A0A096NRV9_PAPAN Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB (Q9GZT5), UniProt , Accession A0A096NRV9, Species PAPAN (Papio anubis, Olive baboon), Gene WNT10A, Length 417 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	49	Very low	252 Å²	252	168.5 Å²	168.5	100%	1.241	87%	0.873	S	S	*	*				0	120.7	0	-82.4	161.8	132.7	0	0	108.2
2	G	42.3	Very low	49.3	Very low	73 Å²	73	168.6 Å²	168.6	75%	0.753	87%	0.874	S	S	*	*			trans	96.8	79.5	159.5	0	0	0	0	0	118.3
3	S	42.5	Very low	49.8	Very low	125 Å²	125	173.3 Å²	173.3	87%	0.874	87%	0.874	S	S	*	*			trans	26.4	142.5	132	-49	0	0	0	0	120.7
4	A	48.3	Very low	50.3	Low	87 Å²	87	170 Å²	170	72%	0.719	87%	0.87	S	S	*	*			cis	-171.7	139.9	-4.7	0	0	0	0	0	108.1
5	H	49.9	Very low	50.8	Low	181 Å²	181	171 Å²	171	84%	0.838	87%	0.87	S	S	*	*			trans	46	120.9	156.3	-77	-68.9	0	0	0	123
6	P	56.7	Low	51.5	Low	122 Å²	122	167.6 Å²	167.6	79%	0.792	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-91.1	132.9	148.2	31.5	-20	0	0	0	110.9
7	R	53	Low	52.1	Low	238 Å²	238	168.1 Å²	168.1	90%	0.898	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-74	141.7	172.6	-75.9	-177.4	174.1	-168.1	-1.4	111.1
8	P	54.7	Low	52.5	Low	117 Å²	117	164.4 Å²	164.4	76%	0.76	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-84.7	137.1	172.5	33.3	-29.4	0	0	0	110.8	L10	P8-L10 PolarHBondContact O-N 3.48Å
9	W	48.1	Very low	53	Low	250 Å²	250	166.1 Å²	166.1	95%	0.947	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-71.4	117.6	176.2	-72.5	77.7	0	0	0	110.5
10	L	50.3	Low	53.8	Low	165 Å²	165	162.9 Å²	162.9	86%	0.864	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-72.3	131.5	170.3	-92.8	135.2	0	0	0	110.2	P8 L12	P8-L10 PolarHBondContact O-N 3.48Å; L10-L12 PolarHBondContact O-N 3.41Å
11	R	51.2	Low	54.7	Low	243 Å²	243	158 Å²	158	92%	0.917	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-51.6	124	176.3	-69.9	179.6	-171.7	-146.8	1.7	111.6	R13	R11-R13 PolarHBondContact O-N 3.36Å
12	L	52.2	Low	56.2	Low	170 Å²	170	151.2 Å²	151.2	89%	0.89	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-64.2	125	165.3	-83.1	131	0	0	0	110	L10	L10-L12 PolarHBondContact O-N 3.41Å
13	R	55.5	Low	57.9	Low	230 Å²	230	156.5 Å²	156.5	87%	0.868	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-66	149.8	165.4	-87.1	-177.9	175.1	178.7	-1.3	109.9	R11 Q15	R11-R13 PolarHBondContact O-N 3.36Å; R13-Q15 PolarHBondContact O-N 3.34Å
14	P	57.8	Low	59.6	Low	127 Å²	127	154.3 Å²	154.3	83%	0.825	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-66.4	127.2	176.3	8.7	1.7	0	0	0	110
15	Q	57.9	Low	61.1	Low	185 Å²	185	155.3 Å²	155.3	86%	0.864	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.7	132.7	174	-152.6	173.7	4.9	0	0	108.8	R13 Q17	R13-Q15 PolarHBondContact O-N 3.34Å; Q15-Q17 PolarHBondContact O-N 3.17Å
16	P	61	Low	62.6	Low	116 Å²	116	151.4 Å²	151.4	75%	0.753	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-67.7	127.3	178.4	27.6	-31.4	0	0	0	109.1
17	Q	62.7	Low	63.9	Low	177 Å²	177	152.1 Å²	152.1	83%	0.827	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-57.5	136.7	173.6	-75.5	-175.4	-16.5	0	0	110.2	Q15 R19	Q15-Q17 PolarHBondContact O-N 3.17Å; Q17-R19 PolarHBondContact O-N 3.34Å
18	P	59.2	Low	65.2	Low	102 Å²	102	146.9 Å²	146.9	66%	0.662	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-65.5	118.5	175.8	27.4	-31.3	0	0	0	108.3	P20	P18-P20 WeakPolarHBondContact O-CD 3.19Å
19	R	62.1	Low	66.4	Low	195 Å²	195	146.6 Å²	146.6	74%	0.736	71%	0.709	S	S	*	*			trans	-67.2	112.4	175.2	-71.1	-178.4	172	-177.1	-2.8	108.4	Q17 A21 L22	Q17-R19 PolarHBondContact O-N 3.34Å; R19-A21 PolarHBondContact O-N 3.01Å; R19-A21 VanDerWaalsContact O-N 3.08Å; R19-L22 HydrophobicContact CB-CD1 4.5Å; R19-L22 PolarHBondContact O-N 3.13Å; R19-L22 VanDerWaalsContact O-N 3.13Å
