A0A3Q0KHK1_SCHMA Loading...

Neuroendocrine protein 7B2

AlphaFold DB , UniProt , Accession A0A3Q0KHK1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 342 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	52.2	Low	229 Å²	229	156.7 Å²	156.7	100%	1.128	75%	0.745	S	S	*	*				0	66.9	0	-159.8	176.4	-168.8	0	0	108.3	Q3	M1-Q3 PolarHBondContact O-N 2.99Å
2	F	43.3	Very low	53.2	Low	209 Å²	209	155.2 Å²	155.2	92%	0.917	73%	0.733	S	S	*	*			trans	-90.3	95.2	176.4	-86	-81.7	0	0	0	107.3	M4	F2-M4 VanDerWaalsContact C-N 3.35Å; F2-M4 PolarHBondContact O-N 2.7Å
3	Q	44.3	Very low	54.3	Low	167 Å²	167	154.5 Å²	154.5	78%	0.78	73%	0.726	S	S	*	*			trans	-62.5	100.7	165.9	-80.6	-172.7	-29.6	0	0	107.3	M1 N5	M1-Q3 PolarHBondContact O-N 2.99Å; Q3-N5 PolarHBondContact O-N 3.02Å
4	M	46.7	Very low	55.4	Low	162 Å²	162	151.7 Å²	151.7	80%	0.798	72%	0.718	S	S	*	*			trans	-60.4	112.6	167.1	-73.4	-172.4	74	0	0	107.2	F2 L6	F2-M4 VanDerWaalsContact C-N 3.35Å; F2-M4 PolarHBondContact O-N 2.7Å; M4-L6 PolarHBondContact O-N 3.1Å
5	N	49.8	Very low	56.3	Low	130 Å²	130	148.1 Å²	148.1	70%	0.695	70%	0.704	S	S	*	*			trans	-56.9	113.4	180	-84.9	-58.9	0	0	0	109.1	Q3 K7 E8	Q3-N5 PolarHBondContact O-N 3.02Å; N5-K7 PolarHBondContact O-N 3.16Å; N5-E8 PolarHBondContact O-N 3.42Å
6	L	51.3	Low	57.1	Low	162 Å²	162	145.6 Å²	145.6	85%	0.848	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	15	175	-77	152.2	0	0	0	114.6	M4 P9	M4-L6 PolarHBondContact O-N 3.1Å; L6-P9 WeakPolarHBondContact O-CD 3.45Å
7	K	53.1	Low	57.7	Low	179 Å²	179	145.3 Å²	145.3	78%	0.778	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-15.4	175.3	-80.9	-174.5	174.5	-179.8	0	113.6	N5	N5-K7 PolarHBondContact O-N 3.16Å
8	E	56.8	Low	58.2	Low	111 Å²	111	143.2 Å²	143.2	52%	0.519	68%	0.683	S	S	.	*	S	Bend	trans	-78.6	-20.2	-179.6	-67.7	-169.9	170.7	0	0	117.7	N5 R10 I11 F12	N5-E8 PolarHBondContact O-N 3.42Å; E8-R10 VanDerWaalsContact C-N 3.26Å; E8-R10 PolarHBondContact O-N 2.75Å; E8-I11 PolarHBondContact O-N 2.98Å; E8-I11 VanDerWaalsContact O-N 3.14Å; E8-F12 HydrophobicContact CB-CD2 4.48Å; E8-F12 WeakPolarHBondContact O-CD2 3.2Å; E8-F12 PolarHBondContact O-N 2.89Å
9	P	57.9	Low	58.6	Low	65 Å²	65	140.2 Å²	140.2	42%	0.422	68%	0.675	S	S	.	*	H	α-helix	trans	-65.4	-32.6	-177.2	25.9	-31.7	0	0	0	111.6	L6 I11 F12 F13	L6-P9 WeakPolarHBondContact O-CD 3.45Å; P9-I11 VanDerWaalsContact C-N 3.32Å; P9-I11 PolarHBondContact O-N 3.23Å; P9-F12 PolarHBondContact O-N 2.9Å; P9-F13 VanDerWaalsContact O-CD2 3.26Å; P9-F13 WeakPolarHBondContact O-CD2 3.18Å; P9-F13 PolarHBondContact O-N 2.97Å
10	R	62.9	Low	58.7	Low	208 Å²	208	138.2 Å²	138.2	79%	0.785	67%	0.668	S	S	*	*	H	α-helix	trans	-66	-33.6	177.9	-71.7	-171.4	175.9	178.3	-0.9	113	E8 L14	E8-R10 VanDerWaalsContact C-N 3.26Å; E8-R10 PolarHBondContact O-N 2.75Å; R10-L14 PolarHBondContact O-N 3.45Å; R10-L14 VanDerWaalsContact O-N 3.07Å
11	I	68.2	Low	58.7	Low	102 Å²	102	136 Å²	136	52%	0.523	66%	0.659	S	S	.	*	H	α-helix	trans	-73.8	-41.8	179.3	-61.3	167.9	0	0	0	109.7	E8 P9 F13 L14 L15	E8-I11 PolarHBondContact O-N 2.98Å; E8-I11 VanDerWaalsContact O-N 3.14Å; P9-I11 VanDerWaalsContact C-N 3.32Å; P9-I11 PolarHBondContact O-N 3.23Å; I11-F13 PolarHBondContact O-N 3.27Å; I11-L14 PolarHBondContact O-N 2.9Å; I11-L15 HydrophobicContact CG2-CD1 4.12Å; I11-L15 WeakPolarHBondContact O-CB 2.98Å; I11-L15 PolarHBondContact O-N 3.21Å
12	F	65.2	Low	59.7	Low	138 Å²	138	128.1 Å²	128.1	61%	0.605	63%	0.626	S	S	*	*	H	α-helix	trans	-60.9	-43.7	174	-87.7	-79.5	0	0	0	112.1	E8 P9 L14 L15 L16	E8-F12 HydrophobicContact CB-CD2 4.48Å; E8-F12 WeakPolarHBondContact O-CD2 3.2Å; E8-F12 PolarHBondContact O-N 2.89Å; P9-F12 PolarHBondContact O-N 2.9Å; F12-L14 PolarHBondContact O-N 3.49Å; F12-L15 PolarHBondContact O-N 3.16Å; F12-L16 WeakPolarHBondContact O-CB 3.45Å; F12-L16 PolarHBondContact O-N 2.79Å
13	F	67.6	Low	60.3	Low	147 Å²	147	120.3 Å²	120.3	65%	0.645	60%	0.604	S	S	*	*	H	α-helix	trans	-62.5	-40.9	175.6	-90.6	-74.1	0	0	0	112.7	P9 I11 L16 F17	P9-F13 VanDerWaalsContact O-CD2 3.26Å; P9-F13 WeakPolarHBondContact O-CD2 3.18Å; P9-F13 PolarHBondContact O-N 2.97Å; I11-F13 PolarHBondContact O-N 3.27Å; F13-L16 PolarHBondContact O-N 2.82Å; F13-F17 WeakPolarHBondContact O-CB 3.18Å; F13-F17 PolarHBondContact O-N 3.25Å
14	L	68.6	Low	60.7	Low	115 Å²	115	119.8 Å²	119.8	60%	0.602	60%	0.602	S	S	*	*	H	α-helix	trans	-65.5	-41.6	175.8	-86	164.6	0	0	0	112.3	R10 I11 F12 F17 L18	R10-L14 PolarHBondContact O-N 3.45Å; R10-L14 VanDerWaalsContact O-N 3.07Å; I11-L14 PolarHBondContact O-N 2.9Å; F12-L14 PolarHBondContact O-N 3.49Å; L14-F17 PolarHBondContact O-N 2.75Å; L14-L18 WeakPolarHBondContact O-CB 3.27Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.16Å
15	L	69.2	Low	61.2	Low	97 Å²	97	118.6 Å²	118.6	51%	0.508	60%	0.598	S	S	.	*	H	α-helix	trans	-63	-43.4	175.1	-86.4	166.1	0	0	0	111.6	I11 F12 F17 L18 T19	I11-L15 HydrophobicContact CG2-CD1 4.12Å; I11-L15 WeakPolarHBondContact O-CB 2.98Å; I11-L15 PolarHBondContact O-N 3.21Å; F12-L15 PolarHBondContact O-N 3.16Å; L15-F17 VanDerWaalsContact C-N 3.3Å; L15-F17 PolarHBondContact O-N 2.8Å; L15-L18 PolarHBondContact O-N 2.78Å; L15-T19 WeakPolarHBondContact O-CG2 3.32Å; L15-T19 PolarHBondContact O-N 3.08Å; L15-T19 PolarHBondContact O-OG1 2.83Å
16	L	68.6	Low	61.4	Low	108 Å²	108	118 Å²	118	57%	0.565	59%	0.594	S	S	*	*	H	α-helix	trans	-66.7	-33.1	177.7	-143.6	112.8	0	0	0	112.2	F12 F13 T19 N20	F12-L16 WeakPolarHBondContact O-CB 3.45Å; F12-L16 PolarHBondContact O-N 2.79Å; F13-L16 PolarHBondContact O-N 2.82Å; L16-T19 WeakPolarHBondContact CA-OG1 3.47Å; L16-T19 PolarHBondContact O-OG1 2.82Å; L16-T19 VanDerWaalsContact O-OG1 3.04Å; L16-N20 PolarHBondContact O-N 3.08Å; L16-N20 VanDerWaalsContact O-N 3.16Å; L16-N20 PolarHBondContact O-ND2 3.26Å
17	F	68	Low	61.4	Low	141 Å²	141	113.3 Å²	113.3	62%	0.618	58%	0.578	S	S	*	*	H	α-helix	trans	-68.8	-42	172.2	-120.6	-85.6	0	0	0	111.7	F13 L14 L15 N20 L21	F13-F17 WeakPolarHBondContact O-CB 3.18Å; F13-F17 PolarHBondContact O-N 3.25Å; L14-F17 PolarHBondContact O-N 2.75Å; L15-F17 VanDerWaalsContact C-N 3.3Å; L15-F17 PolarHBondContact O-N 2.8Å; F17-N20 PolarHBondContact O-N 3.41Å; F17-L21 HydrophobicContact CD1-CD1 4.2Å; F17-L21 WeakPolarHBondContact O-CB 3.44Å; F17-L21 WeakPolarHBondContact O-CG 3.47Å; F17-L21 PolarHBondContact O-N 2.94Å
18	L	66.3	Low	62	Low	107 Å²	107	106.9 Å²	106.9	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-66.3	-38.4	177.6	-76	170.5	0	0	0	111.9	L14 L15 C22	L14-L18 WeakPolarHBondContact O-CB 3.27Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.16Å; L15-L18 PolarHBondContact O-N 2.78Å; L18-C22 WeakPolarHBondContact O-CB 2.91Å; L18-C22 PolarHBondContact O-N 3.27Å
19	T	65.9	Low	62.8	Low	87 Å²	87	108.4 Å²	108.4	53%	0.534	57%	0.567	S	S	.	*	H	α-helix	trans	-68.7	-37	175.2	54.7	0	0	0	0	112.1	L15 L16 C22 G23	L15-T19 WeakPolarHBondContact O-CG2 3.32Å; L15-T19 PolarHBondContact O-N 3.08Å; L15-T19 PolarHBondContact O-OG1 2.83Å; L16-T19 WeakPolarHBondContact CA-OG1 3.47Å; L16-T19 PolarHBondContact O-OG1 2.82Å; L16-T19 VanDerWaalsContact O-OG1 3.04Å; T19-C22 PolarHBondContact O-N 3.28Å; T19-G23 PolarHBondContact O-N 2.7Å
20	N	61.6	Low	63.8	Low	99 Å²	99	112 Å²	112	53%	0.529	57%	0.573	S	S	.	*	H	α-helix	trans	-67.2	-43.3	174.1	-87.8	-67.3	0	0	0	112.3	L16 F17 C22 G23 Q24	L16-N20 PolarHBondContact O-N 3.08Å; L16-N20 VanDerWaalsContact O-N 3.16Å; L16-N20 PolarHBondContact O-ND2 3.26Å; F17-N20 PolarHBondContact O-N 3.41Å; N20-C22 VanDerWaalsContact C-N 3.32Å; N20-C22 PolarHBondContact O-N 3.42Å; N20-G23 PolarHBondContact O-N 2.77Å; N20-Q24 VanDerWaalsContact O-CG 3.23Å; N20-Q24 WeakPolarHBondContact O-CG 3.45Å; N20-Q24 PolarHBondContact O-N 2.81Å
21	L	58.9	Low	64.9	Low	92 Å²	92	105.6 Å²	105.6	48%	0.482	56%	0.555	S	S	.	*	H	α-helix	trans	-63.2	-39.9	173.7	-80.5	163.9	0	0	0	111.4	F17 Q24 I25	F17-L21 HydrophobicContact CD1-CD1 4.2Å; F17-L21 WeakPolarHBondContact O-CB 3.44Å; F17-L21 WeakPolarHBondContact O-CG 3.47Å; F17-L21 PolarHBondContact O-N 2.94Å; L21-Q24 PolarHBondContact O-N 2.91Å; L21-I25 WeakPolarHBondContact O-CD1 3.48Å; L21-I25 VanDerWaalsContact O-CG1 3.25Å; L21-I25 WeakPolarHBondContact O-CG1 3.29Å; L21-I25 PolarHBondContact O-N 3.44Å
22	C	58.6	Low	65.6	Low	65 Å²	65	107.4 Å²	107.4	44%	0.439	56%	0.561	S	S	.	*	H	α-helix	trans	-64.9	-41.7	175.8	-155.5	0	0	0	0	111.2	L18 T19 N20 Q24 I25 L26	L18-C22 WeakPolarHBondContact O-CB 2.91Å; L18-C22 PolarHBondContact O-N 3.27Å; T19-C22 PolarHBondContact O-N 3.28Å; N20-C22 VanDerWaalsContact C-N 3.32Å; N20-C22 PolarHBondContact O-N 3.42Å; C22-Q24 VanDerWaalsContact C-N 3.31Å; C22-Q24 PolarHBondContact O-N 3.31Å; C22-I25 PolarHBondContact O-N 3.29Å; C22-L26 VanDerWaalsContact O-CB 3.31Å; C22-L26 WeakPolarHBondContact O-CB 3.21Å; C22-L26 WeakPolarHBondContact O-CD1 3.46Å; C22-L26 PolarHBondContact O-N 2.83Å
23	G	56.3	Low	66.4	Low	44 Å²	44	103.9 Å²	103.9	45%	0.454	54%	0.544	S	S	.	.	H	α-helix	trans	-61.1	-36.4	174.8	0	0	0	0	0	113.3	T19 N20 A27	T19-G23 PolarHBondContact O-N 2.7Å; N20-G23 PolarHBondContact O-N 2.77Å; G23-A27 PolarHBondContact O-N 3.04Å; G23-A27 VanDerWaalsContact O-N 3.09Å
24	Q	53.7	Low	67.2	Low	157 Å²	157	99.5 Å²	99.5	73%	0.734	53%	0.527	S	S	*	.	H	α-helix	trans	-73.3	-30.4	175.8	-64.8	-99.1	-46.8	0	0	112.8	N20 L21 C22 A27	N20-Q24 VanDerWaalsContact O-CG 3.23Å; N20-Q24 WeakPolarHBondContact O-CG 3.45Å; N20-Q24 PolarHBondContact O-N 2.81Å; L21-Q24 PolarHBondContact O-N 2.91Å; C22-Q24 VanDerWaalsContact C-N 3.31Å; C22-Q24 PolarHBondContact O-N 3.31Å; Q24-A27 WeakPolarHBondContact O-CB 3.02Å
25	I	56.4	Low	68.1	Low	137 Å²	137	98.6 Å²	98.6	70%	0.703	52%	0.523	S	S	*	.	H	α-helix	trans	-81.3	-28.8	176.3	-62.9	162.1	0	0	0	111.2	L21 C22 A27	L21-I25 WeakPolarHBondContact O-CD1 3.48Å; L21-I25 VanDerWaalsContact O-CG1 3.25Å; L21-I25 WeakPolarHBondContact O-CG1 3.29Å; L21-I25 PolarHBondContact O-N 3.44Å; C22-I25 PolarHBondContact O-N 3.29Å; I25-A27 VanDerWaalsContact C-N 3.31Å
26	L	54.2	Low	68.9	Low	118 Å²	118	100.9 Å²	100.9	62%	0.618	53%	0.525	S	S	*	.	H	α-helix	trans	-78.9	-12	172.5	-87.5	149.3	0	0	0	113.3	C22 S28	C22-L26 VanDerWaalsContact O-CB 3.31Å; C22-L26 WeakPolarHBondContact O-CB 3.21Å; C22-L26 WeakPolarHBondContact O-CD1 3.46Å; C22-L26 PolarHBondContact O-N 2.83Å; L26-S28 WeakPolarHBondContact O-CA 3.13Å; L26-S28 WeakPolarHBondContact O-CB 3.46Å; L26-S28 PolarHBondContact O-N 2.98Å
27	A	52.3	Low	69.7	Low	62 Å²	62	99 Å²	99	51%	0.512	52%	0.515	S	S	.	.	S	Bend	trans	-59.8	89.9	161.1	0	0	0	0	0	106.2	G23 Q24 I25 D31	G23-A27 PolarHBondContact O-N 3.04Å; G23-A27 VanDerWaalsContact O-N 3.09Å; Q24-A27 WeakPolarHBondContact O-CB 3.02Å; I25-A27 VanDerWaalsContact C-N 3.31Å; A27-D31 WeakPolarHBondContact CA-OD2 3.27Å
28	S	65.5	Low	70.7	Confident	44 Å²	44	96.2 Å²	96.2	31%	0.308	51%	0.505	S	S	.	.			trans	-81.1	162.8	-156.2	57.9	0	0	0	0	108.1	L26 Y30 D31 Q32	L26-S28 WeakPolarHBondContact O-CA 3.13Å; L26-S28 WeakPolarHBondContact O-CB 3.46Å; L26-S28 PolarHBondContact O-N 2.98Å; S28-Y30 PolarHBondContact O-N 2.9Å; S28-Y30 WeakPolarHBondContact OG-CB 3.01Å; S28-Y30 PolarHBondContact OG-N 2.01Å; S28-D31 PolarHBondContact N-OD2 2.83Å; S28-D31 PolarHBondContact O-N 3.06Å; S28-D31 PolarHBondContact OG-N 2.74Å; S28-D31 PolarHBondContact OG-OD2 3.01Å; S28-Q32 PolarHBondContact O-N 3.05Å
29	N	72.8	Confident	71.9	Confident	144 Å²	144	95.3 Å²	95.3	77%	0.77	50%	0.501	S	S	*	.	H	α-helix	trans	-52.3	-20.1	165.6	-68	-29.1	0	0	0	111.9	Y33	N29-Y33 VanDerWaalsContact O-CB 3.26Å; N29-Y33 WeakPolarHBondContact O-CB 3.44Å; N29-Y33 PolarHBondContact O-N 3.42Å; N29-Y33 VanDerWaalsContact O-N 3.13Å
30	Y	79	Confident	73	Confident	140 Å²	140	94.3 Å²	94.3	55%	0.549	49%	0.493	S	S	.	.	H	α-helix	trans	-74.1	-43.6	174.8	-171.7	-97.8	0	0	0	112.7	S28 Q32 Y33 I34	S28-Y30 PolarHBondContact O-N 2.9Å; S28-Y30 WeakPolarHBondContact OG-CB 3.01Å; S28-Y30 PolarHBondContact OG-N 2.01Å; Y30-Q32 VanDerWaalsContact C-N 3.33Å; Y30-Q32 PolarHBondContact O-N 3.07Å; Y30-Y33 HydrophobicContact CD2-CD1 4.33Å; Y30-Y33 HydrophobicContact CE2-CD1 4.37Å; Y30-Y33 CarbonylContact O-C 3.59Å; Y30-Y33 WeakPolarHBondContact O-CA 3.47Å; Y30-Y33 WeakPolarHBondContact O-CB 3.45Å; Y30-Y33 PolarHBondContact O-N 3.14Å; Y30-Y33 VanDerWaalsContact O-N 3.08Å; Y30-I34 HydrophobicContact CD1-CG1 3.9Å; Y30-I34 HydrophobicContact CE1-CD1 3.92Å; Y30-I34 HydrophobicContact CE1-CG1 3.55Å; Y30-I34 HydrophobicContact CE2-CD1 4.37Å; Y30-I34 HydrophobicContact CE2-CG1 4.48Å; Y30-I34 WeakPolarHBondContact O-CG1 3.37Å; Y30-I34 PolarHBondContact O-N 3.03Å
31	D	85.9	Confident	74.3	Confident	74 Å²	74	91.4 Å²	91.4	40%	0.396	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-44.2	177.6	-58.3	-50.3	0	0	0	110.7	A27 S28 Y33 I34 D35	A27-D31 WeakPolarHBondContact CA-OD2 3.27Å; S28-D31 PolarHBondContact N-OD2 2.83Å; S28-D31 PolarHBondContact O-N 3.06Å; S28-D31 PolarHBondContact OG-N 2.74Å; S28-D31 PolarHBondContact OG-OD2 3.01Å; D31-Y33 VanDerWaalsContact C-N 3.28Å; D31-Y33 PolarHBondContact O-N 3.47Å; D31-I34 PolarHBondContact O-N 2.82Å; D31-D35 PolarHBondContact O-N 3.5Å
32	Q	82.3	Confident	75.7	Confident	139 Å²	139	92.8 Å²	92.8	65%	0.65	49%	0.488	S	S	*	.	H	α-helix	trans	-62.5	-35.2	174	-172.1	179.8	2.1	0	0	112.5	S28 Y30 R36	S28-Q32 PolarHBondContact O-N 3.05Å; Y30-Q32 VanDerWaalsContact C-N 3.33Å; Y30-Q32 PolarHBondContact O-N 3.07Å; Q32-R36 WeakPolarHBondContact O-CB 3.37Å; Q32-R36 PolarHBondContact O-N 2.99Å
33	Y	82.1	Confident	77.2	Confident	65 Å²	65	95.2 Å²	95.2	26%	0.255	50%	0.496	S	S	.	.	H	α-helix	trans	-67.7	-42.7	175.2	168.4	-104.9	0	0	0	111.9	N29 Y30 D31 R36 L37	N29-Y33 VanDerWaalsContact O-CB 3.26Å; N29-Y33 WeakPolarHBondContact O-CB 3.44Å; N29-Y33 PolarHBondContact O-N 3.42Å; N29-Y33 VanDerWaalsContact O-N 3.13Å; Y30-Y33 HydrophobicContact CD2-CD1 4.33Å; Y30-Y33 HydrophobicContact CE2-CD1 4.37Å; Y30-Y33 CarbonylContact O-C 3.59Å; Y30-Y33 WeakPolarHBondContact O-CA 3.47Å; Y30-Y33 WeakPolarHBondContact O-CB 3.45Å; Y30-Y33 PolarHBondContact O-N 3.14Å; Y30-Y33 VanDerWaalsContact O-N 3.08Å; D31-Y33 VanDerWaalsContact C-N 3.28Å; D31-Y33 PolarHBondContact O-N 3.47Å; Y33-R36 PolarHBondContact O-N 3.32Å; Y33-L37 HydrophobicContact CD1-CD1 3.95Å; Y33-L37 HydrophobicContact CD2-CG 4.45Å; Y33-L37 HydrophobicContact CE1-CD1 3.31Å; Y33-L37 HydrophobicContact CE1-CG 4.12Å; Y33-L37 HydrophobicContact CE2-CD1 4.06Å; Y33-L37 HydrophobicContact CE2-CD2 4.28Å; Y33-L37 HydrophobicContact CE2-CG 3.99Å; Y33-L37 WeakPolarHBondContact O-CG 3.21Å; Y33-L37 PolarHBondContact O-N 3.49Å
34	I	84.1	Confident	78.8	Confident	54 Å²	54	99 Å²	99	28%	0.277	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-44.7	175.6	-66.7	-65.2	0	0	0	110.5	Y30 D31 R36 L37 I38	Y30-I34 HydrophobicContact CD1-CG1 3.9Å; Y30-I34 HydrophobicContact CE1-CD1 3.92Å; Y30-I34 HydrophobicContact CE1-CG1 3.55Å; Y30-I34 HydrophobicContact CE2-CD1 4.37Å; Y30-I34 HydrophobicContact CE2-CG1 4.48Å; Y30-I34 WeakPolarHBondContact O-CG1 3.37Å; Y30-I34 PolarHBondContact O-N 3.03Å; D31-I34 PolarHBondContact O-N 2.82Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.46Å; I34-L37 HydrophobicContact CD1-CD1 4.35Å; I34-L37 PolarHBondContact O-N 3.04Å; I34-I38 HydrophobicContact CG2-CD1 3.79Å; I34-I38 HydrophobicContact CG2-CG1 4.43Å; I34-I38 VanDerWaalsContact O-CG1 3.27Å; I34-I38 WeakPolarHBondContact O-CG1 3.41Å; I34-I38 PolarHBondContact O-N 3.15Å
35	D	87.8	Confident	80.4	Confident	97 Å²	97	94.4 Å²	94.4	52%	0.519	48%	0.481	S	S	.	.	H	α-helix	trans	-58.1	-41.9	174.7	-76.4	-21.2	0	0	0	111.9	D31 I38 N39	D31-D35 PolarHBondContact O-N 3.5Å; D35-I38 PolarHBondContact O-N 3.06Å; D35-N39 VanDerWaalsContact O-CG 3.27Å; D35-N39 PolarHBondContact O-N 3.17Å; D35-N39 PolarHBondContact O-ND2 3.35Å; D35-N39 VanDerWaalsContact O-ND2 3.15Å
36	R	87	Confident	81.9	Confident	145 Å²	145	91.7 Å²	91.7	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-64.4	-46.8	175.7	-178.5	-179.9	174	-175.1	1.1	111.8	Q32 Y33 I34 I38 N39 D40	Q32-R36 WeakPolarHBondContact O-CB 3.37Å; Q32-R36 PolarHBondContact O-N 2.99Å; Y33-R36 PolarHBondContact O-N 3.32Å; I34-R36 VanDerWaalsContact C-N 3.28Å; I34-R36 PolarHBondContact O-N 3.46Å; R36-I38 VanDerWaalsContact C-N 3.28Å; R36-I38 PolarHBondContact O-N 3.39Å; R36-N39 PolarHBondContact O-N 3.46Å; R36-N39 VanDerWaalsContact O-N 3.14Å; R36-D40 IonicContact NE-OD2 2.83Å; R36-D40 WeakPolarHBondContact O-CB 3.5Å; R36-D40 PolarHBondContact O-N 2.79Å
37	L	84.1	Confident	83.7	Confident	69 Å²	69	90 Å²	90	36%	0.361	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-40.8	177.2	-79.3	177.2	0	0	0	111.9	Y33 I34 N39 D40 G41	Y33-L37 HydrophobicContact CD1-CD1 3.95Å; Y33-L37 HydrophobicContact CD2-CG 4.45Å; Y33-L37 HydrophobicContact CE1-CD1 3.31Å; Y33-L37 HydrophobicContact CE1-CG 4.12Å; Y33-L37 HydrophobicContact CE2-CD1 4.06Å; Y33-L37 HydrophobicContact CE2-CD2 4.28Å; Y33-L37 HydrophobicContact CE2-CG 3.99Å; Y33-L37 WeakPolarHBondContact O-CG 3.21Å; Y33-L37 PolarHBondContact O-N 3.49Å; I34-L37 HydrophobicContact CD1-CD1 4.35Å; I34-L37 PolarHBondContact O-N 3.04Å; L37-N39 VanDerWaalsContact C-N 3.33Å; L37-N39 PolarHBondContact O-N 3.09Å; L37-D40 PolarHBondContact O-N 2.9Å; L37-G41 PolarHBondContact O-N 3.36Å
38	I	89	Confident	85.3	Confident	81 Å²	81	91.7 Å²	91.7	42%	0.415	45%	0.454	S	S	.	.	H	α-helix	trans	-62.5	-42.8	176.4	-69.3	165.5	0	0	0	110.3	I34 D35 R36 K42	I34-I38 HydrophobicContact CG2-CD1 3.79Å; I34-I38 HydrophobicContact CG2-CG1 4.43Å; I34-I38 VanDerWaalsContact O-CG1 3.27Å; I34-I38 WeakPolarHBondContact O-CG1 3.41Å; I34-I38 PolarHBondContact O-N 3.15Å; D35-I38 PolarHBondContact O-N 3.06Å; R36-I38 VanDerWaalsContact C-N 3.28Å; R36-I38 PolarHBondContact O-N 3.39Å; I38-K42 HydrophobicContact CG2-CD 4.27Å; I38-K42 VanDerWaalsContact O-CG 3.28Å; I38-K42 WeakPolarHBondContact O-CG 3.34Å; I38-K42 PolarHBondContact O-N 3.05Å
