0	0	114	E282 M283	E282-A286 PolarHBondContact O-N 3.08Å; M283-A286 PolarHBondContact O-N 3.28Å
287	C	55.8	Low	61.5	Low	170 Å²	170	93.7 Å²	93.7	100%	1.149	59%	0.592	S	S	*	*			trans	-94	0	174	-68.1	0	0	0	0	111.5	M283	M283-C287 PolarHBondContact O-N 3.43Å

Retrieved 287 of 287 residues in 48.3 ms (Link to these results)

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