20	P	68.6	Low	68	Low	102 Å²	102	140 Å²	140	66%	0.662	69%	0.692	S	S	*	*	H	α-helix	trans	-60.8	-24	-177	23.5	-32.6	0	0	0	112.4	P18 L22 W23 V24	P18-P20 WeakPolarHBondContact O-CD 3.19Å; P20-L22 VanDerWaalsContact C-N 3.29Å; P20-L22 PolarHBondContact O-N 3.3Å; P20-W23 PolarHBondContact O-N 3.08Å; P20-V24 WeakPolarHBondContact O-CG2 3.39Å; P20-V24 PolarHBondContact O-N 3.49Å; P20-V24 VanDerWaalsContact O-N 3.14Å
21	A	72.9	Confident	69.4	Low	62 Å²	62	136.6 Å²	136.6	51%	0.512	67%	0.674	S	S	.	*	H	α-helix	trans	-59.7	-33	176.8	0	0	0	0	0	114.1	R19 L25	R19-A21 PolarHBondContact O-N 3.01Å; R19-A21 VanDerWaalsContact O-N 3.08Å; A21-L25 WeakPolarHBondContact O-CB 3.45Å; A21-L25 PolarHBondContact O-N 3.14Å
22	L	74.1	Confident	70.6	Confident	108 Å²	108	129.6 Å²	129.6	57%	0.565	66%	0.655	S	S	*	*	H	α-helix	trans	-71.2	-37.9	179.9	-91.2	157.5	0	0	0	112.1	R19 P20 L25 L26	R19-L22 HydrophobicContact CB-CD1 4.5Å; R19-L22 PolarHBondContact O-N 3.13Å; R19-L22 VanDerWaalsContact O-N 3.13Å; P20-L22 VanDerWaalsContact C-N 3.29Å; P20-L22 PolarHBondContact O-N 3.3Å; L22-L25 PolarHBondContact O-N 2.86Å; L22-L26 WeakPolarHBondContact O-CB 3.4Å; L22-L26 PolarHBondContact O-N 3.4Å
23	W	76.3	Confident	71.7	Confident	185 Å²	185	125 Å²	125	70%	0.701	64%	0.641	S	S	*	*	H	α-helix	trans	-70.4	-38	176.3	-73.2	95.9	0	0	0	111.8	P20 L26 F27	P20-W23 PolarHBondContact O-N 3.08Å; W23-L26 PolarHBondContact O-N 3.29Å; W23-F27 WeakPolarHBondContact O-CB 3.47Å; W23-F27 PolarHBondContact O-N 3.3Å
24	V	79.1	Confident	72.6	Confident	79 Å²	79	118 Å²	118	48%	0.479	63%	0.632	S	S	.	*	H	α-helix	trans	-64.1	-43.3	174.4	175.9	0	0	0	0	110.9	P20 F27 F28	P20-V24 WeakPolarHBondContact O-CG2 3.39Å; P20-V24 PolarHBondContact O-N 3.49Å; P20-V24 VanDerWaalsContact O-N 3.14Å; V24-F27 PolarHBondContact O-N 2.89Å; V24-F28 HydrophobicContact CG1-CD2 3.72Å; V24-F28 HydrophobicContact CG1-CE2 3.9Å; V24-F28 WeakPolarHBondContact O-CB 3.48Å; V24-F28 WeakPolarHBondContact O-CD2 3.4Å; V24-F28 PolarHBondContact O-N 3Å
25	L	79.8	Confident	73.2	Confident	108 Å²	108	115.5 Å²	115.5	57%	0.565	62%	0.623	S	S	*	*	H	α-helix	trans	-62.3	-43.6	175	-87.1	158	0	0	0	112.6	A21 L22 F27 F28 L29	A21-L25 WeakPolarHBondContact O-CB 3.45Å; A21-L25 PolarHBondContact O-N 3.14Å; L22-L25 PolarHBondContact O-N 2.86Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 3.5Å; L25-F28 PolarHBondContact O-N 3.37Å; L25-L29 WeakPolarHBondContact O-CB 3.41Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 3.41Å
26	L	81.7	Confident	73.3	Confident	98 Å²	98	112.7 Å²	112.7	51%	0.513	61%	0.611	S	S	.	*	H	α-helix	trans	-62.6	-40.6	175.3	-108.3	142.7	0	0	0	111.8	L22 W23 L29 L30	L22-L26 WeakPolarHBondContact O-CB 3.4Å; L22-L26 PolarHBondContact O-N 3.4Å; W23-L26 PolarHBondContact O-N 3.29Å; L26-L29 PolarHBondContact O-N 2.87Å; L26-L30 HydrophobicContact CD2-CD1 4.48Å; L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 PolarHBondContact O-N 3.44Å
27	F	82.9	Confident	73	Confident	137 Å²	137	112.5 Å²	112.5	60%	0.601	61%	0.609	S	S	*	*	H	α-helix	trans	-68.5	-40.6	177.7	-157	-97.7	0	0	0	111.9	W23 V24 L25 L30 L31	W23-F27 WeakPolarHBondContact O-CB 3.47Å; W23-F27 PolarHBondContact O-N 3.3Å; V24-F27 PolarHBondContact O-N 2.89Å; L25-F27 VanDerWaalsContact C-N 3.33Å; L25-F27 PolarHBondContact O-N 3.5Å; F27-L30 PolarHBondContact O-N 2.87Å; F27-L31 HydrophobicContact CD1-CD1 3.55Å; F27-L31 HydrophobicContact CD1-CG 4.32Å; F27-L31 HydrophobicContact CE1-CD1 3.55Å; F27-L31 HydrophobicContact CE1-CG 4.23Å; F27-L31 WeakPolarHBondContact O-CB 3.39Å; F27-L31 PolarHBondContact O-N 3.4Å