39	N	91.4	Very high	86.3	Confident	88 Å²	88	90.6 Å²	90.6	47%	0.471	44%	0.444	S	S	.	.	H	α-helix	trans	-68.6	-44.3	178.3	-70	-29.8	0	0	0	112.5	D35 R36 L37 G41 K42 L43	D35-N39 VanDerWaalsContact O-CG 3.27Å; D35-N39 PolarHBondContact O-N 3.17Å; D35-N39 PolarHBondContact O-ND2 3.35Å; D35-N39 VanDerWaalsContact O-ND2 3.15Å; R36-N39 PolarHBondContact O-N 3.46Å; R36-N39 VanDerWaalsContact O-N 3.14Å; L37-N39 VanDerWaalsContact C-N 3.33Å; L37-N39 PolarHBondContact O-N 3.09Å; N39-G41 VanDerWaalsContact C-N 3.31Å; N39-G41 PolarHBondContact O-N 3.36Å; N39-K42 PolarHBondContact O-N 2.86Å; N39-L43 WeakPolarHBondContact O-CG 3.46Å; N39-L43 PolarHBondContact O-N 3.48Å
40	D	89.9	Confident	87.1	Confident	67 Å²	67	91.7 Å²	91.7	36%	0.358	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-40.7	177	-70.3	-12.2	0	0	0	110.3	R36 L37 L43 L44	R36-D40 IonicContact NE-OD2 2.83Å; R36-D40 WeakPolarHBondContact O-CB 3.5Å; R36-D40 PolarHBondContact O-N 2.79Å; L37-D40 PolarHBondContact O-N 2.9Å; D40-L43 PolarHBondContact O-N 3.14Å; D40-L44 WeakPolarHBondContact O-CG 3.21Å; D40-L44 PolarHBondContact O-N 2.66Å
41	G	88.4	Confident	87.5	Confident	37 Å²	37	91 Å²	91	38%	0.381	44%	0.444	S	S	.	.	H	α-helix	trans	-62.4	-42.6	174.5	0	0	0	0	0	113.1	L37 N39 L44 Y45	L37-G41 PolarHBondContact O-N 3.36Å; N39-G41 VanDerWaalsContact C-N 3.31Å; N39-G41 PolarHBondContact O-N 3.36Å; G41-L44 PolarHBondContact O-N 3.48Å; G41-Y45 WeakPolarHBondContact O-CB 3.33Å; G41-Y45 PolarHBondContact O-N 3.27Å
42	K	89.5	Confident	87.4	Confident	121 Å²	121	89.9 Å²	89.9	53%	0.526	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-44.1	174.5	-75.9	171.1	-178	175.7	0	112.3	I38 N39 L44 Y45 D46	I38-K42 HydrophobicContact CG2-CD 4.27Å; I38-K42 VanDerWaalsContact O-CG 3.28Å; I38-K42 WeakPolarHBondContact O-CG 3.34Å; I38-K42 PolarHBondContact O-N 3.05Å; N39-K42 PolarHBondContact O-N 2.86Å; K42-L44 VanDerWaalsContact C-N 3.34Å; K42-L44 PolarHBondContact O-N 3.1Å; K42-Y45 WeakPolarHBondContact O-CB 3.33Å; K42-Y45 PolarHBondContact O-N 3.36Å; K42-D46 VanDerWaalsContact O-CG 3.3Å; K42-D46 PolarHBondContact O-N 2.72Å
43	L	89.8	Confident	87.3	Confident	117 Å²	117	87.8 Å²	87.8	61%	0.613	44%	0.437	S	S	*	.	H	α-helix	trans	-62.4	-41.8	178.2	-72.7	172	0	0	0	112	N39 D40 D46 D47	N39-L43 WeakPolarHBondContact O-CG 3.46Å; N39-L43 PolarHBondContact O-N 3.48Å; D40-L43 PolarHBondContact O-N 3.14Å; L43-D46 PolarHBondContact O-N 3.15Å; L43-D47 WeakPolarHBondContact O-CB 3.07Å; L43-D47 PolarHBondContact O-N 3.4Å
44	L	89	Confident	87	Confident	124 Å²	124	86.9 Å²	86.9	65%	0.649	45%	0.447	S	S	*	.	H	α-helix	trans	-65.3	-41.4	175.5	-74.2	171	0	0	0	112	D40 G41 K42 D47 Y48	D40-L44 WeakPolarHBondContact O-CG 3.21Å; D40-L44 PolarHBondContact O-N 2.66Å; G41-L44 PolarHBondContact O-N 3.48Å; K42-L44 VanDerWaalsContact C-N 3.34Å; K42-L44 PolarHBondContact O-N 3.1Å; L44-D47 PolarHBondContact O-N 2.97Å; L44-Y48 VanDerWaalsContact O-CB 3.3Å; L44-Y48 WeakPolarHBondContact O-CB 3.45Å; L44-Y48 PolarHBondContact O-N 3.05Å
45	Y	87.4	Confident	86.8	Confident	59 Å²	59	85 Å²	85	23%	0.231	44%	0.438	C	S	.	.	H	α-helix	trans	-60.2	-49.7	175.1	179.7	-93.7	0	0	0	111.3	G41 K42 D47 Y48 I49 L59 Y63	G41-Y45 WeakPolarHBondContact O-CB 3.33Å; G41-Y45 PolarHBondContact O-N 3.27Å; K42-Y45 WeakPolarHBondContact O-CB 3.33Å; K42-Y45 PolarHBondContact O-N 3.36Å; Y45-D47 PolarHBondContact O-N 3.26Å; Y45-Y48 WeakPolarHBondContact O-CB 3.49Å; Y45-Y48 PolarHBondContact O-N 2.94Å; Y45-I49 HydrophobicContact CD1-CG1 4.12Å; Y45-I49 HydrophobicContact CE1-CD1 4.44Å; Y45-I49 HydrophobicContact CE1-CG1 3.7Å; Y45-I49 HydrophobicContact CE2-CD1 4.35Å; Y45-I49 HydrophobicContact CE2-CG1 4.26Å; Y45-I49 WeakPolarHBondContact O-CG1 3.29Å; Y45-I49 PolarHBondContact O-N 2.83Å; Y45-L59 HydrophobicContact CD2-CD1 4.3Å; Y45-L59 HydrophobicContact CE2-CB 3.99Å; Y45-L59 HydrophobicContact CE2-CD1 3.78Å; Y45-Y63 HydrophobicContact CD2-CE2 4.34Å; Y45-Y63 HydrophobicContact CE2-CE2 4.18Å
46	D	89.3	Confident	86.6	Confident	81 Å²	81	84.8 Å²	84.8	43%	0.433	43%	0.433	S	S	.	.	H	α-helix	trans	-62.3	-41.1	-179.9	-71	-12.4	0	0	0	112.3	K42 L43 K50	K42-D46 VanDerWaalsContact O-CG 3.3Å; K42-D46 PolarHBondContact O-N 2.72Å; L43-D46 PolarHBondContact O-N 3.15Å; D46-K50 VanDerWaalsContact O-CG 3.27Å; D46-K50 WeakPolarHBondContact O-CG 3.32Å; D46-K50 PolarHBondContact O-N 3.38Å
47	D	90.8	Very high	86.2	Confident	81 Å²	81	80.3 Å²	80.3	43%	0.433	42%	0.424	S	S	.	.	H	α-helix	trans	-64.1	-41.9	175.2	-173.2	50	0	0	0	111.4	L43 L44 Y45 K50 Q51	L43-D47 WeakPolarHBondContact O-CB 3.07Å; L43-D47 PolarHBondContact O-N 3.4Å; L44-D47 PolarHBondContact O-N 2.97Å; Y45-D47 PolarHBondContact O-N 3.26Å; D47-K50 PolarHBondContact O-N 2.94Å; D47-Q51 VanDerWaalsContact CG-NE2 3.33Å; D47-Q51 WeakPolarHBondContact O-CG 3.36Å; D47-Q51 PolarHBondContact O-N 3.15Å; D47-Q51 VanDerWaalsContact O-N 3.12Å; D47-Q51 PolarHBondContact OD1-NE2 3.18Å; D47-Q51 PolarHBondContact OD2-NE2 3.32Å
48	Y	85.9	Confident	86.1	Confident	98 Å²	98	77.1 Å²	77.1	38%	0.384	41%	0.408	S	S	.	.	H	α-helix	trans	-63.8	-44.1	177.4	-173.7	-92.4	0	0	0	112.6	L44 Y45 Q51 N52 L55 L59	L44-Y48 VanDerWaalsContact O-CB 3.3Å; L44-Y48 WeakPolarHBondContact O-CB 3.45Å; L44-Y48 PolarHBondContact O-N 3.05Å; Y45-Y48 WeakPolarHBondContact O-CB 3.49Å; Y45-Y48 PolarHBondContact O-N 2.94Å; Y48-Q51 PolarHBondContact O-N 3.01Å; Y48-N52 HydrophobicContact CE1-CB 4.19Å; Y48-N52 WeakPolarHBondContact O-CB 3.27Å; Y48-N52 PolarHBondContact O-N 3.46Å; Y48-N52 PolarHBondContact O-ND2 3.23Å; Y48-N52 VanDerWaalsContact O-ND2 3.13Å; Y48-L55 HydrophobicContact CE1-CB 4.36Å; Y48-L55 HydrophobicContact CE1-CD2 4.32Å; Y48-L59 HydrophobicContact CD1-CD1 3.67Å; Y48-L59 HydrophobicContact CE1-CD1 3.76Å
49	I	87.2	Confident	85.7	Confident	21 Å²	21	74.6 Å²	74.6	11%	0.108	40%	0.395	C	S	.	.	H	α-helix	trans	-64.2	-40.1	176.6	-67.5	-59	0	0	0	111.4	Y45 Q51 N52 P53 E56 L59	Y45-I49 HydrophobicContact CD1-CG1 4.12Å; Y45-I49 HydrophobicContact CE1-CD1 4.44Å; Y45-I49 HydrophobicContact CE1-CG1 3.7Å; Y45-I49 HydrophobicContact CE2-CD1 4.35Å; Y45-I49 HydrophobicContact CE2-CG1 4.26Å; Y45-I49 WeakPolarHBondContact O-CG1 3.29Å; Y45-I49 PolarHBondContact O-N 2.83Å; I49-Q51 VanDerWaalsContact C-N 3.27Å; I49-Q51 PolarHBondContact O-N 3.31Å; I49-N52 CarbonylContact O-C 3.15Å; I49-N52 PolarHBondContact O-N 3.02Å; I49-N52 VanDerWaalsContact O-N 3.16Å; I49-P53 WeakPolarHBondContact O-CA 3.38Å; I49-P53 VanDerWaalsContact O-N 3.1Å; I49-E56 HydrophobicContact CD1-CB 3.85Å; I49-E56 HydrophobicContact CD1-CG 4.14Å; I49-E56 HydrophobicContact CG2-CB 4.41Å; I49-E56 HydrophobicContact CG2-CG 4.41Å; I49-L59 HydrophobicContact CD1-CD1 3.73Å
50	K	88.5	Confident	85.2	Confident	168 Å²	168	76.2 Å²	76.2	73%	0.73	40%	0.4	S	S	*	.	H	α-helix	trans	-60	-38.6	175	-76.6	171.3	-173.5	170	0	112.3	D46 D47	D46-K50 VanDerWaalsContact O-CG 3.27Å; D46-K50 WeakPolarHBondContact O-CG 3.32Å; D46-K50 PolarHBondContact O-N 3.38Å; D47-K50 PolarHBondContact O-N 2.94Å
51	Q	87.2	Confident	84.7	Confident	124 Å²	124	74.8 Å²	74.8	58%	0.579	39%	0.389	S	S	*	.	H	α-helix	trans	-76.6	-30.3	177	-66.9	174	29.1	0	0	112.1	D47 Y48 I49	D47-Q51 VanDerWaalsContact CG-NE2 3.33Å; D47-Q51 WeakPolarHBondContact O-CG 3.36Å; D47-Q51 PolarHBondContact O-N 3.15Å; D47-Q51 VanDerWaalsContact O-N 3.12Å; D47-Q51 PolarHBondContact OD1-NE2 3.18Å; D47-Q51 PolarHBondContact OD2-NE2 3.32Å; Y48-Q51 PolarHBondContact O-N 3.01Å; I49-Q51 VanDerWaalsContact C-N 3.27Å; I49-Q51 PolarHBondContact O-N 3.31Å
52	N	84.5	Confident	84.3	Confident	52 Å²	52	74.3 Å²	74.3	28%	0.278	38%	0.378	S	S	.	.			trans	-133.1	69.6	-172.9	-55.9	-83.2	0	0	0	112	Y48 I49 G54 L55	Y48-N52 HydrophobicContact CE1-CB 4.19Å; Y48-N52 WeakPolarHBondContact O-CB 3.27Å; Y48-N52 PolarHBondContact O-N 3.46Å; Y48-N52 PolarHBondContact O-ND2 3.23Å; Y48-N52 VanDerWaalsContact O-ND2 3.13Å; I49-N52 CarbonylContact O-C 3.15Å; I49-N52 PolarHBondContact O-N 3.02Å; I49-N52 VanDerWaalsContact O-N 3.16Å; N52-G54 PolarHBondContact O-N 3Å; N52-L55 HydrophobicContact CB-CB 4.39Å; N52-L55 HydrophobicContact CB-CD1 3.78Å; N52-L55 PolarHBondContact O-N 3.02Å; N52-L55 VanDerWaalsContact O-N 3.11Å
53	P	79.6	Confident	83.6	Confident	95 Å²	95	77.4 Å²	77.4	62%	0.617	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-63.9	-26.8	-173.4	24.2	-34.8	0	0	0	113.6	I49 L55	I49-P53 WeakPolarHBondContact O-CA 3.38Å; I49-P53 VanDerWaalsContact O-N 3.1Å; P53-L55 PolarHBondContact O-N 2.03Å
54	G	76.7	Confident	83.2	Confident	46 Å²	46	73.5 Å²	73.5	47%	0.474	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-72.3	-10	178.4	0	0	0	0	0	114.9	N52	N52-G54 PolarHBondContact O-N 3Å
55	L	80.7	Confident	82.3	Confident	15 Å²	15	71.8 Å²	71.8	8%	0.079	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-94.8	-8	-179.1	-90.8	111	0	0	0	114.1	Y48 N52 P53 S57 T58 L59 A95	Y48-L55 HydrophobicContact CE1-CB 4.36Å; Y48-L55 HydrophobicContact CE1-CD2 4.32Å; N52-L55 HydrophobicContact CB-CB 4.39Å; N52-L55 HydrophobicContact CB-CD1 3.78Å; N52-L55 PolarHBondContact O-N 3.02Å; N52-L55 VanDerWaalsContact O-N 3.11Å; P53-L55 PolarHBondContact O-N 2.03Å; L55-S57 PolarHBondContact O-N 2.58Å; L55-T58 WeakPolarHBondContact O-CB 3.47Å; L55-T58 PolarHBondContact O-N 2.96Å; L55-T58 VanDerWaalsContact O-N 3.08Å; L55-L59 WeakPolarHBondContact O-CG 3.05Å; L55-L59 PolarHBondContact O-N 2.78Å; L55-A95 HydrophobicContact CD2-CB 4.27Å; L55-A95 HydrophobicContact CG-CB 4.12Å
56	E	82.2	Confident	81.6	Confident	91 Å²	91	75 Å²	75	43%	0.425	38%	0.384	S	S	.	.	H	α-helix	trans	-54.5	-53	-174.7	-171.3	172.7	-166.6	0	0	112.5	I49 T58 L59 E60	I49-E56 HydrophobicContact CD1-CB 3.85Å; I49-E56 HydrophobicContact CD1-CG 4.14Å; I49-E56 HydrophobicContact CG2-CB 4.41Å; I49-E56 HydrophobicContact CG2-CG 4.41Å; E56-T58 PolarHBondContact O-N 3.46Å; E56-L59 PolarHBondContact O-N 2.79Å; E56-E60 WeakPolarHBondContact O-CG 3.22Å; E56-E60 PolarHBondContact O-N 3.16Å
57	S	78.9	Confident	80.9	Confident	52 Å²	52	71.5 Å²	71.5	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-32.6	178.8	60.7	0	0	0	0	113.4	L55 R61	L55-S57 PolarHBondContact O-N 2.58Å; S57-R61 WeakPolarHBondContact O-CB 3.06Å; S57-R61 PolarHBondContact O-N 3.14Å
58	T	81.3	Confident	79.9	Confident	2 Å²	2	68.4 Å²	68.4	1%	0.012	35%	0.349	C	S	.	.	H	α-helix	trans	-73.2	-44.3	177.6	-51.9	0	0	0	0	110	L55 E56 R61 L62 E91 A95	L55-T58 WeakPolarHBondContact O-CB 3.47Å; L55-T58 PolarHBondContact O-N 2.96Å; L55-T58 VanDerWaalsContact O-N 3.08Å; E56-T58 PolarHBondContact O-N 3.46Å; T58-R61 WeakPolarHBondContact O-CB 3.35Å; T58-R61 PolarHBondContact O-N 3.35Å; T58-L62 WeakPolarHBondContact O-CG 3.44Å; T58-L62 PolarHBondContact O-N 3.28Å; T58-E91 HydrophobicContact CG2-CG 4.26Å; T58-A95 HydrophobicContact CG2-CB 3.8Å; T58-A95 VanDerWaalsContact OG1-CB 3.27Å; T58-A95 WeakPolarHBondContact OG1-CB 3.22Å
59	L	81.2	Confident	79.6	Confident	28 Å²	28	64.2 Å²	64.2	15%	0.147	33%	0.333	C	S	.	.	H	α-helix	trans	-65	-45.4	178.2	-69.9	-175	0	0	0	112	Y45 Y48 I49 L55 E56 R61 L62 Y63	Y45-L59 HydrophobicContact CD2-CD1 4.3Å; Y45-L59 HydrophobicContact CE2-CB 3.99Å; Y45-L59 HydrophobicContact CE2-CD1 3.78Å; Y48-L59 HydrophobicContact CD1-CD1 3.67Å; Y48-L59 HydrophobicContact CE1-CD1 3.76Å; I49-L59 HydrophobicContact CD1-CD1 3.73Å; L55-L59 WeakPolarHBondContact O-CG 3.05Å; L55-L59 PolarHBondContact O-N 2.78Å; E56-L59 PolarHBondContact O-N 2.79Å; L59-R61 PolarHBondContact O-N 3.17Å; L59-L62 HydrophobicContact CD2-CD1 4.18Å; L59-L62 PolarHBondContact O-N 3.01Å; L59-Y63 VanDerWaalsContact O-CD2 3.25Å; L59-Y63 WeakPolarHBondContact O-CD2 3.1Å; L59-Y63 PolarHBondContact O-N 2.67Å
60	E	82.1	Confident	79.1	Confident	122 Å²	122	68.3 Å²	68.3	57%	0.57	35%	0.35	S	S	*	.	H	α-helix	trans	-55.8	-39	176	-74.5	-168.2	157.3	0	0	112	E56 Y63 S64	E56-E60 WeakPolarHBondContact O-CG 3.22Å; E56-E60 PolarHBondContact O-N 3.16Å; E60-Y63 PolarHBondContact O-N 2.76Å; E60-S64 PolarHBondContact O-N 2.85Å; E60-S64 VanDerWaalsContact O-N 3.15Å
61	R	78.5	Confident	78.3	Confident	36 Å²	36	63.6 Å²	63.6	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-65.8	-41.6	173.6	164.9	-174.7	-73	-147	-26.7	113	S57 T58 L59 Y63 S64 E91 I105 L108	S57-R61 WeakPolarHBondContact O-CB 3.06Å; S57-R61 PolarHBondContact O-N 3.14Å; T58-R61 WeakPolarHBondContact O-CB 3.35Å; T58-R61 PolarHBondContact O-N 3.35Å; L59-R61 PolarHBondContact O-N 3.17Å; R61-Y63 PolarHBondContact O-N 2.69Å; R61-S64 VanDerWaalsContact O-CB 3.23Å; R61-S64 WeakPolarHBondContact O-CB 3.16Å; R61-S64 PolarHBondContact O-N 3.34Å; R61-E91 WeakPolarHBondContact CD-OE1 3.46Å; R61-E91 IonicContact CZ-OE1 3.37Å; R61-E91 IonicContact NE-OE1 3.63Å; R61-E91 IonicContact NH1-OE1 2.58Å; R61-E91 PolarHBondContact NH1-OE1 3.1Å; R61-I105 PolarHBondContact NH1-O 3.29Å; R61-I105 VanDerWaalsContact NH2-CB 3.3Å; R61-I105 PolarHBondContact NH2-O 3.25Å; R61-L108 VanDerWaalsContact NH1-CB 3.35Å
62	L	79.4	Confident	77.4	Confident	28 Å²	28	66 Å²	66	15%	0.147	34%	0.342	C	S	.	.	H	α-helix	trans	-65.5	-31.1	179.4	-64.5	175	0	0	0	111.8	T58 L59 S64 F70 L88	T58-L62 WeakPolarHBondContact O-CG 3.44Å; T58-L62 PolarHBondContact O-N 3.28Å; L59-L62 HydrophobicContact CD2-CD1 4.18Å; L59-L62 PolarHBondContact O-N 3.01Å; L62-S64 VanDerWaalsContact C-N 3.31Å; L62-F70 HydrophobicContact CB-CD2 4.29Å; L62-F70 HydrophobicContact CB-CE2 4.44Å; L62-F70 HydrophobicContact CD2-CD2 4.16Å; L62-F70 HydrophobicContact CD2-CE2 3.94Å; L62-L88 HydrophobicContact CD2-CD1 3.55Å
63	Y	76.2	Confident	76.8	Confident	185 Å²	185	70.7 Å²	70.7	73%	0.725	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.3	171.9	-77.5	-72.9	0	0	0	113.6	Y45 L59 E60 R61	Y45-Y63 HydrophobicContact CD2-CE2 4.34Å; Y45-Y63 HydrophobicContact CE2-CE2 4.18Å; L59-Y63 VanDerWaalsContact O-CD2 3.25Å; L59-Y63 WeakPolarHBondContact O-CD2 3.1Å; L59-Y63 PolarHBondContact O-N 2.67Å; E60-Y63 PolarHBondContact O-N 2.76Å; R61-Y63 PolarHBondContact O-N 2.69Å
64	S	80.1	Confident	76.4	Confident	35 Å²	35	70 Å²	70	25%	0.245	35%	0.353	C	S	.	.	S	Bend	trans	-71.8	132.6	177.4	-177.4	0	0	0	0	110.3	E60 R61 L62 E66 H67	E60-S64 PolarHBondContact O-N 2.85Å; E60-S64 VanDerWaalsContact O-N 3.15Å; R61-S64 VanDerWaalsContact O-CB 3.23Å; R61-S64 WeakPolarHBondContact O-CB 3.16Å; R61-S64 PolarHBondContact O-N 3.34Å; L62-S64 VanDerWaalsContact C-N 3.31Å; S64-E66 PolarHBondContact O-N 3.02Å; S64-E66 PolarHBondContact OG-N 3.4Å; S64-H67 WeakPolarHBondContact O-CB 3.33Å; S64-H67 PolarHBondContact O-N 3.42Å
65	P	70.1	Confident	76.4	Confident	89 Å²	89	72 Å²	72	58%	0.578	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-11.6	177.5	27.8	-35.9	0	0	0	112.9	H67 Q71	P65-H67 PolarHBondContact O-N 2.87Å; P65-Q71 VanDerWaalsContact O-CG 3.32Å; P65-Q71 WeakPolarHBondContact O-CG 3.03Å
66	E	72.2	Confident	76	Confident	127 Å²	127	80.8 Å²	80.8	59%	0.593	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-10.2	174.5	-59.5	-174.3	146.4	0	0	113.2	S64 K109	S64-E66 PolarHBondContact O-N 3.02Å; S64-E66 PolarHBondContact OG-N 3.4Å; E66-K109 VanDerWaalsContact CD-NZ 3.3Å; E66-K109 IonicContact OE1-NZ 3.34Å; E66-K109 PolarHBondContact OE1-NZ 3.39Å; E66-K109 WeakPolarHBondContact OE2-CE 3.37Å; E66-K109 IonicContact OE2-NZ 3.69Å; E66-K109 PolarHBondContact OE2-NZ 2.87Å
67	H	75.2	Confident	75.6	Confident	7 Å²	7	83.6 Å²	83.6	3%	0.032	42%	0.416	C	S	.	.			trans	-74.7	125.4	-176.1	-171.5	-90	0	0	0	111.9	S64 P65 I69 F70 Q71	S64-H67 WeakPolarHBondContact O-CB 3.33Å; S64-H67 PolarHBondContact O-N 3.42Å; P65-H67 PolarHBondContact O-N 2.87Å; H67-I69 PolarHBondContact ND1-N 2.85Å; H67-I69 PolarHBondContact O-N 2.69Å; H67-F70 HydrophobicContact CB-CB 4.35Å; H67-F70 AromaticContact CE1-CD2 3.77Å; H67-F70 AromaticContact ND1-CD2 3.31Å; H67-F70 VanDerWaalsContact ND1-CD2 3.31Å; H67-F70 WeakPolarHBondContact ND1-CD2 3.11Å; H67-F70 AromaticContact ND1-CG 3.99Å; H67-F70 PolarHBondContact ND1-N 3.35Å; H67-F70 CarbonylContact O-C 3.37Å; H67-F70 PolarHBondContact O-N 2.92Å; H67-Q71 WeakPolarHBondContact O-CG 2.82Å; H67-Q71 PolarHBondContact O-N 3.3Å; H67-Q71 VanDerWaalsContact O-N 3.14Å
68	P	70.6	Confident	75.5	Confident	16 Å²	16	84 Å²	84	10%	0.104	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.2	-169.9	26.3	-37.6	0	0	0	115.4	Y74 Y78 Y112	P68-Y74 PolarHBondContact O-OH 3.43Å; P68-Y78 PolarHBondContact O-OH 2.83Å; P68-Y112 HydrophobicContact CB-CD1 4.35Å; P68-Y112 HydrophobicContact CG-CD1 3.4Å; P68-Y112 VanDerWaalsContact CG-CD1 3.4Å; P68-Y112 HydrophobicContact CG-CD2 4.03Å; P68-Y112 HydrophobicContact CG-CE1 3.79Å; P68-Y112 HydrophobicContact CG-CE2 4.39Å; P68-Y112 HydrophobicContact CG-CG 3.54Å
69	I	79.5	Confident	75.3	Confident	10 Å²	10	91.7 Å²	91.7	5%	0.051	45%	0.445	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-14.8	178.6	-66.1	164.8	0	0	0	112	H67 Y74 I80 Q84 W85 L88	H67-I69 PolarHBondContact ND1-N 2.85Å; H67-I69 PolarHBondContact O-N 2.69Å; I69-Y74 WeakPolarHBondContact CA-OH 3.47Å; I69-Y74 PolarHBondContact O-OH 2.91Å; I69-I80 HydrophobicContact CD1-CG2 4.43Å; I69-I80 HydrophobicContact CG1-CG2 4.13Å; I69-I80 HydrophobicContact CG2-CD1 4.04Å; I69-Q84 HydrophobicContact CD1-CB 4.42Å; I69-W85 HydrophobicContact CD1-CE3 4.41Å; I69-L88 HydrophobicContact CB-CD2 4.43Å; I69-L88 HydrophobicContact CD1-CB 3.52Å; I69-L88 HydrophobicContact CD1-CD2 3.46Å; I69-L88 VanDerWaalsContact CD1-CD2 3.46Å; I69-L88 HydrophobicContact CD1-CG 4.03Å; I69-L88 HydrophobicContact CG2-CD2 4.13Å