28	F	80.5	Confident	72.5	Confident	129 Å²	129	115.8 Å²	115.8	57%	0.566	61%	0.614	S	S	*	*	H	α-helix	trans	-65.3	-38.7	173	-95.4	-79.2	0	0	0	112.4	V24 L25 L31 L32	V24-F28 HydrophobicContact CG1-CD2 3.72Å; V24-F28 HydrophobicContact CG1-CE2 3.9Å; V24-F28 WeakPolarHBondContact O-CB 3.48Å; V24-F28 WeakPolarHBondContact O-CD2 3.4Å; V24-F28 PolarHBondContact O-N 3Å; L25-F28 PolarHBondContact O-N 3.37Å; F28-L31 PolarHBondContact O-N 2.9Å; F28-L32 WeakPolarHBondContact O-CB 3.36Å; F28-L32 WeakPolarHBondContact O-CG 3.33Å; F28-L32 PolarHBondContact O-N 3.47Å
29	L	81.3	Confident	72.2	Confident	110 Å²	110	116.1 Å²	116.1	58%	0.576	62%	0.619	S	S	*	*	H	α-helix	trans	-65.7	-40.3	174	-82.5	160.8	0	0	0	112	L25 L26 L32 A33	L25-L29 WeakPolarHBondContact O-CB 3.41Å; L25-L29 WeakPolarHBondContact O-CG 3.37Å; L25-L29 PolarHBondContact O-N 3.41Å; L26-L29 PolarHBondContact O-N 2.87Å; L29-L32 PolarHBondContact O-N 3.46Å; L29-A33 VanDerWaalsContact O-CB 3.31Å; L29-A33 WeakPolarHBondContact O-CB 3.23Å; L29-A33 PolarHBondContact O-N 3.3Å
30	L	81.6	Confident	71.6	Confident	113 Å²	113	110.7 Å²	110.7	59%	0.592	62%	0.616	S	S	*	*	H	α-helix	trans	-66	-41	174.3	-95.5	148.2	0	0	0	112.2	L26 F27 A33 A34	L26-L30 HydrophobicContact CD2-CD1 4.48Å; L26-L30 WeakPolarHBondContact O-CB 3.34Å; L26-L30 PolarHBondContact O-N 3.44Å; F27-L30 PolarHBondContact O-N 2.87Å; L30-A33 PolarHBondContact O-N 2.88Å; L30-A34 WeakPolarHBondContact O-CB 3.34Å; L30-A34 PolarHBondContact O-N 3.38Å
31	L	78.7	Confident	70.7	Confident	92 Å²	92	110.4 Å²	110.4	48%	0.482	61%	0.614	S	S	.	*	H	α-helix	trans	-65.7	-41.7	174	-86.1	163.7	0	0	0	112.1	F27 F28 A33 A34 A35	F27-L31 HydrophobicContact CD1-CD1 3.55Å; F27-L31 HydrophobicContact CD1-CG 4.32Å; F27-L31 HydrophobicContact CE1-CD1 3.55Å; F27-L31 HydrophobicContact CE1-CG 4.23Å; F27-L31 WeakPolarHBondContact O-CB 3.39Å; F27-L31 PolarHBondContact O-N 3.4Å; F28-L31 PolarHBondContact O-N 2.9Å; L31-A33 VanDerWaalsContact C-N 3.34Å; L31-A34 PolarHBondContact O-N 3.41Å; L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 3.31Å; L31-A35 PolarHBondContact O-N 2.91Å
32	L	76.7	Confident	69.5	Low	97 Å²	97	115.1 Å²	115.1	51%	0.508	63%	0.631	S	S	.	*	H	α-helix	trans	-64.6	-38.3	174.4	-80.7	163.1	0	0	0	111.7	F28 L29 A35 M36	F28-L32 WeakPolarHBondContact O-CB 3.36Å; F28-L32 WeakPolarHBondContact O-CG 3.33Å; F28-L32 PolarHBondContact O-N 3.47Å; L29-L32 PolarHBondContact O-N 3.46Å; L32-A35 PolarHBondContact O-N 2.85Å; L32-M36 WeakPolarHBondContact O-CG 3.44Å; L32-M36 PolarHBondContact O-N 2.87Å
33	A	74.9	Confident	68.3	Low	72 Å²	72	115.5 Å²	115.5	60%	0.595	63%	0.634	S	S	*	*	H	α-helix	trans	-69.1	-33.5	175.2	0	0	0	0	0	112.7	L29 L30 L31	L29-A33 VanDerWaalsContact O-CB 3.31Å; L29-A33 WeakPolarHBondContact O-CB 3.23Å; L29-A33 PolarHBondContact O-N 3.3Å; L30-A33 PolarHBondContact O-N 2.88Å; L31-A33 VanDerWaalsContact C-N 3.34Å
34	A	74.8	Confident	67.6	Low	83 Å²	83	114.2 Å²	114.2	69%	0.686	64%	0.639	S	S	*	*	H	α-helix	trans	-79.1	-25.1	176.1	0	0	0	0	0	113.4	L30 L31	L30-A34 WeakPolarHBondContact O-CB 3.34Å; L30-A34 PolarHBondContact O-N 3.38Å; L31-A34 PolarHBondContact O-N 3.41Å
35	A	70.6	Confident	66.7	Low	76 Å²	76	116.4 Å²	116.4	63%	0.628	65%	0.647	S	S	*	*	S	Bend	trans	-84.8	-5.7	178.3	0	0	0	0	0	113.8	L31 L32 P37	L31-A35 VanDerWaalsContact O-CB 3.23Å; L31-A35 WeakPolarHBondContact O-CB 3.31Å; L31-A35 PolarHBondContact O-N 2.91Å; L32-A35 PolarHBondContact O-N 2.85Å; A35-P37 VanDerWaalsContact O-CD 3.31Å; A35-P37 WeakPolarHBondContact O-CD 3.31Å
36	M	60.7	Low	65.5	Low	125 Å²	125	118.2 Å²	118.2	62%	0.616	66%	0.657	S	S	*	*	S	Bend	trans	-74	117.3	170	-68.2	-63.2	154.9	0	0	108.9	L32 R38	L32-M36 WeakPolarHBondContact O-CG 3.44Å; L32-M36 PolarHBondContact O-N 2.87Å; M36-R38 PolarHBondContact O-N 2.96Å
37	P	54.7	Low	64.1	Low	112 Å²	112	118.9 Å²	118.9	73%	0.727	66%	0.661	S	S	*	*			trans	-61.6	112.4	175.9	20.7	-24.5	0	0	0	108.2	A35 S39	A35-P37 VanDerWaalsContact O-CD 3.31Å; A35-P37 WeakPolarHBondContact O-CD 3.31Å; P37-S39 PolarHBondContact O-N 2.97Å
38	R	51.3	Low	62.8	Low	246 Å²	246	123.4 Å²	123.4	93%	0.928	67%	0.674	S	S	*	*			trans	-64.7	83.4	164.8	-80.8	-179.5	175.2	149.3	-1.6	107.8	M36 A40	M36-R38 PolarHBondContact O-N 2.96Å; R38-A40 PolarHBondContact O-N 2.81Å
39	S	52.3	Low	61.8	Low	109 Å²	109	123.8 Å²	123.8	76%	0.762	68%	0.681	S	S	*	*			trans	-70.6	83.9	158.2	52.7	0	0	0	0	107.2	P37 P41	P37-S39 PolarHBondContact O-N 2.97Å; S39-P41 WeakPolarHBondContact O-CD 3.4Å
40	A	49.5	Very low	60.8	Low	82 Å²	82	123.6 Å²	123.6	68%	0.678	69%	0.687	S	S	*	*			trans	-76.8	118	166.1	0	0	0	0	0	107.8	R38	R38-A40 PolarHBondContact O-N 2.81Å
41	P	49.7	Very low	60.1	Low	95 Å²	95	124.1 Å²	124.1	62%	0.617	70%	0.697	S	S	*	*			trans	-70.5	146.3	162.7	26.3	-20.2	0	0	0	108.5	S39 D43	S39-P41 WeakPolarHBondContact O-CD 3.4Å; P41-D43 PolarHBondContact O-N 2.9Å
42	N	47.5	Very low	59.5	Low	162 Å²	162	126.9 Å²	126.9	87%	0.866	71%	0.707	S	S	*	*			trans	-67.5	92.9	178.6	-70.2	-49.3	0	0	0	110.5	I44	N42-I44 PolarHBondContact O-N 3.3Å
43	D	50.5	Low	59.2	Low	116 Å²	116	127.3 Å²	127.3	62%	0.62	72%	0.716	S	S	*	*			trans	-84.2	88.7	175.6	-70.3	-35.8	0	0	0	110.6	P41	P41-D43 PolarHBondContact O-N 2.9Å
44	I	60.5	Low	58.9	Low	157 Å²	157	129 Å²	129	81%	0.805	72%	0.718	S	S	*	*	S	Bend	trans	-88.9	-12.3	171.9	-91	172	0	0	0	112.6	N42	N42-I44 PolarHBondContact O-N 3.3Å
45	L	60.5	Low	58.9	Low	125 Å²	125	128.6 Å²	128.6	65%	0.654	70%	0.704	S	S	*	*	S	Bend	trans	-137.1	118.9	171.5	-61.5	166.3	0	0	0	104.9	L47	L45-L47 HydrophobicContact CB-CD1 4.08Å; L45-L47 PolarHBondContact O-N 3.28Å
46	D	54.1	Low	59.3	Low	147 Å²	147	129.1 Å²	129.1	79%	0.786	70%	0.696	S	S	*	*			trans	-67.7	43.3	179.3	-165.7	24.3	0	0	0	112.4	R48	D46-R48 PolarHBondContact O-N 3.28Å
47	L	53.4	Low	60.1	Low	112 Å²	112	124.3 Å²	124.3	59%	0.586	68%	0.677	S	S	*	*			trans	-82.7	96.1	164.6	-84.7	145.3	0	0	0	105.7	L45 L49	L45-L47 HydrophobicContact CB-CD1 4.08Å; L45-L47 PolarHBondContact O-N 3.28Å; L47-L49 HydrophobicContact CB-CG 4.34Å; L47-L49 PolarHBondContact O-N 2.95Å
48	R	54.3	Low	61.3	Low	232 Å²	232	124.6 Å²	124.6	88%	0.875	67%	0.672	S	S	*	*			trans	-60.6	77.3	159.8	-73.8	-174.3	-175	170.8	2.2	108.7	D46	D46-R48 PolarHBondContact O-N 3.28Å
49	L	61.2	Low	62.8	Low	136 Å²	136	116.4 Å²	116.4	71%	0.712	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-64.8	125	167.1	-71.2	169.4	0	0	0	105.7	L47	L47-L49 HydrophobicContact CB-CG 4.34Å; L47-L49 PolarHBondContact O-N 2.95Å
50	P	60.2	Low	64.4	Low	107 Å²	107	111.7 Å²	111.7	70%	0.695	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-53.3	134.1	174.9	20.6	-29.8	0	0	0	107.9	E52	P50-E52 PolarHBondContact O-N 3.38Å
51	P	65.5	Low	66.2	Low	124 Å²	124	107.8 Å²	107.8	81%	0.805	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-53.1	129.2	-179.4	21	-31.5	0	0	0	108.3
52	E	66.1	Low	67.8	Low	149 Å²	149	108.9 Å²	108.9	70%	0.696	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.9	132	177.8	-69.6	-166.2	162.1	0	0	108.4	P50 V54	P50-E52 PolarHBondContact O-N 3.38Å; E52-V54 PolarHBondContact O-N 3.35Å