70	F	76.4	Confident	75.3	Confident	106 Å²	106	94 Å²	94	47%	0.465	46%	0.458	S	S	.	.	S	Bend	trans	-124.3	37	-178.3	-58.7	-60.3	0	0	0	111.8	L62 H67 Y74 L88	L62-F70 HydrophobicContact CB-CD2 4.29Å; L62-F70 HydrophobicContact CB-CE2 4.44Å; L62-F70 HydrophobicContact CD2-CD2 4.16Å; L62-F70 HydrophobicContact CD2-CE2 3.94Å; H67-F70 HydrophobicContact CB-CB 4.35Å; H67-F70 AromaticContact CE1-CD2 3.77Å; H67-F70 AromaticContact ND1-CD2 3.31Å; H67-F70 VanDerWaalsContact ND1-CD2 3.31Å; H67-F70 WeakPolarHBondContact ND1-CD2 3.11Å; H67-F70 AromaticContact ND1-CG 3.99Å; H67-F70 PolarHBondContact ND1-N 3.35Å; H67-F70 CarbonylContact O-C 3.37Å; H67-F70 PolarHBondContact O-N 2.92Å; F70-Y74 PolarHBondContact N-OH 3.21Å; F70-L88 HydrophobicContact CE2-CD2 4.28Å; F70-L88 HydrophobicContact CZ-CD2 4.46Å
71	Q	71.8	Confident	75.3	Confident	69 Å²	69	91.3 Å²	91.3	32%	0.322	45%	0.449	S	S	.	.			trans	-73.7	145.2	167.7	-79.5	162.2	21.2	0	0	110.2	P65 H67 Y74	P65-Q71 VanDerWaalsContact O-CG 3.32Å; P65-Q71 WeakPolarHBondContact O-CG 3.03Å; H67-Q71 WeakPolarHBondContact O-CG 2.82Å; H67-Q71 PolarHBondContact O-N 3.3Å; H67-Q71 VanDerWaalsContact O-N 3.14Å; Q71-Y74 HydrophobicContact CB-CD1 4.3Å; Q71-Y74 HydrophobicContact CB-CE1 3.67Å; Q71-Y74 HydrophobicContact CB-CE2 4.39Å; Q71-Y74 PolarHBondContact N-OH 3.29Å; Q71-Y74 WeakPolarHBondContact O-CD2 3.31Å; Q71-Y74 WeakPolarHBondContact O-CE2 3.18Å; Q71-Y74 VanDerWaalsContact O-CZ 3.31Å
72	E	68.4	Low	75.6	Confident	176 Å²	176	95.9 Å²	95.9	82%	0.822	48%	0.476	S	S	*	.	S	Bend	trans	-81.5	-34.6	172.9	-66.2	-176.1	165.3	0	0	111.3	Y74	E72-Y74 PolarHBondContact O-N 2.83Å
73	D	72.6	Confident	75.7	Confident	149 Å²	149	97.1 Å²	97.1	80%	0.797	48%	0.479	S	S	*	.			trans	-99.5	75.1	-172.8	-71.3	-31	0	0	0	112.1
74	Y	71	Confident	76	Confident	82 Å²	82	88.7 Å²	88.7	32%	0.322	45%	0.446	S	S	.	.			trans	-82.9	136.3	172.9	-70.2	-59.1	0	0	0	112.5	P68 I69 F70 Q71 E72 Y78	P68-Y74 PolarHBondContact O-OH 3.43Å; I69-Y74 WeakPolarHBondContact CA-OH 3.47Å; I69-Y74 PolarHBondContact O-OH 2.91Å; F70-Y74 PolarHBondContact N-OH 3.21Å; Q71-Y74 HydrophobicContact CB-CD1 4.3Å; Q71-Y74 HydrophobicContact CB-CE1 3.67Å; Q71-Y74 HydrophobicContact CB-CE2 4.39Å; Q71-Y74 PolarHBondContact N-OH 3.29Å; Q71-Y74 WeakPolarHBondContact O-CD2 3.31Å; Q71-Y74 WeakPolarHBondContact O-CE2 3.18Å; Q71-Y74 VanDerWaalsContact O-CZ 3.31Å; E72-Y74 PolarHBondContact O-N 2.83Å; Y74-Y78 AromaticContact CD1-CD1 3.05Å; Y74-Y78 HydrophobicContact CD1-CD1 3.05Å; Y74-Y78 AromaticContact CD1-CD2 3.94Å; Y74-Y78 HydrophobicContact CD1-CD2 3.94Å; Y74-Y78 AromaticContact CD1-CE1 3.44Å; Y74-Y78 HydrophobicContact CD1-CE1 3.44Å; Y74-Y78 VanDerWaalsContact CD1-CE1 3.44Å; Y74-Y78 HydrophobicContact CD1-CE2 4.28Å; Y74-Y78 AromaticContact CD1-CG 3.32Å; Y74-Y78 HydrophobicContact CD1-CG 3.32Å; Y74-Y78 AromaticContact CE1-CD1 3.24Å; Y74-Y78 HydrophobicContact CE1-CD1 3.24Å; Y74-Y78 HydrophobicContact CE1-CD2 4.38Å; Y74-Y78 AromaticContact CE1-CE1 3.05Å; Y74-Y78 HydrophobicContact CE1-CE1 3.05Å; Y74-Y78 HydrophobicContact CE1-CE2 4.27Å; Y74-Y78 AromaticContact CE1-CG 3.9Å; Y74-Y78 HydrophobicContact CE1-CG 3.9Å; Y74-Y78 AromaticContact CE1-CZ 3.63Å; Y74-Y78 AromaticContact CG-CD1 3.77Å; Y74-Y78 HydrophobicContact CG-CD1 3.77Å; Y74-Y78 HydrophobicContact CG-CE1 4.44Å; Y74-Y78 HydrophobicContact CG-CG 4.06Å; Y74-Y78 AromaticContact CZ-CE1 3.81Å
75	P	75.4	Confident	76.3	Confident	87 Å²	87	92.7 Å²	92.7	57%	0.565	46%	0.456	S	S	*	.			trans	-60.8	150.6	164.7	24.6	-30.7	0	0	0	110.2	N77 Y78	P75-N77 PolarHBondContact O-N 3.49Å; P75-Y78 HydrophobicContact CG-CD2 4.43Å; P75-Y78 WeakPolarHBondContact O-CB 3.45Å; P75-Y78 PolarHBondContact O-N 2.74Å
76	E	73.9	Confident	77	Confident	200 Å²	200	91.9 Å²	91.9	94%	0.935	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-21.6	-172.9	-67.7	-175.8	168.8	0	0	114.8
77	N	73.1	Confident	77.6	Confident	150 Å²	150	86.1 Å²	86.1	80%	0.802	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.3	28.5	179.3	-58.3	-26.8	0	0	0	112.9	P75 E79	P75-N77 PolarHBondContact O-N 3.49Å; N77-E79 PolarHBondContact O-N 2.77Å
78	Y	75.5	Confident	78.1	Confident	60 Å²	60	86 Å²	86	24%	0.235	42%	0.421	C	S	.	.			trans	-69.5	123	174	-173.6	-104.6	0	0	0	110.5	P68 Y74 P75 I80	P68-Y78 PolarHBondContact O-OH 2.83Å; Y74-Y78 AromaticContact CD1-CD1 3.05Å; Y74-Y78 HydrophobicContact CD1-CD1 3.05Å; Y74-Y78 AromaticContact CD1-CD2 3.94Å; Y74-Y78 HydrophobicContact CD1-CD2 3.94Å; Y74-Y78 AromaticContact CD1-CE1 3.44Å; Y74-Y78 HydrophobicContact CD1-CE1 3.44Å; Y74-Y78 VanDerWaalsContact CD1-CE1 3.44Å; Y74-Y78 HydrophobicContact CD1-CE2 4.28Å; Y74-Y78 AromaticContact CD1-CG 3.32Å; Y74-Y78 HydrophobicContact CD1-CG 3.32Å; Y74-Y78 AromaticContact CE1-CD1 3.24Å; Y74-Y78 HydrophobicContact CE1-CD1 3.24Å; Y74-Y78 HydrophobicContact CE1-CD2 4.38Å; Y74-Y78 AromaticContact CE1-CE1 3.05Å; Y74-Y78 HydrophobicContact CE1-CE1 3.05Å; Y74-Y78 HydrophobicContact CE1-CE2 4.27Å; Y74-Y78 AromaticContact CE1-CG 3.9Å; Y74-Y78 HydrophobicContact CE1-CG 3.9Å; Y74-Y78 AromaticContact CE1-CZ 3.63Å; Y74-Y78 AromaticContact CG-CD1 3.77Å; Y74-Y78 HydrophobicContact CG-CD1 3.77Å; Y74-Y78 HydrophobicContact CG-CE1 4.44Å; Y74-Y78 HydrophobicContact CG-CG 4.06Å; Y74-Y78 AromaticContact CZ-CE1 3.81Å; P75-Y78 HydrophobicContact CG-CD2 4.43Å; P75-Y78 WeakPolarHBondContact O-CB 3.45Å; P75-Y78 PolarHBondContact O-N 2.74Å; Y78-I80 HydrophobicContact CD1-CG1 4.42Å; Y78-I80 HydrophobicContact CE1-CG1 3.75Å
79	E	78.1	Confident	78.7	Confident	163 Å²	163	88.4 Å²	88.4	76%	0.762	43%	0.432	S	S	*	.			trans	-119.3	126	173	-69.2	-177.6	178.7	0	0	108.7	N77 T81	N77-E79 PolarHBondContact O-N 2.77Å; E79-T81 PolarHBondContact O-N 3.09Å
80	I	81.2	Confident	79	Confident	78 Å²	78	92.4 Å²	92.4	40%	0.4	45%	0.454	S	S	.	.			trans	-67.8	116.7	172.8	-62	161	0	0	0	107.3	I69 Y78 Q84 W85	I69-I80 HydrophobicContact CD1-CG2 4.43Å; I69-I80 HydrophobicContact CG1-CG2 4.13Å; I69-I80 HydrophobicContact CG2-CD1 4.04Å; Y78-I80 HydrophobicContact CD1-CG1 4.42Å; Y78-I80 HydrophobicContact CE1-CG1 3.75Å; I80-Q84 HydrophobicContact CG2-CB 4.35Å; I80-W85 HydrophobicContact CG2-CB 4.29Å; I80-W85 HydrophobicContact CG2-CE3 4.49Å
81	T	82.2	Confident	79.2	Confident	64 Å²	64	87.4 Å²	87.4	39%	0.393	43%	0.432	S	S	.	.			trans	-75.5	150	178.7	63.7	0	0	0	0	111	E79 R83 Q84 W85	E79-T81 PolarHBondContact O-N 3.09Å; T81-R83 PolarHBondContact O-N 3.29Å; T81-Q84 PolarHBondContact O-N 3.14Å; T81-Q84 VanDerWaalsContact OG1-CD 3.29Å; T81-Q84 VanDerWaalsContact OG1-CG 3.31Å; T81-Q84 WeakPolarHBondContact OG1-CG 3.3Å; T81-Q84 PolarHBondContact OG1-N 3.32Å; T81-Q84 PolarHBondContact OG1-OE1 3.38Å; T81-W85 PolarHBondContact O-N 3.18Å
82	D	83.8	Confident	79.7	Confident	132 Å²	132	87.1 Å²	87.1	71%	0.706	43%	0.432	S	S	*	.	H	α-helix	trans	-53.5	-30.4	173.7	-68.7	-27.5	0	0	0	112.3	N86	D82-N86 VanDerWaalsContact O-CB 3.25Å; D82-N86 WeakPolarHBondContact O-CB 3.41Å; D82-N86 PolarHBondContact O-N 3.25Å; D82-N86 PolarHBondContact O-ND2 3.49Å
83	R	81.4	Confident	80.4	Confident	55 Å²	55	83 Å²	83	21%	0.208	42%	0.415	C	S	.	.	H	α-helix	trans	-66.3	-48.5	176.6	-60.9	-167.5	177.5	161.6	-5.7	112.2	T81 W85 N86 A87 F115 K118 D121 Y123	T81-R83 PolarHBondContact O-N 3.29Å; R83-W85 VanDerWaalsContact C-N 3.33Å; R83-N86 PolarHBondContact O-N 2.8Å; R83-A87 WeakPolarHBondContact O-CB 3.47Å; R83-A87 PolarHBondContact O-N 3.34Å; R83-F115 HydrophobicContact CB-CD1 4.29Å; R83-F115 HydrophobicContact CB-CE1 4.03Å; R83-K118 PolarHBondContact NH1-O 3.38Å; R83-D121 PolarHBondContact NH2-O 3.08Å; R83-Y123 HydrophobicContact CG-CE1 3.72Å
84	Q	83	Confident	80.8	Confident	7 Å²	7	79.8 Å²	79.8	3%	0.033	40%	0.396	C	S	.	.	H	α-helix	trans	-63.1	-44.1	177.4	-72.2	161.6	-36	0	0	110.1	I69 I80 T81 N86 A87 L88 F115	I69-Q84 HydrophobicContact CD1-CB 4.42Å; I80-Q84 HydrophobicContact CG2-CB 4.35Å; T81-Q84 PolarHBondContact O-N 3.14Å; T81-Q84 VanDerWaalsContact OG1-CD 3.29Å; T81-Q84 VanDerWaalsContact OG1-CG 3.31Å; T81-Q84 WeakPolarHBondContact OG1-CG 3.3Å; T81-Q84 PolarHBondContact OG1-N 3.32Å; T81-Q84 PolarHBondContact OG1-OE1 3.38Å; Q84-N86 PolarHBondContact O-N 3.09Å; Q84-A87 WeakPolarHBondContact O-CB 3.42Å; Q84-A87 PolarHBondContact O-N 2.92Å; Q84-L88 PolarHBondContact O-N 2.86Å; Q84-F115 HydrophobicContact CG-CB 4.39Å; Q84-F115 HydrophobicContact CG-CD2 4Å; Q84-F115 HydrophobicContact CG-CG 4.32Å
85	W	86.3	Confident	81.1	Confident	119 Å²	119	76 Å²	76	45%	0.451	38%	0.381	S	S	.	.	H	α-helix	trans	-59.8	-47.5	177.2	-173.2	-108.8	0	0	0	112.4	I69 I80 T81 R83 A87 L88 L89	I69-W85 HydrophobicContact CD1-CE3 4.41Å; I80-W85 HydrophobicContact CG2-CB 4.29Å; I80-W85 HydrophobicContact CG2-CE3 4.49Å; T81-W85 PolarHBondContact O-N 3.18Å; R83-W85 VanDerWaalsContact C-N 3.33Å; W85-A87 VanDerWaalsContact C-N 3.33Å; W85-A87 PolarHBondContact O-N 2.94Å; W85-L88 HydrophobicContact CE3-CD2 4.3Å; W85-L88 HydrophobicContact CZ3-CD2 4.13Å; W85-L88 WeakPolarHBondContact O-CB 3.32Å; W85-L88 PolarHBondContact O-N 3.5Å; W85-L89 WeakPolarHBondContact O-CG 3.38Å; W85-L89 PolarHBondContact O-N 3.05Å
86	N	85.9	Confident	81.2	Confident	73 Å²	73	77.3 Å²	77.3	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-67.3	-33	177.8	-74	-42.2	0	0	0	112.9	D82 R83 Q84 N90	D82-N86 VanDerWaalsContact O-CB 3.25Å; D82-N86 WeakPolarHBondContact O-CB 3.41Å; D82-N86 PolarHBondContact O-N 3.25Å; D82-N86 PolarHBondContact O-ND2 3.49Å; R83-N86 PolarHBondContact O-N 2.8Å; Q84-N86 PolarHBondContact O-N 3.09Å; N86-N90 WeakPolarHBondContact O-CB 3.33Å; N86-N90 PolarHBondContact O-N 2.99Å; N86-N90 PolarHBondContact O-ND2 3.06Å
87	A	84	Confident	81.4	Confident	6 Å²	6	72.9 Å²	72.9	5%	0.05	36%	0.36	C	S	.	.	H	α-helix	trans	-62.8	-44.6	173.1	0	0	0	0	0	111.1	R83 Q84 W85 N90 E91 M111 Y112 F115	R83-A87 WeakPolarHBondContact O-CB 3.47Å; R83-A87 PolarHBondContact O-N 3.34Å; Q84-A87 WeakPolarHBondContact O-CB 3.42Å; Q84-A87 PolarHBondContact O-N 2.92Å; W85-A87 VanDerWaalsContact C-N 3.33Å; W85-A87 PolarHBondContact O-N 2.94Å; A87-N90 PolarHBondContact O-N 2.99Å; A87-E91 PolarHBondContact O-N 3.47Å; A87-M111 HydrophobicContact CB-CE 3.58Å; A87-Y112 HydrophobicContact CB-CE1 3.66Å; A87-F115 HydrophobicContact CB-CE2 4.16Å; A87-F115 HydrophobicContact CB-CZ 4.32Å
88	L	85.4	Confident	81.3	Confident	4 Å²	4	68.5 Å²	68.5	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-61.1	-46.8	175.2	173	65	0	0	0	112	L62 I69 F70 Q84 W85 N90 E91 I92 Y112	L62-L88 HydrophobicContact CD2-CD1 3.55Å; I69-L88 HydrophobicContact CB-CD2 4.43Å; I69-L88 HydrophobicContact CD1-CB 3.52Å; I69-L88 HydrophobicContact CD1-CD2 3.46Å; I69-L88 VanDerWaalsContact CD1-CD2 3.46Å; I69-L88 HydrophobicContact CD1-CG 4.03Å; I69-L88 HydrophobicContact CG2-CD2 4.13Å; F70-L88 HydrophobicContact CE2-CD2 4.28Å; F70-L88 HydrophobicContact CZ-CD2 4.46Å; Q84-L88 PolarHBondContact O-N 2.86Å; W85-L88 HydrophobicContact CE3-CD2 4.3Å; W85-L88 HydrophobicContact CZ3-CD2 4.13Å; W85-L88 WeakPolarHBondContact O-CB 3.32Å; W85-L88 PolarHBondContact O-N 3.5Å; L88-N90 VanDerWaalsContact C-N 3.29Å; L88-N90 PolarHBondContact O-N 3.28Å; L88-E91 WeakPolarHBondContact O-CB 3.28Å; L88-E91 PolarHBondContact O-N 2.9Å; L88-I92 HydrophobicContact CD1-CD1 3.94Å; L88-I92 HydrophobicContact CD1-CG1 4.19Å; L88-I92 HydrophobicContact CG-CD1 3.94Å; L88-I92 WeakPolarHBondContact O-CG1 3.02Å; L88-I92 PolarHBondContact O-N 3.5Å; L88-Y112 VanDerWaalsContact CA-OH 3.31Å; L88-Y112 WeakPolarHBondContact CA-OH 3.48Å; L88-Y112 PolarHBondContact N-OH 3.3Å; L88-Y112 VanDerWaalsContact N-OH 3.16Å
89	L	84.5	Confident	81	Confident	66 Å²	66	72.3 Å²	72.3	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-61.3	-39.2	178	-69.1	179.9	0	0	0	112	W85 I92 N93	W85-L89 WeakPolarHBondContact O-CG 3.38Å; W85-L89 PolarHBondContact O-N 3.05Å; L89-I92 PolarHBondContact O-N 3.2Å; L89-N93 WeakPolarHBondContact O-CB 3.39Å; L89-N93 PolarHBondContact O-N 3.29Å; L89-N93 PolarHBondContact O-ND2 2.85Å; L89-N93 VanDerWaalsContact O-ND2 3.07Å
90	N	84.2	Confident	80.4	Confident	95 Å²	95	65.8 Å²	65.8	51%	0.508	33%	0.334	S	S	.	.	H	α-helix	trans	-66.4	-38.8	175.6	-79.1	-34.7	0	0	0	112.3	N86 A87 L88 N93 Q94	N86-N90 WeakPolarHBondContact O-CB 3.33Å; N86-N90 PolarHBondContact O-N 2.99Å; N86-N90 PolarHBondContact O-ND2 3.06Å; A87-N90 PolarHBondContact O-N 2.99Å; L88-N90 VanDerWaalsContact C-N 3.29Å; L88-N90 PolarHBondContact O-N 3.28Å; N90-N93 PolarHBondContact O-N 2.03Å; N90-Q94 WeakPolarHBondContact O-CB 3.4Å; N90-Q94 VanDerWaalsContact O-CG 3.23Å; N90-Q94 WeakPolarHBondContact O-CG 3.16Å; N90-Q94 PolarHBondContact O-N 3.24Å
91	E	81.4	Confident	79.8	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-61.1	-50.4	173.8	178.2	170	-163.1	0	0	111.2	T58 R61 A87 L88 N93 Q94 A95 L100 L108 Y112	T58-E91 HydrophobicContact CG2-CG 4.26Å; R61-E91 WeakPolarHBondContact CD-OE1 3.46Å; R61-E91 IonicContact CZ-OE1 3.37Å; R61-E91 IonicContact NE-OE1 3.63Å; R61-E91 IonicContact NH1-OE1 2.58Å; R61-E91 PolarHBondContact NH1-OE1 3.1Å; A87-E91 PolarHBondContact O-N 3.47Å; L88-E91 WeakPolarHBondContact O-CB 3.28Å; L88-E91 PolarHBondContact O-N 2.9Å; E91-N93 VanDerWaalsContact C-N 3.3Å; E91-N93 PolarHBondContact O-N 3.12Å; E91-Q94 PolarHBondContact O-N 3.33Å; E91-Q94 VanDerWaalsContact O-N 3.13Å; E91-A95 WeakPolarHBondContact O-CB 3.08Å; E91-A95 PolarHBondContact O-N 3.33Å; E91-L100 HydrophobicContact CG-CD1 4.09Å; E91-L108 HydrophobicContact CB-CD1 4.4Å; E91-L108 HydrophobicContact CB-CD2 4.49Å; E91-L108 HydrophobicContact CG-CD1 3.92Å; E91-Y112 PolarHBondContact OE2-OH 3.46Å
92	I	82.7	Confident	79	Confident	62 Å²	62	73.3 Å²	73.3	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-59	-42.4	176.6	-66	168.9	0	0	0	111.1	L88 L89 A95 K96	L88-I92 HydrophobicContact CD1-CD1 3.94Å; L88-I92 HydrophobicContact CD1-CG1 4.19Å; L88-I92 HydrophobicContact CG-CD1 3.94Å; L88-I92 WeakPolarHBondContact O-CG1 3.02Å; L88-I92 PolarHBondContact O-N 3.5Å; L89-I92 PolarHBondContact O-N 3.2Å; I92-A95 PolarHBondContact O-N 2.88Å; I92-K96 WeakPolarHBondContact O-CB 3.42Å; I92-K96 PolarHBondContact O-N 3.02Å
93	N	82.5	Confident	78.2	Confident	89 Å²	89	72.8 Å²	72.8	48%	0.476	36%	0.361	S	S	.	.	H	α-helix	trans	-65.2	-39.6	177.3	-76.6	-34.1	0	0	0	112.3	L89 N90 E91 L97	L89-N93 WeakPolarHBondContact O-CB 3.39Å; L89-N93 PolarHBondContact O-N 3.29Å; L89-N93 PolarHBondContact O-ND2 2.85Å; L89-N93 VanDerWaalsContact O-ND2 3.07Å; N90-N93 PolarHBondContact O-N 2.03Å; E91-N93 VanDerWaalsContact C-N 3.3Å; E91-N93 PolarHBondContact O-N 3.12Å; N93-L97 VanDerWaalsContact O-CG 3.26Å; N93-L97 WeakPolarHBondContact O-CG 3.33Å; N93-L97 PolarHBondContact O-N 3.19Å; N93-L97 VanDerWaalsContact O-N 3.1Å
94	Q	80.6	Confident	77.7	Confident	82 Å²	82	72.7 Å²	72.7	38%	0.383	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-38.5	176.2	-72.4	175.6	11.6	0	0	111.7	N90 E91 L97 G98 R99 L100	N90-Q94 WeakPolarHBondContact O-CB 3.4Å; N90-Q94 VanDerWaalsContact O-CG 3.23Å; N90-Q94 WeakPolarHBondContact O-CG 3.16Å; N90-Q94 PolarHBondContact O-N 3.24Å; E91-Q94 PolarHBondContact O-N 3.33Å; E91-Q94 VanDerWaalsContact O-N 3.13Å; Q94-L97 PolarHBondContact O-N 3.46Å; Q94-G98 PolarHBondContact O-N 2.88Å; Q94-R99 PolarHBondContact O-N 3.01Å; Q94-L100 HydrophobicContact CB-CD1 4.33Å; Q94-L100 HydrophobicContact CB-CD2 3.73Å; Q94-L100 HydrophobicContact CB-CG 3.73Å; Q94-L100 VanDerWaalsContact OE1-CD2 3.24Å
95	A	77.6	Confident	76.9	Confident	2 Å²	2	73.6 Å²	73.6	2%	0.017	37%	0.369	C	S	.	.	H	α-helix	trans	-61.5	-47.8	173.5	0	0	0	0	0	111.3	L55 T58 E91 I92 L97 G98 L100	L55-A95 HydrophobicContact CD2-CB 4.27Å; L55-A95 HydrophobicContact CG-CB 4.12Å; T58-A95 HydrophobicContact CG2-CB 3.8Å; T58-A95 VanDerWaalsContact OG1-CB 3.27Å; T58-A95 WeakPolarHBondContact OG1-CB 3.22Å; E91-A95 WeakPolarHBondContact O-CB 3.08Å; E91-A95 PolarHBondContact O-N 3.33Å; I92-A95 PolarHBondContact O-N 2.88Å; A95-L97 PolarHBondContact O-N 3.3Å; A95-G98 WeakPolarHBondContact O-CA 3.19Å; A95-G98 PolarHBondContact O-N 3.02Å; A95-L100 HydrophobicContact CB-CD1 3.75Å
96	K	78.3	Confident	76.1	Confident	115 Å²	115	73.3 Å²	73.3	50%	0.5	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-32.8	176.2	-170.9	173	-175.8	171.7	0	112.5	I92 G98 E138	I92-K96 WeakPolarHBondContact O-CB 3.42Å; I92-K96 PolarHBondContact O-N 3.02Å; K96-G98 VanDerWaalsContact C-N 3.27Å; K96-G98 PolarHBondContact O-N 3.37Å; K96-E138 IonicContact NZ-OE2 3.74Å; K96-E138 PolarHBondContact NZ-OE2 2.86Å
97	L	77.9	Confident	75.6	Confident	107 Å²	107	77.1 Å²	77.1	56%	0.56	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-2.1	175.4	-67.6	173.4	0	0	0	113.7	N93 Q94 A95 R99	N93-L97 VanDerWaalsContact O-CG 3.26Å; N93-L97 WeakPolarHBondContact O-CG 3.33Å; N93-L97 PolarHBondContact O-N 3.19Å; N93-L97 VanDerWaalsContact O-N 3.1Å; Q94-L97 PolarHBondContact O-N 3.46Å; A95-L97 PolarHBondContact O-N 3.3Å; L97-R99 HydrophobicContact CB-CG 3.89Å; L97-R99 PolarHBondContact O-N 2.76Å
98	G	70.7	Confident	74.9	Confident	58 Å²	58	77.7 Å²	77.7	60%	0.598	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	26.8	-176.5	0	0	0	0	0	113.3	Q94 A95 K96	Q94-G98 PolarHBondContact O-N 2.88Å; A95-G98 WeakPolarHBondContact O-CA 3.19Å; A95-G98 PolarHBondContact O-N 3.02Å; K96-G98 VanDerWaalsContact C-N 3.27Å; K96-G98 PolarHBondContact O-N 3.37Å
99	R	69.1	Low	74.2	Confident	141 Å²	141	82.4 Å²	82.4	53%	0.532	41%	0.412	S	S	.	.			trans	-98.3	-9	-174	-67.3	-176.9	-173.5	-176.3	1.8	114.1	Q94 L97 N131	Q94-R99 PolarHBondContact O-N 3.01Å; L97-R99 HydrophobicContact CB-CG 3.89Å; L97-R99 PolarHBondContact O-N 2.76Å; R99-N131 PolarHBondContact NH1-ND2 3.2Å
100	L	65.5	Low	73.5	Confident	25 Å²	25	84.4 Å²	84.4	13%	0.131	42%	0.423	C	S	.	.			trans	-79.8	122.3	177.9	-70.1	178.3	0	0	0	110.1	E91 Q94 A95 D104 L108	E91-L100 HydrophobicContact CG-CD1 4.09Å; Q94-L100 HydrophobicContact CB-CD1 4.33Å; Q94-L100 HydrophobicContact CB-CD2 3.73Å; Q94-L100 HydrophobicContact CB-CG 3.73Å; Q94-L100 VanDerWaalsContact OE1-CD2 3.24Å; A95-L100 HydrophobicContact CB-CD1 3.75Å; L100-D104 HydrophobicContact CD2-CB 4.08Å; L100-L108 HydrophobicContact CD2-CD1 4.05Å