53	P	70.6	Confident	69.5	Low	106 Å²	106	104.6 Å²	104.6	69%	0.688	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-59.2	130.5	-174.1	24	-33.3	0	0	0	109.1	L55	P53-L55 PolarHBondContact O-N 2.86Å
54	V	69.6	Low	70.9	Confident	108 Å²	108	99.3 Å²	99.3	66%	0.655	54%	0.536	S	S	*	.			trans	-64.9	108.6	177.3	-174.4	0	0	0	0	108.5	E52 N56	E52-V54 PolarHBondContact O-N 3.35Å; V54-N56 WeakPolarHBondContact CG1-OD1 3.39Å; V54-N56 PolarHBondContact O-N 3.22Å; V54-N56 VanDerWaalsContact O-N 3.1Å
55	L	74.5	Confident	71.7	Confident	75 Å²	75	94.8 Å²	94.8	39%	0.393	52%	0.516	S	S	.	.			trans	-78	91.5	-179.9	-68.7	162.8	0	0	0	109.6	P53 V60 D80 A83	P53-L55 PolarHBondContact O-N 2.86Å; L55-V60 HydrophobicContact CB-CG2 4.13Å; L55-V60 HydrophobicContact CD2-CG2 3.59Å; L55-V60 HydrophobicContact CG-CG2 4.47Å; L55-D80 HydrophobicContact CD1-CB 4.5Å; L55-A83 HydrophobicContact CD1-CB 4.13Å; L55-A83 HydrophobicContact CD2-CB 3.96Å
56	N	78	Confident	72.6	Confident	86 Å²	86	90.9 Å²	90.9	46%	0.46	51%	0.506	S	S	.	.			trans	-97.2	160.4	175	-69.4	-22.6	0	0	0	110.6	V54 N58 T59 V60	V54-N56 WeakPolarHBondContact CG1-OD1 3.39Å; V54-N56 PolarHBondContact O-N 3.22Å; V54-N56 VanDerWaalsContact O-N 3.1Å; N56-N58 PolarHBondContact O-N 3.4Å; N56-N58 VanDerWaalsContact O-N 3.15Å; N56-T59 PolarHBondContact N-OG1 3.04Å; N56-T59 PolarHBondContact O-N 2.97Å; N56-T59 PolarHBondContact O-OG1 3.23Å; N56-V60 PolarHBondContact O-N 2.99Å
57	A	78.9	Confident	74	Confident	24 Å²	24	85 Å²	85	20%	0.198	47%	0.474	C	S	.	.	H	α-helix	trans	-55	-35.6	177	0	0	0	0	0	112.7	T59 C61 L62 V76 P79	A57-T59 PolarHBondContact O-N 3.15Å; A57-C61 WeakPolarHBondContact O-CA 3.39Å; A57-C61 VanDerWaalsContact O-CB 3.25Å; A57-C61 WeakPolarHBondContact O-CB 3.34Å; A57-C61 PolarHBondContact O-N 2.84Å; A57-L62 PolarHBondContact O-N 3.48Å; A57-V76 HydrophobicContact CB-CG2 4.36Å; A57-P79 HydrophobicContact CB-CB 4.49Å
58	N	80	Confident	75.5	Confident	119 Å²	119	80.9 Å²	80.9	64%	0.636	46%	0.455	S	S	*	.	H	α-helix	trans	-68.2	-32.9	177.7	-64.8	-12	0	0	0	113.1	N56 L62	N56-N58 PolarHBondContact O-N 3.4Å; N56-N58 VanDerWaalsContact O-N 3.15Å; N58-L62 HydrophobicContact CB-CD1 4.22Å
59	T	82.9	Confident	77.1	Confident	74 Å²	74	79 Å²	79	45%	0.454	45%	0.448	S	S	.	.	H	α-helix	trans	-84.8	-27.5	-178.7	57.4	0	0	0	0	112.2	N56 A57 T63	N56-T59 PolarHBondContact N-OG1 3.04Å; N56-T59 PolarHBondContact O-N 2.97Å; N56-T59 PolarHBondContact O-OG1 3.23Å; A57-T59 PolarHBondContact O-N 3.15Å; T59-T63 WeakPolarHBondContact O-CG2 3.28Å; T59-T63 PolarHBondContact O-OG1 3.23Å
60	V	84.3	Confident	78.3	Confident	9 Å²	9	77.9 Å²	77.9	6%	0.055	44%	0.435	C	S	.	.	H	α-helix	trans	-99.9	-66.7	-179.3	-174.9	0	0	0	0	111	L55 N56 L62 T63 L64 P79 A82 A83 I86	L55-V60 HydrophobicContact CB-CG2 4.13Å; L55-V60 HydrophobicContact CD2-CG2 3.59Å; L55-V60 HydrophobicContact CG-CG2 4.47Å; N56-V60 PolarHBondContact O-N 2.99Å; V60-L62 PolarHBondContact O-N 3.1Å; V60-T63 PolarHBondContact O-N 2.97Å; V60-T63 PolarHBondContact O-OG1 3.18Å; V60-L64 HydrophobicContact CG1-CD1 4.32Å; V60-L64 WeakPolarHBondContact O-CD1 3.25Å; V60-L64 WeakPolarHBondContact O-CG 3.49Å; V60-P79 HydrophobicContact CB-CB 4.45Å; V60-A82 HydrophobicContact CG1-CB 4.39Å; V60-A83 HydrophobicContact CG1-CB 3.99Å; V60-A83 HydrophobicContact CG2-CB 4.1Å; V60-I86 HydrophobicContact CG1-CD1 4.29Å
61	C	87.1	Confident	79.7	Confident	1 Å²	1	72.9 Å²	72.9	1%	0.007	40%	0.402	C	S	.	.	G	3₁₀ helix	trans	-67.1	-39.8	-166.7	-52.1	0	0	0	0	113.3	A57 T63 L64 M72 C75	A57-C61 WeakPolarHBondContact O-CA 3.39Å; A57-C61 VanDerWaalsContact O-CB 3.25Å; A57-C61 WeakPolarHBondContact O-CB 3.34Å; A57-C61 PolarHBondContact O-N 2.84Å; C61-T63 VanDerWaalsContact C-N 3.28Å; C61-T63 PolarHBondContact O-N 2.96Å; C61-L64 PolarHBondContact O-N 3.03Å; C61-M72 HydrophobicContact CB-SD 3.71Å; C61-C75 WeakPolarHBondContact CA-SG 3Å; C61-C75 HydrophobicContact CB-CB 3.89Å; C61-C75 WeakPolarHBondContact CB-SG 3.41Å; C61-C75 WeakPolarHBondContact SG-CB 3.02Å; C61-C75 PolarHBondContact SG-O 3.21Å; C61-C75 CovalentContact SG-SG 2.03Å; C61-C75 PolarHBondContact SG-SG 2.91Å
62	L	83.8	Confident	80.9	Confident	117 Å²	117	69.5 Å²	69.5	61%	0.613	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-74.4	-17.3	179	-60.6	-179.4	0	0	0	113.3	A57 N58 V60 L64	A57-L62 PolarHBondContact O-N 3.48Å; N58-L62 HydrophobicContact CB-CD1 4.22Å; V60-L62 PolarHBondContact O-N 3.1Å; L62-L64 PolarHBondContact O-N 2.69Å
63	T	82.8	Confident	82.1	Confident	73 Å²	73	66.2 Å²	66.2	45%	0.448	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-83.7	0.2	176.5	69.7	0	0	0	0	113.1	T59 V60 C61 P65	T59-T63 WeakPolarHBondContact O-CG2 3.28Å; T59-T63 PolarHBondContact O-OG1 3.23Å; V60-T63 PolarHBondContact O-N 2.97Å; V60-T63 PolarHBondContact O-OG1 3.18Å; C61-T63 VanDerWaalsContact C-N 3.28Å; C61-T63 PolarHBondContact O-N 2.96Å; T63-P65 WeakPolarHBondContact O-CD 3.45Å
64	L	80.8	Confident	83.1	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.026	33%	0.334	C	S	.	.			trans	-109.9	89.2	-176.8	-61.8	163.6	0	0	0	109.4	V60 C61 L62 L67 I86 K115 I116	V60-L64 HydrophobicContact CG1-CD1 4.32Å; V60-L64 WeakPolarHBondContact O-CD1 3.25Å; V60-L64 WeakPolarHBondContact O-CG 3.49Å; C61-L64 PolarHBondContact O-N 3.03Å; L62-L64 PolarHBondContact O-N 2.69Å; L64-L67 HydrophobicContact CB-CD1 3.72Å; L64-L67 HydrophobicContact CB-CG 3.96Å; L64-L67 HydrophobicContact CD1-CD1 3.96Å; L64-I86 HydrophobicContact CD1-CD1 3.22Å; L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CD1 3.76Å; L64-I86 HydrophobicContact CD2-CG1 4.42Å; L64-I86 HydrophobicContact CG-CD1 4.09Å; L64-K115 HydrophobicContact CD2-CB 3.78Å; L64-K115 HydrophobicContact CD2-CD 3.71Å; L64-K115 HydrophobicContact CD2-CG 4.24Å; L64-I116 HydrophobicContact CB-CD1 4.12Å; L64-I116 HydrophobicContact CD2-CG1 4.32Å
65	P	77.3	Confident	84.1	Confident	62 Å²	62	57 Å²	57	40%	0.403	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	147	168.9	28.3	-34	0	0	0	109.4	T63 N114	T63-P65 WeakPolarHBondContact O-CD 3.45Å; P65-N114 HydrophobicContact CG-CB 3.93Å
66	G	78.2	Confident	85	Confident	43 Å²	43	57.4 Å²	57.4	44%	0.443	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	-0.9	174.7	0	0	0	0	0	116.6	S68 E119	G66-S68 PolarHBondContact O-N 3.36Å; G66-E119 WeakPolarHBondContact CA-OE1 3.43Å
67	L	83.6	Confident	85.7	Confident	22 Å²	22	61.8 Å²	61.8	12%	0.115	32%	0.318	C	S	.	.			trans	-64.9	123.9	172	-74.3	175.5	0	0	0	110.5	L64 Q71 M72 C75 I116 F228	L64-L67 HydrophobicContact CB-CD1 3.72Å; L64-L67 HydrophobicContact CB-CG 3.96Å; L64-L67 HydrophobicContact CD1-CD1 3.96Å; L67-Q71 HydrophobicContact CB-CB 4.37Å; L67-Q71 HydrophobicContact CD2-CB 3.72Å; L67-M72 HydrophobicContact CB-CE 4.06Å; L67-M72 HydrophobicContact CD1-CE 3.91Å; L67-M72 HydrophobicContact CD1-SD 4.26Å; L67-C75 HydrophobicContact CD1-CB 4.46Å; L67-I116 HydrophobicContact CD2-CD1 3.26Å; L67-I116 HydrophobicContact CG-CD1 3.64Å; L67-F228 HydrophobicContact CD2-CE2 3.92Å; L67-F228 HydrophobicContact CD2-CZ 3.85Å
68	S	85.3	Confident	86.3	Confident	26 Å²	26	64.1 Å²	64.1	18%	0.182	33%	0.325	C	S	.	.			trans	-64.4	159.3	169.1	63.2	0	0	0	0	110.8	G66 R70 Q71 M72	G66-S68 PolarHBondContact O-N 3.36Å; S68-R70 VanDerWaalsContact C-N 3.26Å; S68-R70 PolarHBondContact O-N 3.32Å; S68-Q71 WeakPolarHBondContact O-CA 3.43Å; S68-Q71 WeakPolarHBondContact O-CB 3.31Å; S68-Q71 PolarHBondContact O-N 3.17Å; S68-Q71 WeakPolarHBondContact OG-CG 3.38Å; S68-Q71 PolarHBondContact OG-OE1 2.69Å; S68-M72 PolarHBondContact O-N 3.31Å