101	Q	68.1	Low	72.8	Confident	136 Å²	136	83.9 Å²	83.9	64%	0.636	42%	0.418	S	S	*	.			trans	-96.2	163.5	163.5	-72.1	-176.4	-10.5	0	0	110.8	D103 D104 I105	Q101-D103 PolarHBondContact O-N 3.42Å; Q101-D104 PolarHBondContact N-OD2 3.48Å; Q101-D104 WeakPolarHBondContact O-CB 3.24Å; Q101-D104 PolarHBondContact O-N 2.84Å; Q101-I105 PolarHBondContact O-N 2.78Å
102	E	66.4	Low	72.1	Confident	164 Å²	164	84.5 Å²	84.5	77%	0.766	42%	0.421	S	S	*	.	H	α-helix	trans	-60.1	-27.1	178.2	-157.2	170.3	-169.8	0	0	112.6	I105	E102-I105 VanDerWaalsContact O-CB 3.26Å; E102-I105 WeakPolarHBondContact O-CB 3.15Å; E102-I105 PolarHBondContact O-N 2.83Å
103	D	67.7	Low	71.2	Confident	122 Å²	122	84.9 Å²	84.9	65%	0.652	43%	0.428	S	S	*	.	H	α-helix	trans	-72.4	-30	173.3	-64	-25.2	0	0	0	112.7	Q101 I105 K107	Q101-D103 PolarHBondContact O-N 3.42Å; D103-I105 VanDerWaalsContact C-N 3.26Å; D103-I105 PolarHBondContact O-N 3.41Å; D103-K107 PolarHBondContact O-N 2.84Å
104	D	68.9	Low	70.3	Confident	53 Å²	53	84.7 Å²	84.7	28%	0.283	43%	0.428	S	S	.	.	H	α-helix	trans	-71.2	-28.2	176	-65.3	-49.1	0	0	0	111.2	L100 Q101 K107 L108	L100-D104 HydrophobicContact CD2-CB 4.08Å; Q101-D104 PolarHBondContact N-OD2 3.48Å; Q101-D104 WeakPolarHBondContact O-CB 3.24Å; Q101-D104 PolarHBondContact O-N 2.84Å; D104-K107 PolarHBondContact O-N 3.49Å; D104-L108 WeakPolarHBondContact O-CB 3.45Å; D104-L108 WeakPolarHBondContact O-CG 3.48Å; D104-L108 PolarHBondContact O-N 3.11Å
105	I	66.9	Low	69.4	Low	26 Å²	26	83 Å²	83	13%	0.133	42%	0.419	C	S	.	.	H	α-helix	trans	-59	-53.3	174.9	-81.2	175.8	0	0	0	109	R61 Q101 E102 D103 K107 L108 K109	R61-I105 PolarHBondContact NH1-O 3.29Å; R61-I105 VanDerWaalsContact NH2-CB 3.3Å; R61-I105 PolarHBondContact NH2-O 3.25Å; Q101-I105 PolarHBondContact O-N 2.78Å; E102-I105 VanDerWaalsContact O-CB 3.26Å; E102-I105 WeakPolarHBondContact O-CB 3.15Å; E102-I105 PolarHBondContact O-N 2.83Å; D103-I105 VanDerWaalsContact C-N 3.26Å; D103-I105 PolarHBondContact O-N 3.41Å; I105-K107 VanDerWaalsContact C-N 3.29Å; I105-K107 PolarHBondContact O-N 2.84Å; I105-L108 WeakPolarHBondContact O-CB 3.32Å; I105-L108 PolarHBondContact O-N 3.22Å; I105-L108 VanDerWaalsContact O-N 3.14Å; I105-K109 PolarHBondContact O-N 2.86Å
106	D	70.5	Confident	68.5	Low	113 Å²	113	89 Å²	89	60%	0.604	45%	0.451	S	S	*	.	H	α-helix	trans	-61.5	-38.4	178.9	-80	-17.4	0	0	0	112.9	L108 K109 L110	D106-L108 VanDerWaalsContact C-N 3.34Å; D106-L108 PolarHBondContact O-N 3.38Å; D106-K109 PolarHBondContact O-N 3.4Å; D106-L110 PolarHBondContact O-N 2.94Å
107	K	73.8	Confident	67.3	Low	153 Å²	153	91.4 Å²	91.4	67%	0.665	46%	0.464	S	S	*	.	H	α-helix	trans	-62.5	-40.5	175.8	-173	179.7	179	-177	0	112.3	D103 D104 I105 L110 M111	D103-K107 PolarHBondContact O-N 2.84Å; D104-K107 PolarHBondContact O-N 3.49Å; I105-K107 VanDerWaalsContact C-N 3.29Å; I105-K107 PolarHBondContact O-N 2.84Å; K107-L110 PolarHBondContact O-N 3.16Å; K107-M111 WeakPolarHBondContact O-CB 3.21Å; K107-M111 PolarHBondContact O-N 2.84Å
108	L	70.6	Confident	65.8	Low	18 Å²	18	93 Å²	93	9%	0.094	47%	0.466	C	S	.	.	H	α-helix	trans	-65.1	-43.6	174.9	-80.3	161.4	0	0	0	111.3	R61 E91 L100 D104 I105 D106 L110 M111 Y112	R61-L108 VanDerWaalsContact NH1-CB 3.35Å; E91-L108 HydrophobicContact CB-CD1 4.4Å; E91-L108 HydrophobicContact CB-CD2 4.49Å; E91-L108 HydrophobicContact CG-CD1 3.92Å; L100-L108 HydrophobicContact CD2-CD1 4.05Å; D104-L108 WeakPolarHBondContact O-CB 3.45Å; D104-L108 WeakPolarHBondContact O-CG 3.48Å; D104-L108 PolarHBondContact O-N 3.11Å; I105-L108 WeakPolarHBondContact O-CB 3.32Å; I105-L108 PolarHBondContact O-N 3.22Å; I105-L108 VanDerWaalsContact O-N 3.14Å; D106-L108 VanDerWaalsContact C-N 3.34Å; D106-L108 PolarHBondContact O-N 3.38Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 3.36Å; L108-M111 HydrophobicContact CD2-CE 4.22Å; L108-M111 WeakPolarHBondContact O-CA 3.31Å; L108-M111 WeakPolarHBondContact O-CB 3.43Å; L108-M111 PolarHBondContact O-N 3.21Å; L108-Y112 HydrophobicContact CB-CE2 4.44Å; L108-Y112 HydrophobicContact CD2-CE2 4.48Å; L108-Y112 WeakPolarHBondContact O-CD2 3.25Å; L108-Y112 PolarHBondContact O-N 3.09Å
109	K	71.5	Confident	64.5	Low	102 Å²	102	95 Å²	95	44%	0.443	47%	0.472	S	S	.	.	H	α-helix	trans	-58.6	-42	176.1	-171.4	169.4	178.9	171	0	111.3	E66 I105 D106 Y112 S113	E66-K109 VanDerWaalsContact CD-NZ 3.3Å; E66-K109 IonicContact OE1-NZ 3.34Å; E66-K109 PolarHBondContact OE1-NZ 3.39Å; E66-K109 WeakPolarHBondContact OE2-CE 3.37Å; E66-K109 IonicContact OE2-NZ 3.69Å; E66-K109 PolarHBondContact OE2-NZ 2.87Å; I105-K109 PolarHBondContact O-N 2.86Å; D106-K109 PolarHBondContact O-N 3.4Å; K109-Y112 PolarHBondContact O-N 2.97Å; K109-S113 PolarHBondContact O-N 3.31Å; K109-S113 VanDerWaalsContact O-N 3.17Å
110	L	68.2	Low	63.3	Low	109 Å²	109	95.2 Å²	95.2	57%	0.571	48%	0.483	S	S	*	.	H	α-helix	trans	-69	-35.3	174.1	-168.1	71.9	0	0	0	112.7	D106 K107 L108 Y112 S113 N114	D106-L110 PolarHBondContact O-N 2.94Å; K107-L110 PolarHBondContact O-N 3.16Å; L108-L110 VanDerWaalsContact C-N 3.28Å; L108-L110 PolarHBondContact O-N 3.36Å; L110-Y112 VanDerWaalsContact C-N 3.3Å; L110-Y112 PolarHBondContact O-N 2.83Å; L110-S113 PolarHBondContact O-OG 2.76Å; L110-S113 VanDerWaalsContact O-OG 3.09Å; L110-N114 PolarHBondContact O-N 3.16Å; L110-N114 PolarHBondContact O-ND2 3.1Å
111	M	69.8	Low	62.1	Low	83 Å²	83	99.3 Å²	99.3	41%	0.409	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-41.2	176.2	-164.9	171.1	87.3	0	0	110.7	A87 K107 L108 N114 F115	A87-M111 HydrophobicContact CB-CE 3.58Å; K107-M111 WeakPolarHBondContact O-CB 3.21Å; K107-M111 PolarHBondContact O-N 2.84Å; L108-M111 HydrophobicContact CD2-CE 4.22Å; L108-M111 WeakPolarHBondContact O-CA 3.31Å; L108-M111 WeakPolarHBondContact O-CB 3.43Å; L108-M111 PolarHBondContact O-N 3.21Å; M111-N114 PolarHBondContact O-N 3.04Å; M111-F115 HydrophobicContact CE-CE2 4.25Å; M111-F115 HydrophobicContact CE-CZ 4.08Å; M111-F115 HydrophobicContact CG-CE2 4.15Å; M111-F115 HydrophobicContact CG-CZ 4.03Å; M111-F115 WeakPolarHBondContact O-CD2 3.32Å
112	Y	66.3	Low	60.8	Low	15 Å²	15	101 Å²	101	6%	0.059	52%	0.519	C	S	.	.	H	α-helix	trans	-68.9	-44	179.3	-71.7	-64.7	0	0	0	113.7	P68 A87 L88 E91 L108 K109 L110 N114 F115	P68-Y112 HydrophobicContact CB-CD1 4.35Å; P68-Y112 HydrophobicContact CG-CD1 3.4Å; P68-Y112 VanDerWaalsContact CG-CD1 3.4Å; P68-Y112 HydrophobicContact CG-CD2 4.03Å; P68-Y112 HydrophobicContact CG-CE1 3.79Å; P68-Y112 HydrophobicContact CG-CE2 4.39Å; P68-Y112 HydrophobicContact CG-CG 3.54Å; A87-Y112 HydrophobicContact CB-CE1 3.66Å; L88-Y112 VanDerWaalsContact CA-OH 3.31Å; L88-Y112 WeakPolarHBondContact CA-OH 3.48Å; L88-Y112 PolarHBondContact N-OH 3.3Å; L88-Y112 VanDerWaalsContact N-OH 3.16Å; E91-Y112 PolarHBondContact OE2-OH 3.46Å; L108-Y112 HydrophobicContact CB-CE2 4.44Å; L108-Y112 HydrophobicContact CD2-CE2 4.48Å; L108-Y112 WeakPolarHBondContact O-CD2 3.25Å; L108-Y112 PolarHBondContact O-N 3.09Å; K109-Y112 PolarHBondContact O-N 2.97Å; L110-Y112 VanDerWaalsContact C-N 3.3Å; L110-Y112 PolarHBondContact O-N 2.83Å; Y112-N114 PolarHBondContact O-N 3.02Å; Y112-F115 AromaticContact CD1-CD2 3.83Å; Y112-F115 HydrophobicContact CD1-CD2 3.83Å; Y112-F115 AromaticContact CD1-CE2 3.75Å; Y112-F115 HydrophobicContact CD1-CE2 3.75Å; Y112-F115 HydrophobicContact CE1-CE2 4.26Å; Y112-F115 PolarHBondContact O-N 3.48Å
113	S	65.2	Low	59.6	Low	69 Å²	69	99.6 Å²	99.6	48%	0.483	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-22.9	178.1	62.9	0	0	0	0	113.5	K109 L110	K109-S113 PolarHBondContact O-N 3.31Å; K109-S113 VanDerWaalsContact O-N 3.17Å; L110-S113 PolarHBondContact O-OG 2.76Å; L110-S113 VanDerWaalsContact O-OG 3.09Å
114	N	62.5	Low	58.2	Low	86 Å²	86	102.2 Å²	102.2	46%	0.46	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-12.1	176.5	-73.8	-47.6	0	0	0	114	L110 M111 Y112 Q117	L110-N114 PolarHBondContact O-N 3.16Å; L110-N114 PolarHBondContact O-ND2 3.1Å; M111-N114 PolarHBondContact O-N 3.04Å; Y112-N114 PolarHBondContact O-N 3.02Å; N114-Q117 PolarHBondContact O-N 2.99Å
115	F	62.9	Low	56.8	Low	45 Å²	45	107.3 Å²	107.3	20%	0.197	54%	0.542	C	S	.	.	G	3₁₀ helix	trans	-69.3	-34.3	-179.8	-75.8	-55.1	0	0	0	112.6	R83 Q84 A87 M111 Y112 Q117 K118	R83-F115 HydrophobicContact CB-CD1 4.29Å; R83-F115 HydrophobicContact CB-CE1 4.03Å; Q84-F115 HydrophobicContact CG-CB 4.39Å; Q84-F115 HydrophobicContact CG-CD2 4Å; Q84-F115 HydrophobicContact CG-CG 4.32Å; A87-F115 HydrophobicContact CB-CE2 4.16Å; A87-F115 HydrophobicContact CB-CZ 4.32Å; M111-F115 HydrophobicContact CE-CE2 4.25Å; M111-F115 HydrophobicContact CE-CZ 4.08Å; M111-F115 HydrophobicContact CG-CE2 4.15Å; M111-F115 HydrophobicContact CG-CZ 4.03Å; M111-F115 WeakPolarHBondContact O-CD2 3.32Å; Y112-F115 AromaticContact CD1-CD2 3.83Å; Y112-F115 HydrophobicContact CD1-CD2 3.83Å; Y112-F115 AromaticContact CD1-CE2 3.75Å; Y112-F115 HydrophobicContact CD1-CE2 3.75Å; Y112-F115 HydrophobicContact CE1-CE2 4.26Å; Y112-F115 PolarHBondContact O-N 3.48Å; F115-Q117 PolarHBondContact O-N 2.84Å; F115-Q117 VanDerWaalsContact O-N 3.09Å; F115-K118 PolarHBondContact O-N 3.3Å
116	D	57.4	Low	55.2	Low	130 Å²	130	113 Å²	113	70%	0.695	57%	0.573	S	S	*	*	G	3₁₀ helix	trans	-65.1	-15.2	-179	-67.2	-23.7	0	0	0	113.2
117	Q	53.2	Low	53.6	Low	165 Å²	165	112.3 Å²	112.3	77%	0.771	57%	0.574	S	S	*	*	G	3₁₀ helix	trans	-99.3	-8.4	-176.3	-82.7	-174	-6.3	0	0	116	N114 F115	N114-Q117 PolarHBondContact O-N 2.99Å; F115-Q117 PolarHBondContact O-N 2.84Å; F115-Q117 VanDerWaalsContact O-N 3.09Å
118	K	46.9	Very low	51.8	Low	139 Å²	139	112.3 Å²	112.3	60%	0.604	58%	0.581	S	S	*	*			trans	-129.7	79.9	-176.8	-79.4	-174	177.1	-178.6	0	113.5	R83 F115	R83-K118 PolarHBondContact NH1-O 3.38Å; F115-K118 PolarHBondContact O-N 3.3Å
119	S	44.2	Very low	50	Low	102 Å²	102	120.5 Å²	120.5	71%	0.713	62%	0.616	S	S	*	*			trans	-59	133.3	156.2	61.8	0	0	0	0	110
120	N	41.9	Very low	48.3	Very low	144 Å²	144	122.1 Å²	122.1	77%	0.77	63%	0.63	S	S	*	*			trans	68.4	88.1	168.2	-56.8	-20.5	0	0	0	116.4
121	D	42.1	Very low	46.9	Very low	112 Å²	112	122.7 Å²	122.7	60%	0.599	63%	0.634	S	S	*	*			trans	-150.6	115.1	149.2	-85.1	-37.1	0	0	0	108.5	R83 Y123	R83-D121 PolarHBondContact NH2-O 3.08Å; D121-Y123 VanDerWaalsContact C-N 3.32Å; D121-Y123 PolarHBondContact O-N 3.36Å
122	N	40.4	Very low	45.3	Very low	172 Å²	172	125.4 Å²	125.4	92%	0.92	65%	0.65	S	S	*	*			trans	-65.2	91.4	175.4	-62.5	-37	0	0	0	108.4	E124	N122-E124 PolarHBondContact O-N 3.13Å
123	Y	40.9	Very low	44.1	Very low	134 Å²	134	132.5 Å²	132.5	53%	0.525	69%	0.689	S	S	.	*			trans	-85.1	110.9	165.8	73.8	-91.5	0	0	0	107	R83 D121 L125	R83-Y123 HydrophobicContact CG-CE1 3.72Å; D121-Y123 VanDerWaalsContact C-N 3.32Å; D121-Y123 PolarHBondContact O-N 3.36Å; Y123-L125 PolarHBondContact O-N 3.44Å
124	E	37.5	Very low	42.8	Very low	177 Å²	177	138.5 Å²	138.5	83%	0.827	71%	0.706	S	S	*	*			trans	-55.5	134	163.8	-68.5	175.1	158.7	0	0	107.8	N122 N126	N122-E124 PolarHBondContact O-N 3.13Å; E124-N126 PolarHBondContact O-N 3.33Å
125	L	40	Very low	41.8	Very low	159 Å²	159	139.9 Å²	139.9	83%	0.832	72%	0.717	S	S	*	*			trans	-49	111.4	169	-81.8	100.5	0	0	0	107.5	Y123 P127	Y123-L125 PolarHBondContact O-N 3.44Å; L125-P127 WeakPolarHBondContact O-CD 3.45Å
126	N	33.8	Very low	40.7	Very low	146 Å²	146	143.5 Å²	143.5	78%	0.781	74%	0.738	S	S	*	*			trans	-75.2	104.8	161.6	-113.3	-33.7	0	0	0	105.3	E124 N128	E124-N126 PolarHBondContact O-N 3.33Å; N126-N128 VanDerWaalsContact C-N 3.27Å; N126-N128 PolarHBondContact O-N 2.98Å
127	P	35.7	Very low	39.9	Very low	99 Å²	99	146 Å²	146	64%	0.643	75%	0.745	S	S	*	*			trans	-74.2	97.1	171	24.9	-10	0	0	0	103.7	L125 K129	L125-P127 WeakPolarHBondContact O-CD 3.45Å; P127-K129 PolarHBondContact O-N 2.92Å
128	N	36.2	Very low	39.4	Very low	152 Å²	152	143.6 Å²	143.6	81%	0.813	73%	0.734	S	S	*	*			trans	-59.3	94.8	165.7	-97.4	-30.8	0	0	0	106.5	N126 N130	N126-N128 VanDerWaalsContact C-N 3.27Å; N126-N128 PolarHBondContact O-N 2.98Å; N128-N130 PolarHBondContact O-N 3.09Å
129	K	34.3	Very low	39.2	Very low	191 Å²	191	142.4 Å²	142.4	83%	0.83	74%	0.74	S	S	*	*			trans	-69.1	14.2	-171.1	-131.3	176.3	-175.1	177.5	0	113.6	P127	P127-K129 PolarHBondContact O-N 2.92Å
130	N	35.3	Very low	38.9	Very low	135 Å²	135	140.8 Å²	140.8	72%	0.722	74%	0.74	S	S	*	*			trans	-131.9	74	-171.8	-64.7	-19.2	0	0	0	109	N128	N128-N130 PolarHBondContact O-N 3.09Å
131	N	39.5	Very low	38.8	Very low	122 Å²	122	139.9 Å²	139.9	65%	0.652	73%	0.734	S	S	*	*	S	Bend	trans	-171.8	76	147.7	-88.6	-31.8	0	0	0	108.5	R99 D133	R99-N131 PolarHBondContact NH1-ND2 3.2Å; N131-D133 PolarHBondContact O-N 3.4Å
132	N	36.2	Very low	38.6	Very low	140 Å²	140	138.7 Å²	138.7	75%	0.749	73%	0.731	S	S	*	*			trans	13.3	100.3	149.7	-54.1	-22	0	0	0	115.1	K134	N132-K134 PolarHBondContact O-N 2.73Å
133	D	39.4	Very low	38.7	Very low	163 Å²	163	138.9 Å²	138.9	87%	0.872	73%	0.727	S	S	*	*			trans	14.6	43	133.2	-55.1	-27.5	0	0	0	118.8	N131 V135	N131-D133 PolarHBondContact O-N 3.4Å; D133-V135 PolarHBondContact O-N 3.37Å
134	K	39.3	Very low	38.7	Very low	195 Å²	195	141.7 Å²	141.7	85%	0.848	74%	0.736	S	S	*	*			trans	-97.9	55.6	158.2	-72.1	-172.3	178.6	-176	0	107.3	N132 L136	N132-K134 PolarHBondContact O-N 2.73Å; K134-L136 PolarHBondContact O-N 3.16Å
135	V	41.5	Very low	38.6	Very low	115 Å²	115	140.6 Å²	140.6	70%	0.697	72%	0.724	S	S	*	*			trans	-63.6	94.4	151.2	-179.7	0	0	0	0	103.4	D133 H137	D133-V135 PolarHBondContact O-N 3.37Å; V135-H137 VanDerWaalsContact C-N 3.33Å; V135-H137 PolarHBondContact O-N 3.31Å
136	L	39.6	Very low	38.7	Very low	122 Å²	122	139.9 Å²	139.9	64%	0.639	72%	0.722	S	S	*	*			trans	-56.6	106.1	172.8	-165.4	73.1	0	0	0	104.6	K134 E138	K134-L136 PolarHBondContact O-N 3.16Å; L136-E138 HydrophobicContact CD2-CG 3.97Å; L136-E138 HydrophobicContact CG-CG 4.29Å; L136-E138 PolarHBondContact O-N 3.04Å
137	H	40.4	Very low	38.9	Very low	182 Å²	182	139.5 Å²	139.5	84%	0.843	72%	0.715	S	S	*	*			trans	-64.4	71.7	166.7	-79.8	-74.8	0	0	0	106.9	V135	V135-H137 VanDerWaalsContact C-N 3.33Å; V135-H137 PolarHBondContact O-N 3.31Å
138	E	42.1	Very low	39.4	Very low	115 Å²	115	141.1 Å²	141.1	54%	0.537	72%	0.717	S	S	.	*			trans	-67.7	127.1	157	-86.4	-171	123.2	0	0	105.8	K96 L136 G140	K96-E138 IonicContact NZ-OE2 3.74Å; K96-E138 PolarHBondContact NZ-OE2 2.86Å; L136-E138 HydrophobicContact CD2-CG 3.97Å; L136-E138 HydrophobicContact CG-CG 4.29Å; L136-E138 PolarHBondContact O-N 3.04Å; E138-G140 VanDerWaalsContact C-N 3.33Å; E138-G140 PolarHBondContact O-N 2.91Å
139	P	43.2	Very low	39.7	Very low	113 Å²	113	137.6 Å²	137.6	73%	0.734	71%	0.709	S	S	*	*			trans	-56.7	108.9	168.6	24.9	-30.8	0	0	0	104.6	L141	P139-L141 PolarHBondContact O-N 3.42Å
140	G	38.4	Very low	40.1	Very low	68 Å²	68	138.7 Å²	138.7	70%	0.701	71%	0.709	S	S	*	*			trans	-46.3	109.8	-177	0	0	0	0	0	106.6	E138 T142	E138-G140 VanDerWaalsContact C-N 3.33Å; E138-G140 PolarHBondContact O-N 2.91Å; G140-T142 PolarHBondContact O-N 3.32Å
141	L	39.6	Very low	40.6	Very low	126 Å²	126	136 Å²	136	66%	0.66	69%	0.693	S	S	*	*			trans	-60.8	97.1	172.1	-71.8	171	0	0	0	102.5	P139 E143	P139-L141 PolarHBondContact O-N 3.42Å; L141-E143 PolarHBondContact O-N 3.31Å
142	T	37.4	Very low	40.8	Very low	86 Å²	86	133.9 Å²	133.9	53%	0.528	68%	0.681	S	S	.	*			trans	-32.3	113.8	-177.5	38.1	0	0	0	0	107.9	G140 R144 R145	G140-T142 PolarHBondContact O-N 3.32Å; T142-R144 PolarHBondContact O-N 2.89Å; T142-R145 PolarHBondContact O-N 3.02Å
143	E	41.9	Very low	41.6	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-48	-28.2	-173.7	-73.7	175.6	150	0	0	111.7	L141 R145 N146	L141-E143 PolarHBondContact O-N 3.31Å; E143-R145 PolarHBondContact O-N 3.5Å; E143-R145 VanDerWaalsContact O-N 3.09Å; E143-N146 PolarHBondContact O-N 3.04Å
144	R	40.5	Very low	42.2	Very low	193 Å²	193	131.2 Å²	131.2	73%	0.728	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-49.6	-27.7	170.5	-94.8	-174	-169.1	-179.4	6.9	117.1	T142 N146 E147	T142-R144 PolarHBondContact O-N 2.89Å; R144-N146 PolarHBondContact O-N 3.22Å; R144-E147 WeakPolarHBondContact CA-OE1 3.47Å; R144-E147 WeakPolarHBondContact CG-OE1 3.4Å; R144-E147 PolarHBondContact O-N 3.49Å
145	R	36.2	Very low	42.4	Very low	153 Å²	153	132 Å²	132	58%	0.577	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-67.7	-22.8	-177.9	-78	-169.1	-161.7	168	6	112.8	T142 E143	T142-R145 PolarHBondContact O-N 3.02Å; E143-R145 PolarHBondContact O-N 3.5Å; E143-R145 VanDerWaalsContact O-N 3.09Å
146	N	41.7	Very low	42.5	Very low	145 Å²	145	128.4 Å²	128.4	78%	0.775	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-100.3	0.3	-176.5	-66.6	-3.5	0	0	0	113.4	E143 R144 I148	E143-N146 PolarHBondContact O-N 3.04Å; R144-N146 PolarHBondContact O-N 3.22Å; N146-I148 PolarHBondContact O-N 3.4Å
147	E	39.2	Very low	42.5	Very low	137 Å²	137	127 Å²	127	64%	0.64	65%	0.647	S	S	*	*			trans	-77.1	93.1	179	-59.6	-173.4	-128.1	0	0	110.1	R144 A149	R144-E147 WeakPolarHBondContact CA-OE1 3.47Å; R144-E147 WeakPolarHBondContact CG-OE1 3.4Å; R144-E147 PolarHBondContact O-N 3.49Å; E147-A149 PolarHBondContact O-N 2.98Å
148	I	44.9	Very low	42.6	Very low	133 Å²	133	126 Å²	126	68%	0.682	64%	0.642	S	S	*	*			trans	-70.3	117.9	168.3	-56.4	168.7	0	0	0	107	N146 Y150	N146-I148 PolarHBondContact O-N 3.4Å; I148-Y150 PolarHBondContact O-N 3.19Å
149	A	42.9	Very low	42.5	Very low	78 Å²	78	128.4 Å²	128.4	65%	0.645	65%	0.65	S	S	*	*			trans	-54.2	132.4	177.4	0	0	0	0	0	110.9	E147 Q151	E147-A149 PolarHBondContact O-N 2.98Å; A149-Q151 PolarHBondContact O-N 3.27Å
150	Y	43.3	Very low	42.3	Very low	215 Å²	215	128.1 Å²	128.1	84%	0.843	65%	0.646	S	S	*	*			trans	-53.6	110.9	177.8	-178.3	-96.5	0	0	0	110.8	I148 N152	I148-Y150 PolarHBondContact O-N 3.19Å; Y150-N152 PolarHBondContact O-N 2.89Å
151	Q	45.6	Very low	42.5	Very low	79 Å²	79	128.7 Å²	128.7	37%	0.369	64%	0.64	S	S	.	*			trans	-76.2	105.1	-178.6	-68.2	-79.8	-19.6	0	0	109.3	A149 P153	A149-Q151 PolarHBondContact O-N 3.27Å; Q151-P153 WeakPolarHBondContact O-CD 3.34Å
152	N	44.1	Very low	42.5	Very low	77 Å²	77	125 Å²	125	41%	0.412	63%	0.632	S	S	.	*			trans	-79	114.9	171.1	-173.8	-16	0	0	0	109.6	Y150 L154 W155	Y150-N152 PolarHBondContact O-N 2.89Å; N152-L154 PolarHBondContact O-N 3.22Å; N152-L154 WeakPolarHBondContact OD1-CB 3.41Å; N152-L154 PolarHBondContact OD1-N 3.43Å; N152-W155 PolarHBondContact O-N 3.44Å
153	P	51.9	Low	42.6	Very low	109 Å²	109	122.3 Å²	122.3	71%	0.708	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-17.5	-177.7	25.3	-34.1	0	0	0	113.4	Q151 W155	Q151-P153 WeakPolarHBondContact O-CD 3.34Å; P153-W155 PolarHBondContact O-N 2.9Å
154	L	52.3	Low	42.5	Very low	137 Å²	137	117.5 Å²	117.5	72%	0.717	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-33	-178.3	-132.1	86.1	0	0	0	113.2	N152	N152-L154 PolarHBondContact O-N 3.22Å; N152-L154 WeakPolarHBondContact OD1-CB 3.41Å; N152-L154 PolarHBondContact OD1-N 3.43Å
155	W	43.1	Very low	42.7	Very low	211 Å²	211	112.3 Å²	112.3	80%	0.799	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	3	-172.8	-62.2	-16.8	0	0	0	114.1	N152 P153	N152-W155 PolarHBondContact O-N 3.44Å; P153-W155 PolarHBondContact O-N 2.9Å
156	G	43.5	Very low	42.8	Very low	40 Å²	40	107.9 Å²	107.9	41%	0.412	59%	0.586	S	S	.	*			trans	66.5	175.9	179.6	0	0	0	0	0	113	H158	G156-H158 PolarHBondContact O-N 3.33Å
157	E	41	Very low	42.9	Very low	94 Å²	94	107.9 Å²	107.9	44%	0.439	59%	0.592	S	S	.	*			trans	-56.2	106	176.2	-64.6	179.4	-175.2	0	0	110	K159	E157-K159 PolarHBondContact O-N 2.89Å
158	H	41.9	Very low	43.2	Very low	160 Å²	160	103.4 Å²	103.4	74%	0.741	58%	0.582	S	S	*	*			trans	-92.3	93.8	164.9	-141.2	-127.5	0	0	0	106.3	G156 V160	G156-H158 PolarHBondContact O-N 3.33Å; H158-V160 VanDerWaalsContact C-N 3.31Å; H158-V160 PolarHBondContact O-N 2.95Å
159	K	39.1	Very low	43.4	Very low	166 Å²	166	101.1 Å²	101.1	72%	0.722	57%	0.569	S	S	*	*			trans	-65.4	98.9	166.7	-65.8	-170	178.2	-169.2	0	106.8	E157 S161	E157-K159 PolarHBondContact O-N 2.89Å; K159-S161 PolarHBondContact O-N 3.34Å
160	V	40.3	Very low	43.7	Very low	106 Å²	106	102.8 Å²	102.8	64%	0.642	56%	0.558	S	S	*	*			trans	-75.6	86.4	167.3	-165.8	0	0	0	0	105.3	H158 G162 G163	H158-V160 VanDerWaalsContact C-N 3.31Å; H158-V160 PolarHBondContact O-N 2.95Å; V160-G162 PolarHBondContact O-N 2.99Å; V160-G163 PolarHBondContact O-N 2.76Å
161	S	42.5	Very low	44.1	Very low	81 Å²	81	96.7 Å²	96.7	57%	0.566	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	125.3	171.1	-179.5	0	0	0	0	107.5	K159 E166 Q169	K159-S161 PolarHBondContact O-N 3.34Å; S161-E166 VanDerWaalsContact CA-OE2 3.28Å; S161-E166 WeakPolarHBondContact CA-OE2 3.4Å; S161-E166 PolarHBondContact OG-OE2 3.47Å; S161-Q169 PolarHBondContact OG-OE1 3.35Å
162	G	40.3	Very low	44.3	Very low	49 Å²	49	97.3 Å²	97.3	51%	0.505	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.5	6	-174.3	0	0	0	0	0	116.3	V160 E166	V160-G162 PolarHBondContact O-N 2.99Å; G162-E166 PolarHBondContact N-OE2 3.05Å
163	G	37.5	Very low	44.6	Very low	29 Å²	29	102.4 Å²	102.4	30%	0.299	56%	0.56	S	S	.	*			trans	-71.5	145.7	166.4	0	0	0	0	0	111.7	V160 S165 E166	V160-G163 PolarHBondContact O-N 2.76Å; G163-S165 PolarHBondContact O-N 3.06Å; G163-E166 PolarHBondContact O-N 3.48Å
164	S	39.8	Very low	44.6	Very low	75 Å²	75	99.7 Å²	99.7	52%	0.524	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-3.5	-175.1	-50.4	0	0	0	0	115.9	W170	S164-W170 VanDerWaalsContact O-CD1 3.3Å; S164-W170 PolarHBondContact O-NE1 3.36Å
165	S	45.8	Very low	44.8	Very low	84 Å²	84	99.1 Å²	99.1	59%	0.587	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-7.4	175.4	56.9	0	0	0	0	113.9	G163 T167	G163-S165 PolarHBondContact O-N 3.06Å; S165-T167 PolarHBondContact O-N 3.41Å; S165-T167 VanDerWaalsContact O-N 3.16Å
166	E	37.6	Very low	45.4	Very low	60 Å²	60	94 Å²	94	28%	0.28	54%	0.536	S	S	.	.	S	Bend	trans	-71.4	112.6	170.1	-75.9	-174.2	153.6	0	0	109.1	S161 G162 G163 G168 Q169	S161-E166 VanDerWaalsContact CA-OE2 3.28Å; S161-E166 WeakPolarHBondContact CA-OE2 3.4Å; S161-E166 PolarHBondContact OG-OE2 3.47Å; G162-E166 PolarHBondContact N-OE2 3.05Å; G163-E166 PolarHBondContact O-N 3.48Å; E166-G168 PolarHBondContact O-N 3.07Å; E166-Q169 PolarHBondContact O-N 3.14Å; E166-Q169 PolarHBondContact OE2-OE1 3.23Å
167	T	45.1	Very low	45.8	Very low	145 Å²	145	93.9 Å²	93.9	89%	0.89	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	111.5	171.2	45.4	0	0	0	0	109.6	S165	S165-T167 PolarHBondContact O-N 3.41Å; S165-T167 VanDerWaalsContact O-N 3.16Å
168	G	44	Very low	46.1	Very low	43 Å²	43	91.5 Å²	91.5	44%	0.443	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.2	13.6	167.6	0	0	0	0	0	117.5	E166 D172	E166-G168 PolarHBondContact O-N 3.07Å; G168-D172 WeakPolarHBondContact O-CB 3.48Å; G168-D172 VanDerWaalsContact O-OD2 3.13Å
169	Q	49.8	Very low	46.5	Very low	85 Å²	85	85.7 Å²	85.7	40%	0.397	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-56.5	173.9	-78	-167.4	-3.3	0	0	114.3	S161 E166 D172 Y173	S161-Q169 PolarHBondContact OG-OE1 3.35Å; E166-Q169 PolarHBondContact O-N 3.14Å; E166-Q169 PolarHBondContact OE2-OE1 3.23Å; Q169-D172 PolarHBondContact O-N 2.88Å; Q169-Y173 WeakPolarHBondContact O-CB 3.4Å; Q169-Y173 WeakPolarHBondContact O-CD2 3.33Å; Q169-Y173 PolarHBondContact O-N 3.39Å
170	W	48.8	Very low	47.1	Very low	113 Å²	113	80.9 Å²	80.9	43%	0.428	51%	0.505	S	S	.	.	H	α-helix	trans	-71.9	-37.2	-175.6	80.9	-80.5	0	0	0	112.9	S164 Y173 A174	S164-W170 VanDerWaalsContact O-CD1 3.3Å; S164-W170 PolarHBondContact O-NE1 3.36Å; W170-Y173 PolarHBondContact O-N 2.7Å; W170-A174 HydrophobicContact CE3-CB 4.44Å; W170-A174 WeakPolarHBondContact O-CB 3.4Å; W170-A174 PolarHBondContact O-N 2.84Å
171	I	51.9	Low	47.4	Very low	87 Å²	87	83.5 Å²	83.5	45%	0.446	51%	0.511	S	S	.	.	H	α-helix	trans	-65.9	-44.1	176.5	-61.1	178.9	0	0	0	109.1	A174 L175	I171-A174 PolarHBondContact O-N 2.91Å; I171-L175 WeakPolarHBondContact O-CB 3.36Å; I171-L175 PolarHBondContact O-N 3.19Å
172	D	50.3	Low	47.6	Very low	93 Å²	93	86.2 Å²	86.2	50%	0.497	52%	0.519	S	S	.	.	H	α-helix	trans	-63.2	-43.7	176.2	-79.5	9.9	0	0	0	111.1	G168 Q169 L175 V176	G168-D172 WeakPolarHBondContact O-CB 3.48Å; G168-D172 VanDerWaalsContact O-OD2 3.13Å; Q169-D172 PolarHBondContact O-N 2.88Å; D172-L175 PolarHBondContact O-N 3.34Å; D172-V176 VanDerWaalsContact O-CB 3.24Å; D172-V176 WeakPolarHBondContact O-CB 3.47Å; D172-V176 WeakPolarHBondContact O-CG2 3.26Å; D172-V176 PolarHBondContact O-N 3.19Å
173	Y	49.5	Very low	47.7	Very low	183 Å²	183	89 Å²	89	72%	0.718	53%	0.526	S	S	*	.	H	α-helix	trans	-64.2	-40.5	174.5	-98	-86.1	0	0	0	112.7	Q169 W170 G177	Q169-Y173 WeakPolarHBondContact O-CB 3.4Å; Q169-Y173 WeakPolarHBondContact O-CD2 3.33Å; Q169-Y173 PolarHBondContact O-N 3.39Å; W170-Y173 PolarHBondContact O-N 2.7Å; Y173-G177 WeakPolarHBondContact O-CA 3.48Å; Y173-G177 PolarHBondContact O-N 3.22Å
174	A	52.4	Low	48	Very low	53 Å²	53	92.2 Å²	92.2	44%	0.438	54%	0.544	S	S	.	.	H	α-helix	trans	-68.1	-39.3	177.8	0	0	0	0	0	111.2	W170 I171 A178	W170-A174 HydrophobicContact CE3-CB 4.44Å; W170-A174 WeakPolarHBondContact O-CB 3.4Å; W170-A174 PolarHBondContact O-N 2.84Å; I171-A174 PolarHBondContact O-N 2.91Å; A174-A178 WeakPolarHBondContact O-CB 3.23Å; A174-A178 PolarHBondContact O-N 2.88Å
175	L	57	Low	48.2	Very low	124 Å²	124	93.5 Å²	93.5	65%	0.649	56%	0.559	S	S	*	*	H	α-helix	trans	-72.2	-41.6	178.7	-160	74.2	0	0	0	111.4	I171 D172 G179	I171-L175 WeakPolarHBondContact O-CB 3.36Å; I171-L175 PolarHBondContact O-N 3.19Å; D172-L175 PolarHBondContact O-N 3.34Å; L175-G179 PolarHBondContact O-N 2.84Å
176	V	55.8	Low	47.7	Very low	105 Å²	105	96.1 Å²	96.1	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-40.9	173	170.8	0	0	0	0	110.7	D172 G179 A180	D172-V176 VanDerWaalsContact O-CB 3.24Å; D172-V176 WeakPolarHBondContact O-CB 3.47Å; D172-V176 WeakPolarHBondContact O-CG2 3.26Å; D172-V176 PolarHBondContact O-N 3.19Å; V176-G179 PolarHBondContact O-N 3.28Å; V176-A180 WeakPolarHBondContact O-CB 3.37Å; V176-A180 PolarHBondContact O-N 2.9Å
177	G	52.6	Low	47.6	Very low	36 Å²	36	101 Å²	101	37%	0.371	60%	0.595	S	S	.	*	H	α-helix	trans	-64	-45	175.5	0	0	0	0	0	112.6	Y173 A180 Q181	Y173-G177 WeakPolarHBondContact O-CA 3.48Å; Y173-G177 PolarHBondContact O-N 3.22Å; G177-A180 PolarHBondContact O-N 2.84Å; G177-Q181 PolarHBondContact O-N 2.93Å
178	A	47.2	Very low	47.1	Very low	44 Å²	44	102.1 Å²	102.1	36%	0.364	59%	0.594	S	S	.	*	H	α-helix	trans	-63.4	-45.1	174.9	0	0	0	0	0	111.5	A174 A180 Q181 D182	A174-A178 WeakPolarHBondContact O-CB 3.23Å; A174-A178 PolarHBondContact O-N 2.88Å; A178-A180 PolarHBondContact O-N 3.14Å; A178-Q181 PolarHBondContact O-N 2.96Å; A178-Q181 VanDerWaalsContact O-N 3.09Å; A178-D182 PolarHBondContact O-N 3.39Å; A178-D182 VanDerWaalsContact O-N 3.14Å
179	G	48.9	Very low	46.6	Very low	39 Å²	39	107.5 Å²	107.5	40%	0.402	61%	0.613	S	S	.	*	H	α-helix	trans	-61.6	-31.8	176.6	0	0	0	0	0	113.4	L175 V176 T183	L175-G179 PolarHBondContact O-N 2.84Å; V176-G179 PolarHBondContact O-N 3.28Å; G179-T183 PolarHBondContact O-N 3.41Å
180	A	52.2	Low	45.9	Very low	64 Å²	64	111.6 Å²	111.6	53%	0.529	64%	0.637	S	S	.	*	H	α-helix	trans	-75.1	-27.4	175.5	0	0	0	0	0	113.3	V176 G177 A178 T183	V176-A180 WeakPolarHBondContact O-CB 3.37Å; V176-A180 PolarHBondContact O-N 2.9Å; G177-A180 PolarHBondContact O-N 2.84Å; A178-A180 PolarHBondContact O-N 3.14Å; A180-T183 PolarHBondContact O-OG1 3.03Å; A180-T183 VanDerWaalsContact O-OG1 3.09Å
181	Q	46.4	Very low	45.1	Very low	161 Å²	161	110.8 Å²	110.8	75%	0.752	65%	0.648	S	S	*	*	H	α-helix	trans	-73.5	-35.3	173.4	-73.1	-175.2	-15.2	0	0	111.9	G177 A178 T183	G177-Q181 PolarHBondContact O-N 2.93Å; A178-Q181 PolarHBondContact O-N 2.96Å; A178-Q181 VanDerWaalsContact O-N 3.09Å; Q181-T183 VanDerWaalsContact C-N 3.27Å; Q181-T183 PolarHBondContact O-N 3.22Å
182	D	45.9	Very low	44.1	Very low	139 Å²	139	111.9 Å²	111.9	74%	0.743	66%	0.664	S	S	*	*	H	α-helix	trans	-74	-16.4	-179.8	-76.2	-16.7	0	0	0	113.5	A178 S184	A178-D182 PolarHBondContact O-N 3.39Å; A178-D182 VanDerWaalsContact O-N 3.14Å; D182-S184 PolarHBondContact O-N 2.85Å
183	T	43.9	Very low	43.5	Very low	106 Å²	106	116.4 Å²	116.4	65%	0.65	68%	0.682	S	S	*	*			trans	-79	72.9	171.3	57.6	0	0	0	0	110.7	G179 A180 Q181 A185	G179-T183 PolarHBondContact O-N 3.41Å; A180-T183 PolarHBondContact O-OG1 3.03Å; A180-T183 VanDerWaalsContact O-OG1 3.09Å; Q181-T183 VanDerWaalsContact C-N 3.27Å; Q181-T183 PolarHBondContact O-N 3.22Å; T183-A185 PolarHBondContact O-N 3.04Å
184	S	44.1	Very low	42.8	Very low	98 Å²	98	116.1 Å²	116.1	69%	0.685	69%	0.692	S	S	*	*			trans	-47.8	133.4	146.8	-64	0	0	0	0	107.7	D182 D186	D182-S184 PolarHBondContact O-N 2.85Å; S184-D186 PolarHBondContact O-N 2.92Å
185	A	42.7	Very low	41.8	Very low	101 Å²	101	122.5 Å²	122.5	84%	0.835	71%	0.712	S	S	*	*	S	Bend	trans	-63	30.9	-161.7	0	0	0	0	0	117.7	T183	T183-A185 PolarHBondContact O-N 3.04Å
186	D	36.6	Very low	40.5	Very low	139 Å²	139	122.6 Å²	122.6	74%	0.743	72%	0.724	S	S	*	*			trans	-125.5	72.3	-172.8	-67.1	-22.6	0	0	0	111.2	S184	S184-D186 PolarHBondContact O-N 2.92Å
187	N	33.8	Very low	39.4	Very low	164 Å²	164	122 Å²	122	88%	0.877	73%	0.725	S	S	*	*				178.8	101.2	129.5	-98.8	-56.4	0	0	0	112.6	N189	N187-N189 PolarHBondContact O-N 3.31Å
188	L	34.5	Very low	38.5	Very low	167 Å²	167	127.9 Å²	127.9	87%	0.874	74%	0.742	S	S	*	*			trans	-62.2	107.7	158	-64.9	158.9	0	0	0	109.8
189	N	34.4	Very low	38.2	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	76%	0.762	S	S	*	*			trans	171.5	80.2	140.4	-103.1	-29.6	0	0	0	110.1	N187	N187-N189 PolarHBondContact O-N 3.31Å
190	L	35	Very low	37.7	Very low	170 Å²	170	138.3 Å²	138.3	89%	0.89	78%	0.776	S	S	*	*			trans	-121.9	93.4	148.6	-160.4	63.2	0	0	0	107.7	S192	L190-S192 PolarHBondContact O-N 3.02Å
191	S	33	Very low	37.3	Very low	96 Å²	96	139 Å²	139	67%	0.671	78%	0.777	S	S	*	*			trans	-27.3	113	164.9	40.8	0	0	0	0	113.7	E193	S191-E193 PolarHBondContact O-N 2.98Å
192	S	30.2	Very low	37	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	78%	0.776	S	S	*	*	S	Bend		36.7	88	121.6	169.5	0	0	0	0	115.8	L190	L190-S192 PolarHBondContact O-N 3.02Å
193	E	37.7	Very low	36.8	Very low	188 Å²	188	139.3 Å²	139.3	88%	0.879	78%	0.775	S	S	*	*			trans	-169.5	7.1	138.7	-117.7	167.2	167.5	0	0	117.1	S191	S191-E193 PolarHBondContact O-N 2.98Å
194	L	35.6	Very low	36.9	Very low	178 Å²	178	139.4 Å²	139.4	93%	0.932	77%	0.771	S	S	*	*	S	Bend	trans	-103.9	106.2	173	-79.1	137.6	0	0	0	110.2	S196	L194-S196 PolarHBondContact O-N 2.92Å
195	E	30	Very low	37.1	Very low	186 Å²	186	141.6 Å²	141.6	87%	0.869	78%	0.775	S	S	*	*			trans	-42.9	123	178.8	-74.3	174.8	131.8	0	0	112.7	S197	E195-S197 PolarHBondContact O-N 3.49Å
196	S	29.4	Very low	37.3	Very low	127 Å²	127	142.5 Å²	142.5	89%	0.888	77%	0.766	S	S	*	*			trans	-43.8	96.5	165.9	-179.4	0	0	0	0	112	L194	L194-S196 PolarHBondContact O-N 2.92Å
197	S	33.1	Very low	38	Very low	93 Å²	93	140.1 Å²	140.1	65%	0.65	76%	0.758	S	S	*	*			trans	-134.6	89	158.7	57	0	0	0	0	108.7	E195 I199	E195-S197 PolarHBondContact O-N 3.49Å; S197-I199 VanDerWaalsContact C-N 3.28Å; S197-I199 PolarHBondContact O-N 3.45Å
198	H	34.1	Very low	38.9	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.736	74%	0.739	S	S	*	*			trans	41.5	44.2	150.2	-82.2	-76.9	0	0	0	117.2	E200	H198-E200 IonicContact CE1-OE1 2.82Å; H198-E200 PolarHBondContact CE1-OE1 2.99Å; H198-E200 IonicContact ND1-OE1 2.61Å; H198-E200 PolarHBondContact ND1-OE1 3.34Å; H198-E200 PolarHBondContact O-N 2.66Å
199	I	40.6	Very low	40.1	Very low	153 Å²	153	134.3 Å²	134.3	79%	0.785	73%	0.725	S	S	*	*			trans	-78.3	66	150.3	-49.7	176.7	0	0	0	105.3	S197 S201	S197-I199 VanDerWaalsContact C-N 3.28Å; S197-I199 PolarHBondContact O-N 3.45Å; I199-S201 PolarHBondContact O-N 3.26Å
200	E	37.9	Very low	41.8	Very low	149 Å²	149	127.9 Å²	127.9	70%	0.696	69%	0.693	S	S	*	*			trans	-63.4	75.8	141.5	-74.4	169.2	-151.4	0	0	103.9	H198 K202	H198-E200 IonicContact CE1-OE1 2.82Å; H198-E200 PolarHBondContact CE1-OE1 2.99Å; H198-E200 IonicContact ND1-OE1 2.61Å; H198-E200 PolarHBondContact ND1-OE1 3.34Å; H198-E200 PolarHBondContact O-N 2.66Å; E200-K202 PolarHBondContact O-N 2.97Å
201	S	44	Very low	43.6	Very low	79 Å²	79	125.8 Å²	125.8	55%	0.552	68%	0.682	S	S	*	*			trans	-53.1	108.7	152.8	47.7	0	0	0	0	101.8	I199 L203	I199-S201 PolarHBondContact O-N 3.26Å; S201-L203 PolarHBondContact O-N 3.19Å
202	K	39.9	Very low	45.6	Very low	170 Å²	170	125.2 Å²	125.2	74%	0.739	68%	0.676	S	S	*	*			trans	-53	99.7	155.4	-73.3	177	174.2	-179.4	0	102.1	E200 D204	E200-K202 PolarHBondContact O-N 2.97Å; K202-D204 VanDerWaalsContact CB-OD1 3.31Å; K202-D204 WeakPolarHBondContact CB-OD1 3.49Å; K202-D204 PolarHBondContact O-N 2.67Å
203	L	42.5	Very low	48	Very low	136 Å²	136	120.4 Å²	120.4	71%	0.712	64%	0.642	S	S	*	*			trans	-51.2	94.9	138.1	-89.7	97.9	0	0	0	101.3	S201 N205	S201-L203 PolarHBondContact O-N 3.19Å; L203-N205 PolarHBondContact O-N 3.14Å
204	D	45.4	Very low	50.2	Low	108 Å²	108	115.2 Å²	115.2	58%	0.578	62%	0.621	S	S	*	*			trans	-64.9	75.9	167.5	-79.8	-31.8	0	0	0	103.2	K202 L206	K202-D204 VanDerWaalsContact CB-OD1 3.31Å; K202-D204 WeakPolarHBondContact CB-OD1 3.49Å; K202-D204 PolarHBondContact O-N 2.67Å; D204-L206 HydrophobicContact CB-CD1 3.82Å; D204-L206 HydrophobicContact CB-CG 4.13Å; D204-L206 PolarHBondContact O-N 3.49Å
205	N	47.8	Very low	52.6	Low	143 Å²	143	107.9 Å²	107.9	77%	0.765	58%	0.583	S	S	*	*			trans	-66.8	47.6	155	-90.4	-4.3	0	0	0	106.8	L203	L203-N205 PolarHBondContact O-N 3.14Å
206	L	48	Very low	55.2	Low	121 Å²	121	100.4 Å²	100.4	63%	0.634	55%	0.552	S	S	*	*			trans	-47.8	129.2	149	-74.8	155.8	0	0	0	104	D204 A208	D204-L206 HydrophobicContact CB-CD1 3.82Å; D204-L206 HydrophobicContact CB-CG 4.13Å; D204-L206 PolarHBondContact O-N 3.49Å; L206-A208 VanDerWaalsContact C-N 3.35Å; L206-A208 PolarHBondContact O-N 2.98Å
207	P	51.1	Low	57.7	Low	89 Å²	89	97.5 Å²	97.5	58%	0.578	53%	0.53	S	S	*	.			trans	-51.5	109.9	172.9	19.9	-29.4	0	0	0	106.2	Y209	P207-Y209 PolarHBondContact O-N 3.3Å
208	A	52.9	Low	60	Low	58 Å²	58	100.6 Å²	100.6	48%	0.479	54%	0.538	S	S	.	.			trans	-61.6	115.1	-171.9	0	0	0	0	0	106.1	L206 C210 C253	L206-A208 VanDerWaalsContact C-N 3.35Å; L206-A208 PolarHBondContact O-N 2.98Å; A208-C210 PolarHBondContact O-N 3.06Å; A208-C253 WeakPolarHBondContact O-CB 3.43Å
209	Y	59.4	Low	62.1	Low	151 Å²	151	101.1 Å²	101.1	59%	0.592	55%	0.546	S	S	*	.			trans	-53.2	139.1	156.6	-67.7	-84.3	0	0	0	106.1	P207 D211 D256	P207-Y209 PolarHBondContact O-N 3.3Å; Y209-D211 PolarHBondContact O-N 2.77Å; Y209-D256 HydrophobicContact CE1-CB 3.96Å; Y209-D256 WeakPolarHBondContact CE1-OD2 3.33Å
210	C	70.9	Confident	63.9	Low	22 Å²	22	100.2 Å²	100.2	15%	0.149	53%	0.534	C	S	.	.			trans	-54.5	119.5	-178.6	-40.7	0	0	0	0	108.4	A208 P212 W243 I244 K247 M248 C253	A208-C210 PolarHBondContact O-N 3.06Å; C210-P212 WeakPolarHBondContact O-CD 3.43Å; C210-W243 HydrophobicContact CB-CZ3 4.24Å; C210-I244 HydrophobicContact CB-CG2 4.39Å; C210-K247 HydrophobicContact CB-CB 4.5Å; C210-M248 WeakPolarHBondContact SG-CG 3.48Å; C210-C253 HydrophobicContact CB-CB 3.85Å; C210-C253 WeakPolarHBondContact CB-SG 3.39Å; C210-C253 WeakPolarHBondContact SG-CB 3.41Å; C210-C253 CovalentContact SG-SG 2.03Å; C210-C253 PolarHBondContact SG-SG 2.9Å
211	D	72.6	Confident	65.9	Low	126 Å²	126	99.9 Å²	99.9	67%	0.674	53%	0.53	S	S	*	.			trans	-64.5	105.5	178.2	-69.8	-37.8	0	0	0	108.2	Y209 W243	Y209-D211 PolarHBondContact O-N 2.77Å; D211-W243 WeakPolarHBondContact O-CH2 3.31Å; D211-W243 WeakPolarHBondContact O-CZ3 3.4Å