69	R	87.5	Confident	86.9	Confident	192 Å²	192	59.5 Å²	59.5	73%	0.725	30%	0.301	S	S	*	.	H	α-helix	trans	-50	-45.5	-179.7	-179.6	-179.3	168.5	166.8	3.1	112.7	M72 E73	R69-M72 WeakPolarHBondContact O-CB 3.3Å; R69-M72 PolarHBondContact O-N 2.96Å; R69-E73 IonicContact NE-OE1 3.85Å; R69-E73 PolarHBondContact NE-OE1 3.09Å; R69-E73 WeakPolarHBondContact O-CG 3.01Å; R69-E73 PolarHBondContact O-N 3.06Å
70	R	87.4	Confident	87.3	Confident	114 Å²	114	57.1 Å²	57.1	43%	0.43	29%	0.285	S	S	.	.	H	α-helix	trans	-67.6	-37.9	178.5	-65.9	-179.5	176.9	-167.1	2.3	112.8	S68 M72 E73 V74 S231	S68-R70 VanDerWaalsContact C-N 3.26Å; S68-R70 PolarHBondContact O-N 3.32Å; R70-M72 VanDerWaalsContact C-N 3.32Å; R70-E73 PolarHBondContact O-N 3.41Å; R70-V74 WeakPolarHBondContact O-CG2 3.05Å; R70-V74 PolarHBondContact O-N 2.97Å; R70-S231 VanDerWaalsContact CD-O 3.23Å; R70-S231 WeakPolarHBondContact CD-O 3.31Å
71	Q	89.6	Confident	87.8	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-37.1	175	-66.9	175.3	-62.7	0	0	111.7	L67 S68 V74 C75 F228 S231	L67-Q71 HydrophobicContact CB-CB 4.37Å; L67-Q71 HydrophobicContact CD2-CB 3.72Å; S68-Q71 WeakPolarHBondContact O-CA 3.43Å; S68-Q71 WeakPolarHBondContact O-CB 3.31Å; S68-Q71 PolarHBondContact O-N 3.17Å; S68-Q71 WeakPolarHBondContact OG-CG 3.38Å; S68-Q71 PolarHBondContact OG-OE1 2.69Å; Q71-V74 PolarHBondContact O-N 3.08Å; Q71-C75 VanDerWaalsContact O-CB 3.31Å; Q71-C75 WeakPolarHBondContact O-CB 3.27Å; Q71-C75 PolarHBondContact O-N 3.2Å; Q71-F228 HydrophobicContact CB-CE2 4.34Å; Q71-F228 VanDerWaalsContact CG-O 3.3Å; Q71-F228 WeakPolarHBondContact CG-O 3.05Å; Q71-F228 PolarHBondContact NE2-O 3.47Å; Q71-S231 WeakPolarHBondContact CG-OG 3.48Å
72	M	90	Very high	88.1	Confident	53 Å²	53	56.6 Å²	56.6	26%	0.261	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-44.4	173	-172.8	63.1	73.6	0	0	111	C61 L67 S68 R69 R70 V74 C75 V76	C61-M72 HydrophobicContact CB-SD 3.71Å; L67-M72 HydrophobicContact CB-CE 4.06Å; L67-M72 HydrophobicContact CD1-CE 3.91Å; L67-M72 HydrophobicContact CD1-SD 4.26Å; S68-M72 PolarHBondContact O-N 3.31Å; R69-M72 WeakPolarHBondContact O-CB 3.3Å; R69-M72 PolarHBondContact O-N 2.96Å; R70-M72 VanDerWaalsContact C-N 3.32Å; M72-V74 VanDerWaalsContact C-N 3.34Å; M72-V74 PolarHBondContact O-N 3.04Å; M72-C75 PolarHBondContact O-N 3.36Å; M72-V76 HydrophobicContact CG-CG2 4.33Å; M72-V76 WeakPolarHBondContact O-CB 3.39Å; M72-V76 VanDerWaalsContact O-CG2 3.28Å; M72-V76 WeakPolarHBondContact O-CG2 3.42Å; M72-V76 PolarHBondContact O-N 3.23Å; M72-V76 HydrophobicContact SD-CG2 4.26Å
73	E	91.3	Very high	88.5	Confident	80 Å²	80	52.2 Å²	52.2	37%	0.374	26%	0.263	S	S	.	.	H	α-helix	trans	-58.8	-42.8	175.4	-72.7	169.1	-165.8	0	0	112.2	R69 R70 R77	R69-E73 IonicContact NE-OE1 3.85Å; R69-E73 PolarHBondContact NE-OE1 3.09Å; R69-E73 WeakPolarHBondContact O-CG 3.01Å; R69-E73 PolarHBondContact O-N 3.06Å; R70-E73 PolarHBondContact O-N 3.41Å; E73-R77 WeakPolarHBondContact O-CG 3.49Å; E73-R77 PolarHBondContact O-N 3.39Å
74	V	91.8	Very high	89	Confident	22 Å²	22	49.4 Å²	49.4	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-66.5	-42.5	175.3	175	0	0	0	0	111.4	R70 Q71 M72 R77 H78 F224 D227 F228	R70-V74 WeakPolarHBondContact O-CG2 3.05Å; R70-V74 PolarHBondContact O-N 2.97Å; Q71-V74 PolarHBondContact O-N 3.08Å; M72-V74 VanDerWaalsContact C-N 3.34Å; M72-V74 PolarHBondContact O-N 3.04Å; V74-R77 PolarHBondContact O-N 2.85Å; V74-H78 PolarHBondContact O-N 3.2Å; V74-F224 HydrophobicContact CG1-CD2 4.45Å; V74-F224 HydrophobicContact CG1-CE2 3.86Å; V74-F224 HydrophobicContact CG1-CZ 4.22Å; V74-D227 HydrophobicContact CG2-CB 4.16Å; V74-F228 HydrophobicContact CG1-CB 4.42Å; V74-F228 HydrophobicContact CG1-CD2 4.26Å