212	P	74	Confident	67.6	Low	84 Å²	84	97 Å²	97	55%	0.545	51%	0.51	S	S	.	.			trans	-63.4	148.2	-175.1	28	-33.3	0	0	0	110	C210	C210-P212 WeakPolarHBondContact O-CD 3.43Å
213	P	80.8	Confident	69.5	Low	9 Å²	9	95.9 Å²	95.9	6%	0.058	51%	0.512	C	S	.	.			trans	-59.8	143.3	176.8	27	-33.9	0	0	0	109.9	P215 D230 I233 F239 N240 W243	P213-P215 WeakPolarHBondContact O-CD 3.43Å; P213-D230 WeakPolarHBondContact CA-OD2 3.42Å; P213-I233 HydrophobicContact CB-CD1 3.55Å; P213-I233 HydrophobicContact CB-CG2 4.16Å; P213-I233 HydrophobicContact CG-CG2 4.46Å; P213-F239 HydrophobicContact CG-CD1 4.44Å; P213-F239 HydrophobicContact CG-CE1 4.01Å; P213-N240 WeakPolarHBondContact CG-OD1 3.47Å; P213-W243 HydrophobicContact CG-CD2 4.09Å; P213-W243 HydrophobicContact CG-CE3 4.49Å; P213-W243 HydrophobicContact CG-CG 4.09Å
214	N	84.6	Confident	71.3	Confident	79 Å²	79	94.7 Å²	94.7	42%	0.422	51%	0.506	S	S	.	.			trans	-109.5	83.3	-177.5	178.9	30.1	0	0	0	109.8	C229 D230	N214-C229 CarbonylContact O-C 3.56Å; N214-C229 WeakPolarHBondContact O-CA 3.27Å; N214-C229 WeakPolarHBondContact O-CB 3.49Å; N214-D230 PolarHBondContact N-OD2 2.85Å; N214-D230 PolarHBondContact O-N 3.03Å
215	P	86	Confident	72.6	Confident	23 Å²	23	91.9 Å²	91.9	15%	0.149	49%	0.491	C	S	.	.	B	Isolated β-bridge	trans	-63.9	141.7	-175.5	26.6	-34.4	0	0	0	111.9	P213 I233 D235	P213-P215 WeakPolarHBondContact O-CD 3.43Å; P215-I233 HydrophobicContact CB-CB 4.44Å; P215-I233 HydrophobicContact CB-CG2 4.38Å; P215-D235 HydrophobicContact CB-CB 4.09Å; P215-D235 HydrophobicContact CG-CB 3.85Å
216	C	83.8	Confident	74	Confident	30 Å²	30	91.3 Å²	91.3	20%	0.203	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-64.8	138.3	175.1	-64.7	0	0	0	0	111.9	C229 D230	C216-C229 WeakPolarHBondContact CA-SG 3.19Å; C216-C229 HydrophobicContact CB-CB 3.93Å; C216-C229 WeakPolarHBondContact CB-SG 3.26Å; C216-C229 VanDerWaalsContact SG-C 3.55Å; C216-C229 WeakPolarHBondContact SG-CB 3.48Å; C216-C229 CovalentContact SG-SG 2.03Å; C216-C229 PolarHBondContact SG-SG 3.15Å; C216-D230 PolarHBondContact N-O 3.44Å; C216-D230 PolarHBondContact SG-O 2.98Å
217	P	82.9	Confident	75.2	Confident	66 Å²	66	90.1 Å²	90.1	43%	0.429	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-54.8	152.6	169.9	-21.3	30.3	0	0	0	112.2	N219 Y220 L225	P217-N219 PolarHBondContact O-N 2.93Å; P217-Y220 HydrophobicContact CB-CD2 3.85Å; P217-Y220 HydrophobicContact CB-CG 4.3Å; P217-Y220 PolarHBondContact O-N 2.99Å; P217-L225 HydrophobicContact CG-CD1 4.13Å
218	L	80.5	Confident	76.6	Confident	158 Å²	158	90.5 Å²	90.5	83%	0.827	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	126.9	178.1	-65.8	173.8	0	0	0	111.1	Y220	L218-Y220 VanDerWaalsContact C-N 3.26Å; L218-Y220 WeakPolarHBondContact O-CD2 3.43Å; L218-Y220 PolarHBondContact O-N 3.29Å
219	N	79.3	Confident	78.1	Confident	170 Å²	170	88.1 Å²	88.1	91%	0.909	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	8.5	-178.7	-49.1	-46.6	0	0	0	116.3	P217	P217-N219 PolarHBondContact O-N 2.93Å
220	Y	76.8	Confident	79.2	Confident	134 Å²	134	84.2 Å²	84.2	53%	0.525	47%	0.465	S	S	.	.			trans	-101.1	140.3	171.9	-74.3	-97.6	0	0	0	110.8	P217 L218 L225	P217-Y220 HydrophobicContact CB-CD2 3.85Å; P217-Y220 HydrophobicContact CB-CG 4.3Å; P217-Y220 PolarHBondContact O-N 2.99Å; L218-Y220 VanDerWaalsContact C-N 3.26Å; L218-Y220 WeakPolarHBondContact O-CD2 3.43Å; L218-Y220 PolarHBondContact O-N 3.29Å; Y220-L225 HydrophobicContact CD1-CD2 4.05Å; Y220-L225 HydrophobicContact CD1-CG 4.27Å
221	K	79.9	Confident	79.7	Confident	141 Å²	141	88.4 Å²	88.4	61%	0.613	48%	0.482	S	S	*	.			trans	-95.9	153.3	168.5	-61.3	-176	178.2	-179.4	0	109.6	N223 D224	K221-N223 PolarHBondContact O-N 3.42Å; K221-N223 VanDerWaalsContact O-N 3.1Å; K221-D224 WeakPolarHBondContact CB-OD2 3.46Å; K221-D224 PolarHBondContact N-OD2 2.84Å; K221-D224 PolarHBondContact O-N 3.05Å
222	S	79.9	Confident	80.1	Confident	18 Å²	18	90.6 Å²	90.6	13%	0.126	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-51	-36.4	176.4	-162.7	0	0	0	0	113	D224 L225 P228 C229	S222-D224 VanDerWaalsContact C-N 3.31Å; S222-D224 PolarHBondContact O-N 3.45Å; S222-L225 PolarHBondContact O-N 3.48Å; S222-P228 WeakPolarHBondContact OG-CA 2.87Å; S222-C229 VanDerWaalsContact CA-SG 3.54Å; S222-C229 VanDerWaalsContact CB-O 3.3Å; S222-C229 WeakPolarHBondContact CB-O 3.48Å; S222-C229 PolarHBondContact OG-N 3.5Å; S222-C229 VanDerWaalsContact OG-N 3.12Å; S222-C229 PolarHBondContact OG-O 3Å
223	N	81.1	Confident	80.6	Confident	148 Å²	148	88.6 Å²	88.6	79%	0.791	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-72.5	-20.1	-179.8	-61.1	4.1	0	0	0	114.4	K221 L225	K221-N223 PolarHBondContact O-N 3.42Å; K221-N223 VanDerWaalsContact O-N 3.1Å; N223-L225 VanDerWaalsContact C-N 3.32Å
224	D	79.3	Confident	80.7	Confident	110 Å²	110	94.3 Å²	94.3	59%	0.588	50%	0.504	S	S	*	.	G	3₁₀ helix	trans	-85.9	-12.4	-178.7	-57.3	-36.5	0	0	0	111.5	K221 S222	K221-D224 WeakPolarHBondContact CB-OD2 3.46Å; K221-D224 PolarHBondContact N-OD2 2.84Å; K221-D224 PolarHBondContact O-N 3.05Å; S222-D224 VanDerWaalsContact C-N 3.31Å; S222-D224 PolarHBondContact O-N 3.45Å
225	L	73.3	Confident	80.6	Confident	49 Å²	49	96.7 Å²	96.7	26%	0.257	52%	0.517	S	S	.	.	S	Bend	trans	-103.3	143.6	-175.4	-70.8	162.9	0	0	0	111.1	P217 Y220 S222 N223 T227 C229	P217-L225 HydrophobicContact CG-CD1 4.13Å; Y220-L225 HydrophobicContact CD1-CD2 4.05Å; Y220-L225 HydrophobicContact CD1-CG 4.27Å; S222-L225 PolarHBondContact O-N 3.48Å; N223-L225 VanDerWaalsContact C-N 3.32Å; L225-T227 PolarHBondContact O-N 3.48Å; L225-C229 HydrophobicContact CD1-CB 4.41Å; L225-C229 VanDerWaalsContact CD1-SG 3.51Å
226	P	76.4	Confident	80.5	Confident	132 Å²	132	98 Å²	98	86%	0.857	53%	0.525	S	S	*	.	S	Bend	trans	-61.4	-27.8	177.4	-22.2	32.1	0	0	0	113.7
227	T	74	Confident	80.4	Confident	95 Å²	95	103.3 Å²	103.3	58%	0.583	55%	0.549	S	S	*	.	S	Bend	trans	-114.1	127.9	176.6	-52.1	0	0	0	0	108	L225 C229	L225-T227 PolarHBondContact O-N 3.48Å; T227-C229 PolarHBondContact O-N 3.36Å
228	P	80.4	Confident	80.4	Confident	98 Å²	98	106 Å²	106	64%	0.636	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-61.6	123.2	178.4	24.8	-32.3	0	0	0	109.4	S222	S222-P228 WeakPolarHBondContact OG-CA 2.87Å
229	C	84.1	Confident	80.8	Confident	7 Å²	7	101.4 Å²	101.4	5%	0.047	53%	0.53	C	S	.	.	P	Polyproline II helix	trans	-97.4	156.2	169.2	57.5	0	0	0	0	110	N214 C216 S222 L225 T227	N214-C229 CarbonylContact O-C 3.56Å; N214-C229 WeakPolarHBondContact O-CA 3.27Å; N214-C229 WeakPolarHBondContact O-CB 3.49Å; C216-C229 WeakPolarHBondContact CA-SG 3.19Å; C216-C229 HydrophobicContact CB-CB 3.93Å; C216-C229 WeakPolarHBondContact CB-SG 3.26Å; C216-C229 VanDerWaalsContact SG-C 3.55Å; C216-C229 WeakPolarHBondContact SG-CB 3.48Å; C216-C229 CovalentContact SG-SG 2.03Å; C216-C229 PolarHBondContact SG-SG 3.15Å; S222-C229 VanDerWaalsContact CA-SG 3.54Å; S222-C229 VanDerWaalsContact CB-O 3.3Å; S222-C229 WeakPolarHBondContact CB-O 3.48Å; S222-C229 PolarHBondContact OG-N 3.5Å; S222-C229 VanDerWaalsContact OG-N 3.12Å; S222-C229 PolarHBondContact OG-O 3Å; L225-C229 HydrophobicContact CD1-CB 4.41Å; L225-C229 VanDerWaalsContact CD1-SG 3.51Å; T227-C229 PolarHBondContact O-N 3.36Å
230	D	83.3	Confident	80.9	Confident	70 Å²	70	95.1 Å²	95.1	37%	0.374	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-78.1	121.9	177.7	-63.1	-45.4	0	0	0	110.5	P213 N214 C216 I233	P213-D230 WeakPolarHBondContact CA-OD2 3.42Å; N214-D230 PolarHBondContact N-OD2 2.85Å; N214-D230 PolarHBondContact O-N 3.03Å; C216-D230 PolarHBondContact N-O 3.44Å; C216-D230 PolarHBondContact SG-O 2.98Å; D230-I233 HydrophobicContact CB-CB 4.48Å; D230-I233 HydrophobicContact CB-CD1 3.32Å; D230-I233 HydrophobicContact CB-CG1 3.87Å
231	Q	81.2	Confident	81.1	Confident	110 Å²	110	94.9 Å²	94.9	51%	0.514	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	151.2	175	-63.3	-179.8	3.2	0	0	110.4	I233	Q231-I233 PolarHBondContact O-N 2.62Å
232	D	80.8	Confident	81.2	Confident	171 Å²	171	93.7 Å²	93.7	91%	0.914	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	24.7	175.2	-54.6	-35.9	0	0	0	115.5
233	I	83.9	Confident	81.5	Confident	43 Å²	43	95 Å²	95	22%	0.221	49%	0.493	C	S	.	.			trans	-99.3	131.1	171.2	-62.1	-166.8	0	0	0	110.3	P213 P215 D230 Q231 D235 F239	P213-I233 HydrophobicContact CB-CD1 3.55Å; P213-I233 HydrophobicContact CB-CG2 4.16Å; P213-I233 HydrophobicContact CG-CG2 4.46Å; P215-I233 HydrophobicContact CB-CB 4.44Å; P215-I233 HydrophobicContact CB-CG2 4.38Å; D230-I233 HydrophobicContact CB-CB 4.48Å; D230-I233 HydrophobicContact CB-CD1 3.32Å; D230-I233 HydrophobicContact CB-CG1 3.87Å; Q231-I233 PolarHBondContact O-N 2.62Å; I233-D235 PolarHBondContact O-N 2.91Å; I233-F239 HydrophobicContact CB-CE1 4.48Å; I233-F239 HydrophobicContact CG2-CD1 3.75Å; I233-F239 HydrophobicContact CG2-CE1 3.27Å; I233-F239 HydrophobicContact CG2-CZ 3.84Å
234	E	83.3	Confident	81.5	Confident	128 Å²	128	89.7 Å²	89.7	60%	0.598	46%	0.464	S	S	*	.			trans	-72.5	120.3	174.3	-66.2	-175.9	174.7	0	0	110.7	T236 F239	E234-T236 HydrophobicContact CB-CG2 4.41Å; E234-T236 PolarHBondContact O-N 3.45Å; E234-F239 HydrophobicContact CB-CB 4.39Å; E234-F239 HydrophobicContact CB-CG 4.42Å
235	D	82.6	Confident	81.5	Confident	129 Å²	129	85.8 Å²	85.8	69%	0.69	44%	0.443	S	S	*	.			trans	-76.4	68	172.7	-170.3	20.2	0	0	0	110.8	P215 I233	P215-D235 HydrophobicContact CB-CB 4.09Å; P215-D235 HydrophobicContact CG-CB 3.85Å; I233-D235 PolarHBondContact O-N 2.91Å
236	T	84.5	Confident	82	Confident	52 Å²	52	90 Å²	90	32%	0.319	46%	0.456	S	S	.	.			trans	-125.5	146.3	175.8	65.7	0	0	0	0	111.3	E234 E238 F239 N240	E234-T236 HydrophobicContact CB-CG2 4.41Å; E234-T236 PolarHBondContact O-N 3.45Å; T236-E238 PolarHBondContact O-N 3.46Å; T236-F239 PolarHBondContact O-N 3.06Å; T236-F239 WeakPolarHBondContact OG1-CB 3.31Å; T236-F239 PolarHBondContact OG1-N 3.43Å; T236-F239 VanDerWaalsContact OG1-N 3.17Å; T236-N240 PolarHBondContact O-N 3.18Å; T236-N240 VanDerWaalsContact O-N 3.1Å
237	I	80.6	Confident	82.3	Confident	140 Å²	140	86.4 Å²	86.4	72%	0.718	43%	0.426	S	S	*	.	H	α-helix	trans	-62	-38.2	178.6	-62.3	170.9	0	0	0	109.8	R241	I237-R241 WeakPolarHBondContact O-CB 3.46Å; I237-R241 PolarHBondContact O-N 2.94Å
238	E	84.1	Confident	82.5	Confident	124 Å²	124	82.4 Å²	82.4	58%	0.579	40%	0.401	S	S	*	.	H	α-helix	trans	-62.7	-47.6	178	-64.9	73.1	-162.4	0	0	110.9	T236 R241 H242	T236-E238 PolarHBondContact O-N 3.46Å; E238-R241 PolarHBondContact O-N 3.44Å; E238-H242 PolarHBondContact O-N 3.09Å; E238-H242 PolarHBondContact O-ND1 3Å
239	F	87.5	Confident	82.4	Confident	60 Å²	60	81 Å²	81	26%	0.263	39%	0.386	S	S	.	.	H	α-helix	trans	-59.5	-51.2	177.4	179.7	-88.7	0	0	0	111	P213 I233 E234 T236 R241 H242 W243	P213-F239 HydrophobicContact CG-CD1 4.44Å; P213-F239 HydrophobicContact CG-CE1 4.01Å; I233-F239 HydrophobicContact CB-CE1 4.48Å; I233-F239 HydrophobicContact CG2-CD1 3.75Å; I233-F239 HydrophobicContact CG2-CE1 3.27Å; I233-F239 HydrophobicContact CG2-CZ 3.84Å; E234-F239 HydrophobicContact CB-CB 4.39Å; E234-F239 HydrophobicContact CB-CG 4.42Å; T236-F239 PolarHBondContact O-N 3.06Å; T236-F239 WeakPolarHBondContact OG1-CB 3.31Å; T236-F239 PolarHBondContact OG1-N 3.43Å; T236-F239 VanDerWaalsContact OG1-N 3.17Å; F239-R241 VanDerWaalsContact C-N 3.3Å; F239-R241 PolarHBondContact O-N 3.01Å; F239-H242 PolarHBondContact O-N 3Å; F239-H242 VanDerWaalsContact O-N 3.15Å; F239-W243 HydrophobicContact CD1-CB 4.5Å; F239-W243 HydrophobicContact CE1-CB 4.19Å; F239-W243 AromaticContact CE1-CD1 3.88Å; F239-W243 HydrophobicContact CE1-CG 4.3Å; F239-W243 AromaticContact CZ-CD1 3.98Å; F239-W243 WeakPolarHBondContact O-CB 3.25Å; F239-W243 PolarHBondContact O-N 3.16Å
240	N	83	Confident	82.2	Confident	39 Å²	39	85.6 Å²	85.6	21%	0.209	41%	0.41	C	S	.	.	H	α-helix	trans	-58.3	-42.7	-179.6	-72.6	-12.6	0	0	0	111.7	P213 T236 W243 I244	P213-N240 WeakPolarHBondContact CG-OD1 3.47Å; T236-N240 PolarHBondContact O-N 3.18Å; T236-N240 VanDerWaalsContact O-N 3.1Å; N240-W243 PolarHBondContact O-N 2.92Å; N240-I244 VanDerWaalsContact O-CG1 3.27Å; N240-I244 WeakPolarHBondContact O-CG1 3.28Å; N240-I244 PolarHBondContact O-N 3.26Å
241	R	79.5	Confident	81.9	Confident	129 Å²	129	85 Å²	85	49%	0.487	42%	0.42	S	S	.	.	H	α-helix	trans	-60.9	-47.3	176.2	-173.2	-179.3	-176.1	-179	5.1	112.2	I237 E238 F239 I245	I237-R241 WeakPolarHBondContact O-CB 3.46Å; I237-R241 PolarHBondContact O-N 2.94Å; E238-R241 PolarHBondContact O-N 3.44Å; F239-R241 VanDerWaalsContact C-N 3.3Å; F239-R241 PolarHBondContact O-N 3.01Å; R241-I245 HydrophobicContact CG-CD1 4.08Å; R241-I245 WeakPolarHBondContact O-CD1 3.1Å; R241-I245 VanDerWaalsContact O-CG1 3.29Å; R241-I245 WeakPolarHBondContact O-CG1 3.43Å; R241-I245 PolarHBondContact O-N 3.2Å; R241-I245 VanDerWaalsContact O-N 3.15Å
242	H	82.9	Confident	81.8	Confident	116 Å²	116	84.8 Å²	84.8	54%	0.537	42%	0.419	S	S	.	.	H	α-helix	trans	-68.2	-36.8	179.5	-72.9	92.2	0	0	0	112.3	E238 F239 R246	E238-H242 PolarHBondContact O-N 3.09Å; E238-H242 PolarHBondContact O-ND1 3Å; F239-H242 PolarHBondContact O-N 3Å; F239-H242 VanDerWaalsContact O-N 3.15Å; H242-R246 WeakPolarHBondContact O-CB 3.4Å; H242-R246 PolarHBondContact O-N 3.48Å
243	W	85.7	Confident	81.7	Confident	46 Å²	46	77.3 Å²	77.3	17%	0.174	38%	0.381	C	S	.	.	H	α-helix	trans	-61.8	-49.8	177.6	-172.2	103.9	0	0	0	111.1	C210 D211 P213 F239 N240 I245 R246 K247	C210-W243 HydrophobicContact CB-CZ3 4.24Å; D211-W243 WeakPolarHBondContact O-CH2 3.31Å; D211-W243 WeakPolarHBondContact O-CZ3 3.4Å; P213-W243 HydrophobicContact CG-CD2 4.09Å; P213-W243 HydrophobicContact CG-CE3 4.49Å; P213-W243 HydrophobicContact CG-CG 4.09Å; F239-W243 HydrophobicContact CD1-CB 4.5Å; F239-W243 HydrophobicContact CE1-CB 4.19Å; F239-W243 AromaticContact CE1-CD1 3.88Å; F239-W243 HydrophobicContact CE1-CG 4.3Å; F239-W243 AromaticContact CZ-CD1 3.98Å; F239-W243 WeakPolarHBondContact O-CB 3.25Å; F239-W243 PolarHBondContact O-N 3.16Å; N240-W243 PolarHBondContact O-N 2.92Å; W243-I245 PolarHBondContact O-N 3.29Å; W243-R246 WeakPolarHBondContact O-CB 3.32Å; W243-R246 PolarHBondContact O-N 3.07Å; W243-K247 HydrophobicContact CD2-CG 4.04Å; W243-K247 HydrophobicContact CE3-CG 3.8Å; W243-K247 HydrophobicContact CH2-CD 4.05Å; W243-K247 VanDerWaalsContact CH2-CE 3.41Å; W243-K247 HydrophobicContact CH2-CG 3.61Å; W243-K247 HydrophobicContact CZ2-CD 4.13Å; W243-K247 HydrophobicContact CZ2-CG 3.92Å; W243-K247 HydrophobicContact CZ3-CB 4.42Å; W243-K247 HydrophobicContact CZ3-CG 3.58Å; W243-K247 PolarHBondContact O-N 3.18Å
244	I	82	Confident	81.3	Confident	35 Å²	35	78.5 Å²	78.5	18%	0.179	39%	0.393	C	S	.	.	H	α-helix	trans	-59.7	-48.6	178.3	-69.5	168	0	0	0	110.2	C210 N240 R246 K247 M248	C210-I244 HydrophobicContact CB-CG2 4.39Å; N240-I244 VanDerWaalsContact O-CG1 3.27Å; N240-I244 WeakPolarHBondContact O-CG1 3.28Å; N240-I244 PolarHBondContact O-N 3.26Å; I244-R246 VanDerWaalsContact C-N 3.29Å; I244-R246 PolarHBondContact O-N 2.87Å; I244-K247 PolarHBondContact O-N 3.37Å; I244-M248 HydrophobicContact CG2-SD 3.54Å; I244-M248 VanDerWaalsContact CG2-SD 3.54Å; I244-M248 WeakPolarHBondContact O-CG 3.39Å; I244-M248 PolarHBondContact O-N 2.94Å; I244-M248 VanDerWaalsContact O-SD 3.39Å
245	I	78.6	Confident	80.9	Confident	29 Å²	29	73.7 Å²	73.7	15%	0.149	37%	0.373	C	S	.	.	H	α-helix	trans	-59.6	-39.6	178	-70.3	168.8	0	0	0	111.9	R241 W243 M248 Q249 F287	R241-I245 HydrophobicContact CG-CD1 4.08Å; R241-I245 WeakPolarHBondContact O-CD1 3.1Å; R241-I245 VanDerWaalsContact O-CG1 3.29Å; R241-I245 WeakPolarHBondContact O-CG1 3.43Å; R241-I245 PolarHBondContact O-N 3.2Å; R241-I245 VanDerWaalsContact O-N 3.15Å; W243-I245 PolarHBondContact O-N 3.29Å; I245-M248 PolarHBondContact O-N 2.94Å; I245-Q249 WeakPolarHBondContact O-CG 3.41Å; I245-Q249 PolarHBondContact O-N 3.49Å; I245-F287 HydrophobicContact CD1-CE1 4.37Å; I245-F287 HydrophobicContact CG2-CE1 3.7Å; I245-F287 HydrophobicContact CG2-CZ 3.77Å
246	R	82.6	Confident	80.5	Confident	138 Å²	138	68.8 Å²	68.8	52%	0.521	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-46.9	177.9	-177.4	-170.5	-67.9	137.2	-3	111.1	H242 W243 I244 M248 Q249 N250	H242-R246 WeakPolarHBondContact O-CB 3.4Å; H242-R246 PolarHBondContact O-N 3.48Å; W243-R246 WeakPolarHBondContact O-CB 3.32Å; W243-R246 PolarHBondContact O-N 3.07Å; I244-R246 VanDerWaalsContact C-N 3.29Å; I244-R246 PolarHBondContact O-N 2.87Å; R246-M248 VanDerWaalsContact C-N 3.28Å; R246-M248 PolarHBondContact O-N 2.72Å; R246-Q249 PolarHBondContact O-N 3.01Å; R246-Q249 VanDerWaalsContact O-N 3.15Å; R246-N250 PolarHBondContact O-N 2.89Å; R246-N250 PolarHBondContact O-OD1 3.44Å
247	K	82.7	Confident	79.8	Confident	55 Å²	55	70.4 Å²	70.4	24%	0.239	35%	0.353	C	S	.	.	H	α-helix	trans	-59.1	-40.7	177.3	-73.7	-69.6	-162.8	176.3	0	112.1	C210 W243 I244 Q249 N250 G251 E252	C210-K247 HydrophobicContact CB-CB 4.5Å; W243-K247 HydrophobicContact CD2-CG 4.04Å; W243-K247 HydrophobicContact CE3-CG 3.8Å; W243-K247 HydrophobicContact CH2-CD 4.05Å; W243-K247 VanDerWaalsContact CH2-CE 3.41Å; W243-K247 HydrophobicContact CH2-CG 3.61Å; W243-K247 HydrophobicContact CZ2-CD 4.13Å; W243-K247 HydrophobicContact CZ2-CG 3.92Å; W243-K247 HydrophobicContact CZ3-CB 4.42Å; W243-K247 HydrophobicContact CZ3-CG 3.58Å; W243-K247 PolarHBondContact O-N 3.18Å; I244-K247 PolarHBondContact O-N 3.37Å; K247-Q249 PolarHBondContact O-N 2.82Å; K247-N250 PolarHBondContact O-N 3.01Å; K247-G251 PolarHBondContact O-N 3.15Å; K247-E252 HydrophobicContact CD-CB 4.26Å; K247-E252 HydrophobicContact CD-CG 4.39Å; K247-E252 WeakPolarHBondContact CD-OE1 3.39Å; K247-E252 WeakPolarHBondContact CD-OE2 3.43Å; K247-E252 WeakPolarHBondContact CE-OE2 3.31Å; K247-E252 IonicContact NZ-OE1 3.53Å; K247-E252 IonicContact NZ-OE2 3.02Å; K247-E252 PolarHBondContact NZ-OE2 3.03Å; K247-E252 PolarHBondContact O-N 3.06Å; K247-E252 VanDerWaalsContact O-N 3.09Å
248	M	78.9	Confident	79.2	Confident	12 Å²	12	69 Å²	69	6%	0.059	34%	0.344	C	S	.	.	H	α-helix	trans	-64.7	-40.1	175.9	-64.7	158	54.2	0	0	112.1	C210 I244 I245 R246 N250 G251 C253 C255 P264	C210-M248 WeakPolarHBondContact SG-CG 3.48Å; I244-M248 HydrophobicContact CG2-SD 3.54Å; I244-M248 VanDerWaalsContact CG2-SD 3.54Å; I244-M248 WeakPolarHBondContact O-CG 3.39Å; I244-M248 PolarHBondContact O-N 2.94Å; I244-M248 VanDerWaalsContact O-SD 3.39Å; I245-M248 PolarHBondContact O-N 2.94Å; R246-M248 VanDerWaalsContact C-N 3.28Å; R246-M248 PolarHBondContact O-N 2.72Å; M248-N250 VanDerWaalsContact C-N 3.31Å; M248-N250 PolarHBondContact O-N 3.47Å; M248-G251 PolarHBondContact O-N 3.41Å; M248-G251 VanDerWaalsContact O-N 3.14Å; M248-C253 VanDerWaalsContact CG-SG 3.51Å; M248-C255 HydrophobicContact CE-CB 3.34Å; M248-C255 WeakPolarHBondContact CE-SG 3.34Å; M248-P264 HydrophobicContact CB-CG 4.25Å; M248-P264 HydrophobicContact CE-CG 4.37Å
249	Q	78	Confident	78.6	Confident	69 Å²	69	68.7 Å²	68.7	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-67.4	-31.6	176.1	-74.1	171.9	9.3	0	0	113.2	I245 R246 K247 G251 P264	I245-Q249 WeakPolarHBondContact O-CG 3.41Å; I245-Q249 PolarHBondContact O-N 3.49Å; R246-Q249 PolarHBondContact O-N 3.01Å; R246-Q249 VanDerWaalsContact O-N 3.15Å; K247-Q249 PolarHBondContact O-N 2.82Å; Q249-G251 PolarHBondContact O-N 3.46Å; Q249-P264 HydrophobicContact CG-CB 3.71Å; Q249-P264 HydrophobicContact CG-CG 3.88Å
250	N	81.2	Confident	77.9	Confident	102 Å²	102	69 Å²	69	55%	0.545	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-7.6	174.7	-68.3	-7.1	0	0	0	112.7	R246 K247 M248 E252	R246-N250 PolarHBondContact O-N 2.89Å; R246-N250 PolarHBondContact O-OD1 3.44Å; K247-N250 PolarHBondContact O-N 3.01Å; M248-N250 VanDerWaalsContact C-N 3.31Å; M248-N250 PolarHBondContact O-N 3.47Å; N250-E252 VanDerWaalsContact C-N 3.26Å; N250-E252 HydrophobicContact CB-CG 3.9Å; N250-E252 WeakPolarHBondContact CB-OE1 3.36Å; N250-E252 PolarHBondContact ND2-OE1 3.03Å; N250-E252 PolarHBondContact O-N 3Å
251	G	77.2	Confident	77.4	Confident	57 Å²	57	71.6 Å²	71.6	59%	0.588	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	15.7	-175.2	0	0	0	0	0	113.6	K247 M248 Q249 C253	K247-G251 PolarHBondContact O-N 3.15Å; M248-G251 PolarHBondContact O-N 3.41Å; M248-G251 VanDerWaalsContact O-N 3.14Å; Q249-G251 PolarHBondContact O-N 3.46Å; G251-C253 VanDerWaalsContact C-N 3.32Å
252	E	78.3	Confident	76.9	Confident	106 Å²	106	66.7 Å²	66.7	50%	0.495	34%	0.342	S	S	.	.	S	Bend	trans	-76.4	-23.8	178.5	-63.2	179.6	-128.8	0	0	111.8	K247 N250	K247-E252 HydrophobicContact CD-CB 4.26Å; K247-E252 HydrophobicContact CD-CG 4.39Å; K247-E252 WeakPolarHBondContact CD-OE1 3.39Å; K247-E252 WeakPolarHBondContact CD-OE2 3.43Å; K247-E252 WeakPolarHBondContact CE-OE2 3.31Å; K247-E252 IonicContact NZ-OE1 3.53Å; K247-E252 IonicContact NZ-OE2 3.02Å; K247-E252 PolarHBondContact NZ-OE2 3.03Å; K247-E252 PolarHBondContact O-N 3.06Å; K247-E252 VanDerWaalsContact O-N 3.09Å; N250-E252 VanDerWaalsContact C-N 3.26Å; N250-E252 HydrophobicContact CB-CG 3.9Å; N250-E252 WeakPolarHBondContact CB-OE1 3.36Å; N250-E252 PolarHBondContact ND2-OE1 3.03Å; N250-E252 PolarHBondContact O-N 3Å
253	C	77.7	Confident	76.4	Confident	15 Å²	15	61.3 Å²	61.3	10%	0.101	32%	0.318	C	S	.	.	S	Bend	trans	-148.4	151.8	177.3	50.9	0	0	0	0	111.7	A208 C210 M248 G251	A208-C253 WeakPolarHBondContact O-CB 3.43Å; C210-C253 HydrophobicContact CB-CB 3.85Å; C210-C253 WeakPolarHBondContact CB-SG 3.39Å; C210-C253 WeakPolarHBondContact SG-CB 3.41Å; C210-C253 CovalentContact SG-SG 2.03Å; C210-C253 PolarHBondContact SG-SG 2.9Å; M248-C253 VanDerWaalsContact CG-SG 3.51Å; G251-C253 VanDerWaalsContact C-N 3.32Å
254	S	75.3	Confident	75.7	Confident	68 Å²	68	60.7 Å²	60.7	48%	0.476	32%	0.32	S	S	.	.			trans	-80.5	141.4	177.8	53.3	0	0	0	0	111.9	D256	S254-D256 PolarHBondContact O-N 3.49Å
255	C	76	Confident	74.8	Confident	27 Å²	27	62.8 Å²	62.8	18%	0.182	33%	0.334	C	S	.	.			trans	-70.2	123.8	169	-161.9	0	0	0	0	111.4	M248 N257 C263	M248-C255 HydrophobicContact CE-CB 3.34Å; M248-C255 WeakPolarHBondContact CE-SG 3.34Å; C255-N257 PolarHBondContact O-N 3.42Å; C255-C263 HydrophobicContact CB-CB 3.62Å; C255-C263 WeakPolarHBondContact CB-SG 3.5Å; C255-C263 VanDerWaalsContact SG-CA 3.56Å; C255-C263 WeakPolarHBondContact SG-CB 3.44Å; C255-C263 CovalentContact SG-SG 2.01Å; C255-C263 PolarHBondContact SG-SG 3.28Å
256	D	73.9	Confident	73.9	Confident	25 Å²	25	67.9 Å²	67.9	13%	0.134	36%	0.357	C	S	.	.			trans	-74.4	93.2	162.5	-171.7	-22.5	0	0	0	110	Y209 S254 E258 H259 M260	Y209-D256 HydrophobicContact CE1-CB 3.96Å; Y209-D256 WeakPolarHBondContact CE1-OD2 3.33Å; S254-D256 PolarHBondContact O-N 3.49Å; D256-E258 PolarHBondContact O-N 3.17Å; D256-E258 WeakPolarHBondContact OD1-CA 3.3Å; D256-E258 WeakPolarHBondContact OD1-CB 3.48Å; D256-E258 PolarHBondContact OD1-N 3.27Å; D256-H259 PolarHBondContact O-N 3.46Å; D256-H259 IonicContact OD1-CG 3.85Å; D256-H259 PolarHBondContact OD1-N 3.02Å; D256-H259 IonicContact OD1-ND1 3.1Å; D256-H259 PolarHBondContact OD1-ND1 2.95Å; D256-H259 VanDerWaalsContact OD1-ND1 3.1Å; D256-H259 IonicContact OD2-CE1 3.69Å; D256-H259 IonicContact OD2-CG 3.39Å; D256-H259 IonicContact OD2-ND1 2.66Å; D256-H259 PolarHBondContact OD2-ND1 2.94Å; D256-M260 HydrophobicContact CB-CG 4.23Å; D256-M260 WeakPolarHBondContact O-CB 3.5Å; D256-M260 WeakPolarHBondContact O-CG 3.37Å; D256-M260 PolarHBondContact O-N 3.5Å
257	N	70.2	Confident	72.3	Confident	86 Å²	86	66.7 Å²	66.7	46%	0.46	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-9.2	178.6	-63.1	-67.2	0	0	0	114	C255 C263 N290	C255-N257 PolarHBondContact O-N 3.42Å; N257-C263 WeakPolarHBondContact OD1-CB 3.39Å; N257-C263 PolarHBondContact OD1-SG 2.92Å; N257-N290 PolarHBondContact O-ND2 3.26Å; N257-N290 PolarHBondContact O-OD1 3.24Å; N257-N290 VanDerWaalsContact O-OD1 3.04Å
258	E	67.9	Low	70.5	Confident	112 Å²	112	69.2 Å²	69.2	52%	0.523	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-36.3	177.3	-174.8	174.9	-178.8	0	0	111.2	D256 N290 Y292	D256-E258 PolarHBondContact O-N 3.17Å; D256-E258 WeakPolarHBondContact OD1-CA 3.3Å; D256-E258 WeakPolarHBondContact OD1-CB 3.48Å; D256-E258 PolarHBondContact OD1-N 3.27Å; E258-N290 PolarHBondContact O-ND2 3.5Å; E258-Y292 HydrophobicContact CB-CD2 4.39Å; E258-Y292 HydrophobicContact CG-CD2 4.41Å; E258-Y292 HydrophobicContact CG-CG 4.28Å
259	H	71.9	Confident	69.1	Low	116 Å²	116	78 Å²	78	54%	0.537	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-18.4	-173.8	-56.2	92.3	0	0	0	114.8	D256	D256-H259 PolarHBondContact O-N 3.46Å; D256-H259 IonicContact OD1-CG 3.85Å; D256-H259 PolarHBondContact OD1-N 3.02Å; D256-H259 IonicContact OD1-ND1 3.1Å; D256-H259 PolarHBondContact OD1-ND1 2.95Å; D256-H259 VanDerWaalsContact OD1-ND1 3.1Å; D256-H259 IonicContact OD2-CE1 3.69Å; D256-H259 IonicContact OD2-CG 3.39Å; D256-H259 IonicContact OD2-ND1 2.66Å; D256-H259 PolarHBondContact OD2-ND1 2.94Å
260	M	73.1	Confident	67.5	Low	66 Å²	66	81 Å²	81	33%	0.325	45%	0.445	S	S	.	.			trans	-91.9	138.3	178.3	-62.2	-64.4	171.3	0	0	111.8	D256 N262 N290 L293	D256-M260 HydrophobicContact CB-CG 4.23Å; D256-M260 WeakPolarHBondContact O-CB 3.5Å; D256-M260 WeakPolarHBondContact O-CG 3.37Å; D256-M260 PolarHBondContact O-N 3.5Å; M260-N262 VanDerWaalsContact C-N 3.33Å; M260-N262 PolarHBondContact O-N 3.01Å; M260-N290 WeakPolarHBondContact O-CB 3.49Å; M260-N290 PolarHBondContact O-ND2 2.9Å; M260-L293 VanDerWaalsContact C-CD1 3.47Å; M260-L293 WeakPolarHBondContact O-CD1 3.48Å
261	D	70.8	Confident	65.5	Low	94 Å²	94	79.3 Å²	79.3	50%	0.503	45%	0.453	S	S	.	.	S	Bend	trans	-59.5	-43.6	178.1	-75.5	-46.7	0	0	0	112.7	N290 L293	D261-N290 WeakPolarHBondContact O-CB 3.42Å; D261-N290 PolarHBondContact O-N 3.38Å; D261-L293 VanDerWaalsContact CA-CD1 3.46Å; D261-L293 HydrophobicContact CB-CD1 4.3Å; D261-L293 WeakPolarHBondContact OD1-CD1 3.49Å
262	N	69.8	Low	63.8	Low	26 Å²	26	84.7 Å²	84.7	14%	0.139	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	114.4	-166.7	-76.2	41.2	0	0	0	110	M260 F287 L288	M260-N262 VanDerWaalsContact C-N 3.33Å; M260-N262 PolarHBondContact O-N 3.01Å; N262-F287 HydrophobicContact CB-CB 3.93Å; N262-F287 HydrophobicContact CB-CD1 3.87Å; N262-F287 HydrophobicContact CB-CG 4.17Å; N262-L288 WeakPolarHBondContact CA-O 3.47Å
263	C	73.5	Confident	62.2	Low	4 Å²	4	88.1 Å²	88.1	3%	0.027	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.7	172.7	-61.5	0	0	0	0	111	C255 N257 F287 L288	C255-C263 HydrophobicContact CB-CB 3.62Å; C255-C263 WeakPolarHBondContact CB-SG 3.5Å; C255-C263 VanDerWaalsContact SG-CA 3.56Å; C255-C263 WeakPolarHBondContact SG-CB 3.44Å; C255-C263 CovalentContact SG-SG 2.01Å; C255-C263 PolarHBondContact SG-SG 3.28Å; N257-C263 WeakPolarHBondContact OD1-CB 3.39Å; N257-C263 PolarHBondContact OD1-SG 2.92Å; C263-F287 WeakPolarHBondContact O-CA 3.26Å; C263-L288 PolarHBondContact N-O 2.61Å; C263-L288 PolarHBondContact O-N 3.1Å
264	P	70	Confident	60.5	Low	33 Å²	33	92 Å²	92	21%	0.214	50%	0.499	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	136.4	169.9	28.7	-32.4	0	0	0	109.7	M248 Q249 E266 F287	M248-P264 HydrophobicContact CB-CG 4.25Å; M248-P264 HydrophobicContact CE-CG 4.37Å; Q249-P264 HydrophobicContact CG-CB 3.71Å; Q249-P264 HydrophobicContact CG-CG 3.88Å; P264-E266 PolarHBondContact O-N 3.35Å; P264-F287 HydrophobicContact CB-CE1 4.35Å
265	V	63.5	Low	59	Low	79 Å²	79	96.5 Å²	96.5	48%	0.479	52%	0.517	S	S	.	.			trans	-82.7	113	174.3	-179.4	0	0	0	0	108.3	S267 I286 L288	V265-S267 PolarHBondContact O-N 2.7Å; V265-I286 HydrophobicContact CG2-CG2 4.29Å; V265-L288 HydrophobicContact CG2-CB 4.09Å; V265-L288 HydrophobicContact CG2-CD1 4.44Å
266	E	59	Low	57.5	Low	136 Å²	136	103.1 Å²	103.1	64%	0.636	54%	0.543	S	S	*	.			trans	-61.5	123.1	162.5	-67.6	-176.9	179.7	0	0	107.9	P264 N268	P264-E266 PolarHBondContact O-N 3.35Å; E266-N268 PolarHBondContact O-N 3.45Å
267	S	48.9	Very low	56.2	Low	113 Å²	113	103.4 Å²	103.4	79%	0.79	55%	0.546	S	S	*	.			trans	-70.3	69.2	170.8	57	0	0	0	0	109	V265 E269	V265-S267 PolarHBondContact O-N 2.7Å; S267-E269 PolarHBondContact O-N 3.09Å
268	N	45.7	Very low	55.2	Low	108 Å²	108	103.3 Å²	103.3	58%	0.578	55%	0.552	S	S	*	*			trans	-64.9	119.9	164.9	-75.7	-41.4	0	0	0	106.4	E266 N270	E266-N268 PolarHBondContact O-N 3.45Å; N268-N270 CarbonylContact O-C 3.48Å; N268-N270 PolarHBondContact O-N 3.36Å
269	E	48.5	Very low	54.3	Low	195 Å²	195	99.9 Å²	99.9	91%	0.911	55%	0.547	S	S	*	.	S	Bend	trans	-54.6	-15.6	179.6	-62.4	-175.1	156.5	0	0	112.6	S267 G271	S267-E269 PolarHBondContact O-N 3.09Å; E269-G271 PolarHBondContact O-N 3.17Å; E269-G271 VanDerWaalsContact O-N 3.1Å
270	N	44.9	Very low	53.5	Low	132 Å²	132	99 Å²	99	71%	0.706	54%	0.543	S	S	*	.	S	Bend	trans	-82.5	84.1	171	-59	-21.9	0	0	0	109.4	N268 H272	N268-N270 CarbonylContact O-C 3.48Å; N268-N270 PolarHBondContact O-N 3.36Å; N270-H272 PolarHBondContact O-N 3.49Å
271	G	40	Very low	52.2	Low	68 Å²	68	103.9 Å²	103.9	70%	0.701	56%	0.562	S	S	*	*			trans	-61.2	52.7	-176.8	0	0	0	0	0	116.9	E269 K273	E269-G271 PolarHBondContact O-N 3.17Å; E269-G271 VanDerWaalsContact O-N 3.1Å; G271-K273 PolarHBondContact O-N 3.46Å
272	H	41.8	Very low	51.4	Low	169 Å²	169	102.4 Å²	102.4	78%	0.782	56%	0.557	S	S	*	*			trans	-79.9	74.4	163.5	-70.1	-71.3	0	0	0	108.9	N270 T274	N270-H272 PolarHBondContact O-N 3.49Å; H272-T274 VanDerWaalsContact C-N 3.33Å; H272-T274 PolarHBondContact O-N 2.94Å
273	K	43	Very low	50.6	Low	178 Å²	178	109 Å²	109	77%	0.774	59%	0.592	S	S	*	*			trans	-61.4	101.4	158.8	-65.1	177.9	-177.4	176.2	0	106	G271 D275	G271-K273 PolarHBondContact O-N 3.46Å; K273-D275 VanDerWaalsContact C-N 3.34Å; K273-D275 PolarHBondContact O-N 2.87Å
274	T	42.9	Very low	49.5	Very low	97 Å²	97	112.5 Å²	112.5	60%	0.595	63%	0.628	S	S	*	*			trans	-67.3	103.6	165.5	48.9	0	0	0	0	105.7	H272 F276 V277	H272-T274 VanDerWaalsContact C-N 3.33Å; H272-T274 PolarHBondContact O-N 2.94Å; T274-F276 PolarHBondContact O-N 3.03Å; T274-V277 PolarHBondContact O-N 2.79Å
275	D	44.1	Very low	48.8	Very low	162 Å²	162	116 Å²	116	87%	0.866	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	7.8	-178.3	-70.8	-36.5	0	0	0	114.4	K273 V277	K273-D275 VanDerWaalsContact C-N 3.34Å; K273-D275 PolarHBondContact O-N 2.87Å; D275-V277 VanDerWaalsContact C-N 3.33Å
276	F	43.6	Very low	48.4	Very low	167 Å²	167	116.8 Å²	116.8	73%	0.732	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-13.5	177.7	-167.1	-110.7	0	0	0	113.3	T274 P291	T274-F276 PolarHBondContact O-N 3.03Å; F276-P291 HydrophobicContact CD1-CG 4.42Å; F276-P291 HydrophobicContact CE1-CB 3.84Å; F276-P291 HydrophobicContact CE1-CG 4.08Å
277	V	46.9	Very low	48.4	Very low	31 Å²	31	110.9 Å²	110.9	19%	0.188	61%	0.613	C	S	.	*			trans	-125.7	116.1	-165.5	-160.9	0	0	0	0	113.5	T274 D275 G279 L288 V289	T274-V277 PolarHBondContact O-N 2.79Å; D275-V277 VanDerWaalsContact C-N 3.33Å; V277-G279 PolarHBondContact O-N 2.63Å; V277-G279 VanDerWaalsContact O-N 3.16Å; V277-L288 HydrophobicContact CB-CD1 3.41Å; V277-L288 VanDerWaalsContact CB-CD1 3.41Å; V277-L288 HydrophobicContact CB-CD2 4.46Å; V277-L288 HydrophobicContact CB-CG 3.88Å; V277-L288 HydrophobicContact CG1-CB 4.47Å; V277-L288 HydrophobicContact CG1-CD1 3.4Å; V277-L288 VanDerWaalsContact CG1-CD1 3.4Å; V277-L288 HydrophobicContact CG1-CD2 4.24Å; V277-L288 HydrophobicContact CG1-CG 3.39Å; V277-L288 HydrophobicContact CG2-CD1 4.12Å; V277-L288 HydrophobicContact CG2-CD2 4.36Å; V277-L288 HydrophobicContact CG2-CG 4.3Å; V277-V289 WeakPolarHBondContact CG1-O 3.5Å
278	S	49.3	Very low	49	Very low	84 Å²	84	108.1 Å²	108.1	59%	0.587	59%	0.589	S	S	*	*			trans	-72.7	104.3	176.1	-172.1	0	0	0	0	109.4	V289	S278-V289 WeakPolarHBondContact O-CB 3.01Å; S278-V289 WeakPolarHBondContact O-CG2 3.4Å
279	G	49.7	Very low	49.7	Very low	40 Å²	40	103.7 Å²	103.7	41%	0.412	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.2	134.1	172.2	0	0	0	0	0	111.5	V277 F287	V277-G279 PolarHBondContact O-N 2.63Å; V277-G279 VanDerWaalsContact O-N 3.16Å; G279-F287 CarbonylContact C-O 3.5Å; G279-F287 WeakPolarHBondContact CA-O 3.05Å
280	Q	53.5	Low	50.5	Low	96 Å²	96	94.8 Å²	94.8	45%	0.449	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141.2	164	-75.2	-177.9	20.3	0	0	109.3	F287 V289	Q280-F287 PolarHBondContact N-O 3.35Å; Q280-F287 PolarHBondContact O-N 2.83Å; Q280-V289 HydrophobicContact CB-CG2 4.27Å; Q280-V289 HydrophobicContact CG-CG2 3.73Å
281	K	47.8	Very low	51.3	Low	170 Å²	170	90.8 Å²	90.8	74%	0.739	51%	0.506	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	114.4	170	-72.9	-177	179.1	-178.4	0	108.5	K285 I286	K281-K285 WeakPolarHBondContact CA-O 3.23Å; K281-I286 HydrophobicContact CG-CG1 4.32Å
282	T	52	Low	52.3	Low	63 Å²	63	95.2 Å²	95.2	39%	0.387	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	124.4	166.5	52.7	0	0	0	0	106.9	G284 K285 F287	T282-G284 VanDerWaalsContact C-N 3.32Å; T282-G284 PolarHBondContact O-N 3.41Å; T282-K285 PolarHBondContact N-O 3.13Å; T282-K285 PolarHBondContact O-N 2.89Å; T282-K285 VanDerWaalsContact O-N 3.08Å; T282-F287 VanDerWaalsContact OG1-CD2 3.32Å; T282-F287 WeakPolarHBondContact OG1-CD2 3.42Å; T282-F287 WeakPolarHBondContact OG1-CE2 3.41Å
283	D	53.9	Low	53.3	Low	164 Å²	164	90.9 Å²	90.9	88%	0.877	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	43.7	176.3	-55.8	-21.8	0	0	0	115.5	K285	D283-K285 PolarHBondContact O-N 3.34Å
284	G	50.4	Low	54	Low	77 Å²	77	90.6 Å²	90.6	79%	0.794	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-3.2	176.6	0	0	0	0	0	115.2	T282	T282-G284 VanDerWaalsContact C-N 3.32Å; T282-G284 PolarHBondContact O-N 3.41Å
285	K	54.4	Low	54.3	Low	106 Å²	106	88.4 Å²	88.4	46%	0.461	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.2	177.2	-64.6	-178.1	-177.7	177.8	0	111	K281 T282 D283 F287	K281-K285 WeakPolarHBondContact CA-O 3.23Å; T282-K285 PolarHBondContact N-O 3.13Å; T282-K285 PolarHBondContact O-N 2.89Å; T282-K285 VanDerWaalsContact O-N 3.08Å; D283-K285 PolarHBondContact O-N 3.34Å; K285-F287 HydrophobicContact CB-CD2 4.24Å; K285-F287 HydrophobicContact CB-CE2 3.66Å; K285-F287 HydrophobicContact CB-CZ 4.36Å
286	I	57.1	Low	54.6	Low	97 Å²	97	89.4 Å²	89.4	50%	0.497	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	115.3	177.8	-58.2	169.8	0	0	0	107.6	V265 K281	V265-I286 HydrophobicContact CG2-CG2 4.29Å; K281-I286 HydrophobicContact CG-CG1 4.32Å
287	F	58.6	Low	54.8	Low	12 Å²	12	86 Å²	86	5%	0.053	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.5	174.5	-74.4	-87.8	0	0	0	110.4	I245 N262 C263 P264 G279 Q280 T282 K285 V289	I245-F287 HydrophobicContact CD1-CE1 4.37Å; I245-F287 HydrophobicContact CG2-CE1 3.7Å; I245-F287 HydrophobicContact CG2-CZ 3.77Å; N262-F287 HydrophobicContact CB-CB 3.93Å; N262-F287 HydrophobicContact CB-CD1 3.87Å; N262-F287 HydrophobicContact CB-CG 4.17Å; C263-F287 WeakPolarHBondContact O-CA 3.26Å; P264-F287 HydrophobicContact CB-CE1 4.35Å; G279-F287 CarbonylContact C-O 3.5Å; G279-F287 WeakPolarHBondContact CA-O 3.05Å; Q280-F287 PolarHBondContact N-O 3.35Å; Q280-F287 PolarHBondContact O-N 2.83Å; T282-F287 VanDerWaalsContact OG1-CD2 3.32Å; T282-F287 WeakPolarHBondContact OG1-CD2 3.42Å; T282-F287 WeakPolarHBondContact OG1-CE2 3.41Å; K285-F287 HydrophobicContact CB-CD2 4.24Å; K285-F287 HydrophobicContact CB-CE2 3.66Å; K285-F287 HydrophobicContact CB-CZ 4.36Å; F287-V289 PolarHBondContact O-N 2.83Å
288	L	60.3	Low	54.9	Low	54 Å²	54	94.2 Å²	94.2	28%	0.283	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	117.4	176	-159.8	72.3	0	0	0	108.7	N262 C263 V265 V277 N290	N262-L288 WeakPolarHBondContact CA-O 3.47Å; C263-L288 PolarHBondContact N-O 2.61Å; C263-L288 PolarHBondContact O-N 3.1Å; V265-L288 HydrophobicContact CG2-CB 4.09Å; V265-L288 HydrophobicContact CG2-CD1 4.44Å; V277-L288 HydrophobicContact CB-CD1 3.41Å; V277-L288 VanDerWaalsContact CB-CD1 3.41Å; V277-L288 HydrophobicContact CB-CD2 4.46Å; V277-L288 HydrophobicContact CB-CG 3.88Å; V277-L288 HydrophobicContact CG1-CB 4.47Å; V277-L288 HydrophobicContact CG1-CD1 3.4Å; V277-L288 VanDerWaalsContact CG1-CD1 3.4Å; V277-L288 HydrophobicContact CG1-CD2 4.24Å; V277-L288 HydrophobicContact CG1-CG 3.39Å; V277-L288 HydrophobicContact CG2-CD1 4.12Å; V277-L288 HydrophobicContact CG2-CD2 4.36Å; V277-L288 HydrophobicContact CG2-CG 4.3Å; L288-N290 PolarHBondContact O-N 2.87Å
289	V	62	Low	55.2	Low	16 Å²	16	99.9 Å²	99.9	10%	0.097	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	121.1	177.9	177.4	0	0	0	0	109.7	V277 S278 Q280 F287 P291	V277-V289 WeakPolarHBondContact CG1-O 3.5Å; S278-V289 WeakPolarHBondContact O-CB 3.01Å; S278-V289 WeakPolarHBondContact O-CG2 3.4Å; Q280-V289 HydrophobicContact CB-CG2 4.27Å; Q280-V289 HydrophobicContact CG-CG2 3.73Å; F287-V289 PolarHBondContact O-N 2.83Å; V289-P291 WeakPolarHBondContact O-CD 3.27Å
290	N	63.8	Low	55.3	Low	8 Å²	8	107.8 Å²	107.8	4%	0.043	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-66.9	121.7	-177.8	174.8	-4.4	0	0	0	112.1	N257 E258 M260 D261 L288 Y292 L293	N257-N290 PolarHBondContact O-ND2 3.26Å; N257-N290 PolarHBondContact O-OD1 3.24Å; N257-N290 VanDerWaalsContact O-OD1 3.04Å; E258-N290 PolarHBondContact O-ND2 3.5Å; M260-N290 WeakPolarHBondContact O-CB 3.49Å; M260-N290 PolarHBondContact O-ND2 2.9Å; D261-N290 WeakPolarHBondContact O-CB 3.42Å; D261-N290 PolarHBondContact O-N 3.38Å; L288-N290 PolarHBondContact O-N 2.87Å; N290-Y292 WeakPolarHBondContact OD1-CA 3.44Å; N290-Y292 VanDerWaalsContact OD1-CB 3.29Å; N290-Y292 WeakPolarHBondContact OD1-CB 3.25Å; N290-Y292 WeakPolarHBondContact OD1-CD2 3.42Å; N290-Y292 PolarHBondContact OD1-N 3.31Å; N290-L293 HydrophobicContact CB-CD1 4.07Å; N290-L293 VanDerWaalsContact ND2-CD1 3.34Å; N290-L293 WeakPolarHBondContact ND2-CD1 3.44Å; N290-L293 WeakPolarHBondContact ND2-CG 3.23Å
291	P	63.2	Low	55.2	Low	48 Å²	48	111.8 Å²	111.8	31%	0.312	56%	0.555	S	S	.	*	S	Bend	trans	-73.9	-24.1	179.2	30.2	-34.5	0	0	0	113.8	F276 V289 R294	F276-P291 HydrophobicContact CD1-CG 4.42Å; F276-P291 HydrophobicContact CE1-CB 3.84Å; F276-P291 HydrophobicContact CE1-CG 4.08Å; V289-P291 WeakPolarHBondContact O-CD 3.27Å; P291-R294 PolarHBondContact O-N 2.92Å
292	Y	60.7	Low	55.4	Low	160 Å²	160	109.3 Å²	109.3	63%	0.627	55%	0.554	S	S	*	*	S	Bend	trans	-72.3	-29.2	-175.6	-57.7	-72.7	0	0	0	112.8	E258 N290 R294 G295	E258-Y292 HydrophobicContact CB-CD2 4.39Å; E258-Y292 HydrophobicContact CG-CD2 4.41Å; E258-Y292 HydrophobicContact CG-CG 4.28Å; N290-Y292 WeakPolarHBondContact OD1-CA 3.44Å; N290-Y292 VanDerWaalsContact OD1-CB 3.29Å; N290-Y292 WeakPolarHBondContact OD1-CB 3.25Å; N290-Y292 WeakPolarHBondContact OD1-CD2 3.42Å; N290-Y292 PolarHBondContact OD1-N 3.31Å; Y292-R294 PolarHBondContact O-N 3.17Å; Y292-G295 PolarHBondContact O-N 3.25Å
293	L	62.5	Low	55.4	Low	79 Å²	79	110.1 Å²	110.1	41%	0.414	57%	0.566	S	S	.	*	S	Bend	trans	-72.8	-20.6	175.2	-67.2	167.4	0	0	0	112.4	M260 D261 N290 G295	M260-L293 VanDerWaalsContact C-CD1 3.47Å; M260-L293 WeakPolarHBondContact O-CD1 3.48Å; D261-L293 VanDerWaalsContact CA-CD1 3.46Å; D261-L293 HydrophobicContact CB-CD1 4.3Å; D261-L293 WeakPolarHBondContact OD1-CD1 3.49Å; N290-L293 HydrophobicContact CB-CD1 4.07Å; N290-L293 VanDerWaalsContact ND2-CD1 3.34Å; N290-L293 WeakPolarHBondContact ND2-CD1 3.44Å; N290-L293 WeakPolarHBondContact ND2-CG 3.23Å; L293-G295 PolarHBondContact O-N 3.3Å; L293-G295 VanDerWaalsContact O-N 3.08Å
294	R	56.6	Low	55.3	Low	171 Å²	171	110 Å²	110	65%	0.645	56%	0.558	S	S	*	*			trans	-83.2	46	166.7	-57.5	-171.7	-171.9	167.2	1.6	111.2	P291 Y292 E296	P291-R294 PolarHBondContact O-N 2.92Å; Y292-R294 PolarHBondContact O-N 3.17Å; R294-E296 PolarHBondContact O-N 2.86Å
295	G	49.8	Very low	55.4	Low	51 Å²	51	115.3 Å²	115.3	53%	0.526	56%	0.559	S	S	.	*	S	Bend	trans	-51.3	129.7	149.5	0	0	0	0	0	107	Y292 L293 S297	Y292-G295 PolarHBondContact O-N 3.25Å; L293-G295 PolarHBondContact O-N 3.3Å; L293-G295 VanDerWaalsContact O-N 3.08Å; G295-S297 PolarHBondContact O-N 3.08Å
296	E	51.4	Low	55.3	Low	184 Å²	184	118.9 Å²	118.9	86%	0.86	57%	0.57	S	S	*	*			trans	-42.9	109.7	177.7	-175	169.6	-167.8	0	0	108.2	R294 R298	R294-E296 PolarHBondContact O-N 2.86Å; E296-R298 PolarHBondContact O-N 3.39Å
297	S	46.9	Very low	55.2	Low	94 Å²	94	119.5 Å²	119.5	66%	0.657	58%	0.578	S	S	*	*			trans	-54.4	112.9	-172.1	55.6	0	0	0	0	106.2	G295 K299	G295-S297 PolarHBondContact O-N 3.08Å; S297-K299 VanDerWaalsContact C-N 3.26Å; S297-K299 PolarHBondContact O-N 3.13Å
298	R	48.3	Very low	54.8	Low	204 Å²	204	126.8 Å²	126.8	77%	0.77	61%	0.609	S	S	*	*			trans	-65.2	97.2	-173.9	-72.4	-175.7	-177.6	161.7	4.1	105.7	E296 R300	E296-R298 PolarHBondContact O-N 3.39Å; R298-R300 PolarHBondContact O-N 3.16Å
299	K	56.1	Low	54.3	Low	204 Å²	204	134.5 Å²	134.5	89%	0.887	64%	0.635	S	S	*	*	S	Bend	trans	-56.4	-9.9	177.7	-66	-174.3	179.9	-179.4	0	112.5	S297	S297-K299 VanDerWaalsContact C-N 3.26Å; S297-K299 PolarHBondContact O-N 3.13Å
300	R	51.3	Low	53.7	Low	205 Å²	205	136.3 Å²	136.3	77%	0.774	65%	0.648	S	S	*	*	S	Bend	trans	-134.3	120.2	175	-68.2	-177.5	169.5	173.3	-4.2	109.1	R298 V302	R298-R300 PolarHBondContact O-N 3.16Å; R300-V302 PolarHBondContact O-N 2.86Å
301	L	53.1	Low	53.1	Low	181 Å²	181	144.5 Å²	144.5	95%	0.948	69%	0.686	S	S	*	*	S	Bend	trans	-63.2	-2.3	174.7	-73	166.5	0	0	0	114.1	A303	L301-A303 PolarHBondContact O-N 3.36Å
302	V	51	Low	52.6	Low	118 Å²	118	148.1 Å²	148.1	72%	0.715	70%	0.701	S	S	*	*	S	Bend	trans	-89.9	113.1	177.8	-168.1	0	0	0	0	109	R300 K304	R300-V302 PolarHBondContact O-N 2.86Å; V302-K304 VanDerWaalsContact C-N 3.31Å; V302-K304 PolarHBondContact O-N 3.26Å
303	A	52	Low	52.2	Low	79 Å²	79	146 Å²	146	65%	0.653	71%	0.707	S	S	*	*			trans	-57.1	94.2	168.2	0	0	0	0	0	109	L301 K305	L301-A303 PolarHBondContact O-N 3.36Å; A303-K305 VanDerWaalsContact C-N 3.31Å; A303-K305 PolarHBondContact O-N 3.12Å
304	K	51.6	Low	51.8	Low	161 Å²	161	152.5 Å²	152.5	70%	0.7	73%	0.726	S	S	*	*			trans	-71.1	94.1	175.2	-166.3	166.5	-176.6	166.7	0	107.3	V302 R306	V302-K304 VanDerWaalsContact C-N 3.31Å; V302-K304 PolarHBondContact O-N 3.26Å; K304-R306 HydrophobicContact CD-CG 4.47Å; K304-R306 HydrophobicContact CG-CG 4.03Å; K304-R306 PolarHBondContact O-N 3.37Å
305	K	53.4	Low	51.8	Low	189 Å²	189	152.5 Å²	152.5	82%	0.822	73%	0.728	S	S	*	*			trans	-61.6	80.7	170.4	-170.5	176.5	-176.4	176.1	0	108.5	A303 V307	A303-K305 VanDerWaalsContact C-N 3.31Å; A303-K305 PolarHBondContact O-N 3.12Å; K305-V307 HydrophobicContact CG-CG2 4.44Å; K305-V307 PolarHBondContact O-N 2.91Å
306	R	51.3	Low	52.4	Low	181 Å²	181	153.6 Å²	153.6	68%	0.683	72%	0.721	S	S	*	*			trans	-75	98	173.2	-66.7	-168.1	-171.2	-161.3	5.9	106.9	K304 K308	K304-R306 HydrophobicContact CD-CG 4.47Å; K304-R306 HydrophobicContact CG-CG 4.03Å; K304-R306 PolarHBondContact O-N 3.37Å; R306-K308 PolarHBondContact O-N 3.06Å
307	V	54.9	Low	53	Low	110 Å²	110	148.3 Å²	148.3	67%	0.667	70%	0.703	S	S	*	*			trans	-69.1	77.8	163.3	-174.7	0	0	0	0	107	K305 R309	K305-V307 HydrophobicContact CG-CG2 4.44Å; K305-V307 PolarHBondContact O-N 2.91Å; V307-R309 HydrophobicContact CG1-CG 4.18Å; V307-R309 PolarHBondContact O-N 2.88Å; V307-R309 VanDerWaalsContact O-N 3.16Å
308	K	50	Low	53.6	Low	165 Å²	165	153.8 Å²	153.8	72%	0.717	71%	0.711	S	S	*	*			trans	-73.4	103.7	160.4	-74.2	-162.7	177.8	-173.5	0	105.4	R306 S310	R306-K308 PolarHBondContact O-N 3.06Å; K308-S310 PolarHBondContact O-N 3.44Å
309	R	49.6	Very low	54.1	Low	217 Å²	217	149.9 Å²	149.9	82%	0.819	70%	0.704	S	S	*	*			trans	-65.6	66.7	161	-66.5	-178.7	178.3	163.3	-1.6	108	V307 H311	V307-R309 HydrophobicContact CG1-CG 4.18Å; V307-R309 PolarHBondContact O-N 2.88Å; V307-R309 VanDerWaalsContact O-N 3.16Å; R309-H311 PolarHBondContact O-N 2.99Å; R309-H311 VanDerWaalsContact O-N 3.16Å
310	S	49.3	Very low	54.3	Low	53 Å²	53	145.4 Å²	145.4	37%	0.371	69%	0.69	S	S	.	*			trans	-73.4	105.7	163.3	57.6	0	0	0	0	105.3	K308 I312	K308-S310 PolarHBondContact O-N 3.44Å; S310-I312 PolarHBondContact O-N 3.48Å
311	H	53.1	Low	54.8	Low	181 Å²	181	138.2 Å²	138.2	84%	0.838	68%	0.679	S	S	*	*			trans	-60.9	21	169.9	-95.5	-85.3	0	0	0	113.5	R309 P313	R309-H311 PolarHBondContact O-N 2.99Å; R309-H311 VanDerWaalsContact O-N 3.16Å; H311-P313 WeakPolarHBondContact O-CD 3.4Å
312	I	51.4	Low	55.3	Low	123 Å²	123	134.2 Å²	134.2	63%	0.631	67%	0.667	S	S	*	*	S	Bend	trans	-85.8	109.8	170.7	-55.9	170.1	0	0	0	104.6	S310 R314	S310-I312 PolarHBondContact O-N 3.48Å; I312-R314 VanDerWaalsContact C-N 3.28Å; I312-R314 PolarHBondContact O-N 3.28Å
313	P	53.5	Low	55.7	Low	117 Å²	117	135.7 Å²	135.7	76%	0.76	67%	0.669	S	S	*	*			trans	-58.7	100.9	169.8	24	-30	0	0	0	106.4	H311 Y315	H311-P313 WeakPolarHBondContact O-CD 3.4Å; P313-Y315 PolarHBondContact O-N 3.46Å
314	R	53.4	Low	55.7	Low	215 Å²	215	139.3 Å²	139.3	81%	0.811	67%	0.672	S	S	*	*			trans	-69	90.2	168.8	-72.2	-173.4	-174.7	171.4	-0.9	105.4	I312 N316	I312-R314 VanDerWaalsContact C-N 3.28Å; I312-R314 PolarHBondContact O-N 3.28Å; R314-N316 PolarHBondContact O-N 3Å
315	Y	56	Low	56	Low	171 Å²	171	141.6 Å²	141.6	67%	0.671	68%	0.682	S	S	*	*			trans	-53.1	106.2	169.6	-176.2	-101.3	0	0	0	107.5	P313 P317 L320	P313-Y315 PolarHBondContact O-N 3.46Å; Y315-P317 VanDerWaalsContact O-CD 3.27Å; Y315-P317 WeakPolarHBondContact O-CD 3.37Å; Y315-L320 HydrophobicContact CE1-CD1 4.21Å; Y315-L320 HydrophobicContact CE1-CD2 4.17Å; Y315-L320 HydrophobicContact CE1-CG 4.35Å; Y315-L320 HydrophobicContact CE2-CD2 4.34Å; Y315-L320 WeakPolarHBondContact OH-CD2 3.36Å
316	N	62.7	Low	55.8	Low	73 Å²	73	137.7 Å²	137.7	39%	0.39	67%	0.674	S	S	.	*			trans	-80.5	110.8	177.8	-179.3	-6	0	0	0	107.5	R314 Y318 L319	R314-N316 PolarHBondContact O-N 3Å; N316-Y318 PolarHBondContact O-N 3.14Å; N316-Y318 VanDerWaalsContact O-N 3.14Å; N316-Y318 WeakPolarHBondContact OD1-CB 3.37Å; N316-Y318 VanDerWaalsContact OD1-CD2 3.27Å; N316-Y318 WeakPolarHBondContact OD1-CD2 3.27Å; N316-Y318 PolarHBondContact OD1-N 2.91Å; N316-L319 HydrophobicContact CB-CB 4.43Å; N316-L319 HydrophobicContact CB-CD1 3.94Å; N316-L319 HydrophobicContact CB-CG 4.17Å; N316-L319 PolarHBondContact O-N 3.4Å
317	P	64.8	Low	55.7	Low	74 Å²	74	134 Å²	134	48%	0.481	68%	0.682	S	S	.	*	G	3₁₀ helix	trans	-63.1	-20.9	-177.6	26.8	-34.5	0	0	0	112.7	Y315 L319 L320	Y315-P317 VanDerWaalsContact O-CD 3.27Å; Y315-P317 WeakPolarHBondContact O-CD 3.37Å; P317-L319 VanDerWaalsContact C-N 3.27Å; P317-L319 PolarHBondContact O-N 3.36Å; P317-L320 WeakPolarHBondContact O-CB 3.44Å; P317-L320 WeakPolarHBondContact O-CD1 3.37Å; P317-L320 WeakPolarHBondContact O-CG 3.45Å; P317-L320 PolarHBondContact O-N 3.32Å
318	Y	58.3	Low	55.1	Low	208 Å²	208	134.9 Å²	134.9	82%	0.816	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-79.1	-8.3	178.2	-55.7	-74.5	0	0	0	113.7	N316	N316-Y318 PolarHBondContact O-N 3.14Å; N316-Y318 VanDerWaalsContact O-N 3.14Å; N316-Y318 WeakPolarHBondContact OD1-CB 3.37Å; N316-Y318 VanDerWaalsContact OD1-CD2 3.27Å; N316-Y318 WeakPolarHBondContact OD1-CD2 3.27Å; N316-Y318 PolarHBondContact OD1-N 2.91Å
319	L	60.2	Low	54.8	Low	122 Å²	122	134 Å²	134	64%	0.639	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-97.3	14.6	174.3	-68.4	174.7	0	0	0	112.8	N316 P317 G321	N316-L319 HydrophobicContact CB-CB 4.43Å; N316-L319 HydrophobicContact CB-CD1 3.94Å; N316-L319 HydrophobicContact CB-CG 4.17Å; N316-L319 PolarHBondContact O-N 3.4Å; P317-L319 VanDerWaalsContact C-N 3.27Å; P317-L319 PolarHBondContact O-N 3.36Å; L319-G321 PolarHBondContact O-N 2.68Å
320	L	59.9	Low	54.3	Low	111 Å²	111	133.9 Å²	133.9	58%	0.581	69%	0.689	S	S	*	*			trans	-71.9	-9.8	177.6	-80.8	171.8	0	0	0	114.4	Y315 P317	Y315-L320 HydrophobicContact CE1-CD1 4.21Å; Y315-L320 HydrophobicContact CE1-CD2 4.17Å; Y315-L320 HydrophobicContact CE1-CG 4.35Å; Y315-L320 HydrophobicContact CE2-CD2 4.34Å; Y315-L320 WeakPolarHBondContact OH-CD2 3.36Å; P317-L320 WeakPolarHBondContact O-CB 3.44Å; P317-L320 WeakPolarHBondContact O-CD1 3.37Å; P317-L320 WeakPolarHBondContact O-CG 3.45Å; P317-L320 PolarHBondContact O-N 3.32Å
321	G	60.8	Low	54.1	Low	54 Å²	54	137.7 Å²	137.7	56%	0.557	70%	0.704	S	S	*	*	S	Bend	trans	-77.4	151.2	172.5	0	0	0	0	0	112.1	L319 I323	L319-G321 PolarHBondContact O-N 2.68Å; G321-I323 PolarHBondContact O-N 3.4Å
322	S	65.1	Low	53.4	Low	97 Å²	97	132.2 Å²	132.2	68%	0.678	70%	0.697	S	S	*	*			trans	-58.5	126.5	165.2	52.5	0	0	0	0	108.8	H324	S322-H324 PolarHBondContact O-N 3.32Å
323	I	58.7	Low	52.8	Low	148 Å²	148	131.6 Å²	131.6	76%	0.759	70%	0.701	S	S	*	*			trans	-65.6	106.3	176.1	-59.2	171.8	0	0	0	107	G321 K325	G321-I323 PolarHBondContact O-N 3.4Å; I323-K325 PolarHBondContact O-N 3.38Å; I323-K325 VanDerWaalsContact O-N 3.16Å
324	H	52.9	Low	52.1	Low	156 Å²	156	135.4 Å²	135.4	72%	0.722	70%	0.701	S	S	*	*			trans	-63.8	116.5	171.2	-73.7	-60.6	0	0	0	108.5	S322 T326	S322-H324 PolarHBondContact O-N 3.32Å; H324-T326 PolarHBondContact O-N 3.49Å; H324-T326 VanDerWaalsContact O-N 3.14Å
325	K	57.6	Low	51.3	Low	209 Å²	209	134 Å²	134	91%	0.909	70%	0.701	S	S	*	*	S	Bend	trans	-67.4	-10.1	-179.1	-66.6	-174.3	179.7	-178	0	113.4	I323	I323-K325 PolarHBondContact O-N 3.38Å; I323-K325 VanDerWaalsContact O-N 3.16Å
326	T	48.9	Very low	50.6	Low	106 Å²	106	130.2 Å²	130.2	65%	0.65	70%	0.697	S	S	*	*			trans	-135.4	110.9	-176.3	49	0	0	0	0	109.1	H324 V328	H324-T326 PolarHBondContact O-N 3.49Å; H324-T326 VanDerWaalsContact O-N 3.14Å; T326-V328 PolarHBondContact O-N 2.96Å
327	A	48.3	Very low	49.4	Very low	104 Å²	104	131.8 Å²	131.8	86%	0.86	71%	0.714	S	S	*	*			trans	-75.9	112.7	162.9	0	0	0	0	0	107.5	K329	A327-K329 PolarHBondContact O-N 3.22Å
328	V	42.4	Very low	48.2	Very low	129 Å²	129	137.2 Å²	137.2	78%	0.782	73%	0.733	S	S	*	*			trans	-80.5	107.4	170.4	-179.4	0	0	0	0	106.7	T326 K330	T326-V328 PolarHBondContact O-N 2.96Å; V328-K330 PolarHBondContact O-N 3.29Å
329	K	43.6	Very low	47.3	Very low	147 Å²	147	135.2 Å²	135.2	64%	0.639	73%	0.731	S	S	*	*			trans	-61.3	125.7	166.7	-81.7	-172.7	175.2	-174.8	0	107.5	A327 I331	A327-K329 PolarHBondContact O-N 3.22Å; K329-I331 HydrophobicContact CB-CD1 4.06Å; K329-I331 HydrophobicContact CB-CG1 4.2Å; K329-I331 HydrophobicContact CD-CD1 4.22Å; K329-I331 PolarHBondContact O-N 3.37Å
330	K	39.8	Very low	46.1	Very low	214 Å²	214	139.4 Å²	139.4	93%	0.93	74%	0.744	S	S	*	*			trans	-65.9	88.6	167.3	-73.8	-169.9	179.1	-176.8	0	108	V328	V328-K330 PolarHBondContact O-N 3.29Å
331	I	44.1	Very low	45	Very low	133 Å²	133	143.5 Å²	143.5	68%	0.682	75%	0.753	S	S	*	*			trans	-125.3	84.3	165.6	-57.2	165.2	0	0	0	104.9	K329	K329-I331 HydrophobicContact CB-CD1 4.06Å; K329-I331 HydrophobicContact CB-CG1 4.2Å; K329-I331 HydrophobicContact CD-CD1 4.22Å; K329-I331 PolarHBondContact O-N 3.37Å
332	G	38.8	Very low	43.8	Very low	66 Å²	66	153.7 Å²	153.7	68%	0.68	79%	0.789	S	S	*	*			trans	-71.2	130.2	159.1	0	0	0	0	0	107.2	Y334	G332-Y334 PolarHBondContact O-N 3.3Å; G332-Y334 VanDerWaalsContact O-N 3.16Å
333	P	39.4	Very low	42.7	Very low	110 Å²	110	156.5 Å²	156.5	71%	0.714	80%	0.795	S	S	*	*			trans	-58.8	120.9	175.2	23.3	-31.7	0	0	0	109.2	K335	P333-K335 PolarHBondContact O-N 3.37Å; P333-K335 VanDerWaalsContact O-N 3.11Å
334	Y	38.7	Very low	41.9	Very low	196 Å²	196	156.9 Å²	156.9	77%	0.769	80%	0.797	S	S	*	*			trans	-59.1	113.6	169.5	178.7	-99.1	0	0	0	108	G332 P336	G332-Y334 PolarHBondContact O-N 3.3Å; G332-Y334 VanDerWaalsContact O-N 3.16Å; Y334-P336 HydrophobicContact CE1-CB 4.22Å; Y334-P336 WeakPolarHBondContact O-CD 3.26Å
335	K	37.4	Very low	41.3	Very low	187 Å²	187	157 Å²	157	81%	0.813	80%	0.801	S	S	*	*			trans	-87	112.2	169	-72.3	-175.2	179.1	-177.8	0	106.6	P333 S337	P333-K335 PolarHBondContact O-N 3.37Å; P333-K335 VanDerWaalsContact O-N 3.11Å; K335-S337 PolarHBondContact O-N 3.11Å
336	P	39.4	Very low	40.3	Very low	90 Å²	90	153.9 Å²	153.9	58%	0.584	80%	0.795	S	S	*	*			trans	-59.2	126.1	169.1	25.2	-31.2	0	0	0	107.4	Y334 Q338	Y334-P336 HydrophobicContact CE1-CB 4.22Å; Y334-P336 WeakPolarHBondContact O-CD 3.26Å; P336-Q338 PolarHBondContact O-N 3.17Å
337	S	39.2	Very low	39.8	Very low	107 Å²	107	156.9 Å²	156.9	75%	0.748	80%	0.804	S	S	*	*			trans	-58.5	106.7	166.3	48.5	0	0	0	0	106.8	K335 E339	K335-S337 PolarHBondContact O-N 3.11Å; S337-E339 PolarHBondContact O-N 3.06Å
338	Q	39.2	Very low	39.2	Very low	188 Å²	188	160.5 Å²	160.5	88%	0.879	80%	0.8	S	S	*	*			trans	-57.9	126.9	171.3	-73.8	-169.4	-44.6	0	0	108	P336 K340	P336-Q338 PolarHBondContact O-N 3.17Å; Q338-K340 PolarHBondContact O-N 2.96Å
339	E	39.5	Very low	39	Very low	166 Å²	166	162.7 Å²	162.7	78%	0.776	80%	0.801	S	S	*	*			trans	-44.1	129.8	179.4	-77.4	162.4	132	0	0	111.8	S337 Y341	S337-E339 PolarHBondContact O-N 3.06Å; E339-Y341 HydrophobicContact CB-CD2 4.22Å; E339-Y341 HydrophobicContact CG-CD2 4.47Å; E339-Y341 PolarHBondContact O-N 3.22Å
340	K	33.7	Very low	38.7	Very low	209 Å²	209	163.9 Å²	163.9	91%	0.909	81%	0.814	S	S	*	*	S	Bend	trans	-79.7	59.5	163.7	-147	179.8	-167.5	-179.2	0	107.9	Q338	Q338-K340 PolarHBondContact O-N 2.96Å
341	Y	38	Very low	38.6	Very low	198 Å²	198	159.8 Å²	159.8	78%	0.776	80%	0.804	S	S	*	*			trans	-141.6	73.1	173.2	-70.1	-73.6	0	0	0	108.9	E339	E339-Y341 HydrophobicContact CB-CD2 4.22Å; E339-Y341 HydrophobicContact CG-CD2 4.47Å; E339-Y341 PolarHBondContact O-N 3.22Å
342	M	35.3	Very low	38.1	Very low	267 Å²	267	162.2 Å²	162.2	100%	1.315	82%	0.815	S	S	*	*			trans	174.9	0	136.8	-93.2	-168.5	98.5	0	0	110.5

Retrieved 342 of 342 residues in 177.6 ms (Link to these results)

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