75	C	92	Very high	89.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.4	-43.9	179.3	-171.6	0	0	0	0	111.9	C61 L67 Q71 M72 R77 H78 P79 A82	C61-C75 WeakPolarHBondContact CA-SG 3Å; C61-C75 HydrophobicContact CB-CB 3.89Å; C61-C75 WeakPolarHBondContact CB-SG 3.41Å; C61-C75 WeakPolarHBondContact SG-CB 3.02Å; C61-C75 PolarHBondContact SG-O 3.21Å; C61-C75 CovalentContact SG-SG 2.03Å; C61-C75 PolarHBondContact SG-SG 2.91Å; L67-C75 HydrophobicContact CD1-CB 4.46Å; Q71-C75 VanDerWaalsContact O-CB 3.31Å; Q71-C75 WeakPolarHBondContact O-CB 3.27Å; Q71-C75 PolarHBondContact O-N 3.2Å; M72-C75 PolarHBondContact O-N 3.36Å; C75-R77 VanDerWaalsContact C-N 3.29Å; C75-R77 PolarHBondContact O-N 3.27Å; C75-H78 CarbonylContact O-C 3.19Å; C75-H78 PolarHBondContact O-N 2.88Å; C75-P79 VanDerWaalsContact O-CA 3.31Å; C75-P79 WeakPolarHBondContact O-CA 3.39Å; C75-A82 HydrophobicContact CB-CB 4.17Å; C75-A82 WeakPolarHBondContact SG-CB 3.49Å
76	V	92.3	Very high	90.3	Very high	82 Å²	82	46.6 Å²	46.6	50%	0.497	23%	0.228	S	C	.	.	H	α-helix	trans	-64.8	-33.7	179.8	171.1	0	0	0	0	111.6	A57 M72	A57-V76 HydrophobicContact CB-CG2 4.36Å; M72-V76 HydrophobicContact CG-CG2 4.33Å; M72-V76 WeakPolarHBondContact O-CB 3.39Å; M72-V76 VanDerWaalsContact O-CG2 3.28Å; M72-V76 WeakPolarHBondContact O-CG2 3.42Å; M72-V76 PolarHBondContact O-N 3.23Å; M72-V76 HydrophobicContact SD-CG2 4.26Å
77	R	92.1	Very high	91	Very high	179 Å²	179	49.9 Å²	49.9	68%	0.675	23%	0.232	S	C	*	.	H	α-helix	trans	-67.9	-38	175.2	-71.9	175.7	-170.3	177.7	5	112.7	E73 V74 C75	E73-R77 WeakPolarHBondContact O-CG 3.49Å; E73-R77 PolarHBondContact O-N 3.39Å; V74-R77 PolarHBondContact O-N 2.85Å; C75-R77 VanDerWaalsContact C-N 3.29Å; C75-R77 PolarHBondContact O-N 3.27Å
78	H	92.2	Very high	91.5	Very high	73 Å²	73	48.9 Å²	48.9	34%	0.338	23%	0.226	S	C	.	.			trans	-140.3	74.1	-174.8	-60.6	-61.4	0	0	0	111.8	V74 C75 D80 V81 A82 F224	V74-H78 PolarHBondContact O-N 3.2Å; C75-H78 CarbonylContact O-C 3.19Å; C75-H78 PolarHBondContact O-N 2.88Å; H78-D80 PolarHBondContact O-N 2.96Å; H78-V81 HydrophobicContact CB-CB 3.92Å; H78-V81 HydrophobicContact CB-CG2 3.78Å; H78-V81 PolarHBondContact O-N 3.47Å; H78-A82 WeakPolarHBondContact O-CB 3.12Å; H78-A82 PolarHBondContact O-N 3.35Å; H78-F224 HydrophobicContact CB-CE2 4.23Å
79	P	92.9	Very high	91.9	Very high	22 Å²	22	47.6 Å²	47.6	14%	0.143	22%	0.218	C	C	.	.	H	α-helix	trans	-69	-32.4	-174.6	26.4	-34.6	0	0	0	113.3	A57 V60 C75 A82 A83	A57-P79 HydrophobicContact CB-CB 4.49Å; V60-P79 HydrophobicContact CB-CB 4.45Å; C75-P79 VanDerWaalsContact O-CA 3.31Å; C75-P79 WeakPolarHBondContact O-CA 3.39Å; P79-A82 PolarHBondContact O-N 3.5Å; P79-A83 PolarHBondContact O-N 3.43Å
80	D	91.9	Very high	92.1	Very high	23 Å²	23	43.3 Å²	43.3	12%	0.123	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-43.9	174.2	59.6	-26.8	0	0	0	111.6	L55 H78 A83 S84 L154 K155	L55-D80 HydrophobicContact CD1-CB 4.5Å; H78-D80 PolarHBondContact O-N 2.96Å; D80-A83 PolarHBondContact O-N 3.36Å; D80-S84 PolarHBondContact O-N 2.02Å; D80-S84 PolarHBondContact O-OG 2.02Å; D80-L154 VanDerWaalsContact C-CD2 3.49Å; D80-L154 HydrophobicContact CB-CD2 3.91Å; D80-L154 WeakPolarHBondContact O-CD2 3.32Å; D80-K155 PolarHBondContact OD2-N 3.06Å
81	V	94.7	Very high	92.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-68.1	-40.8	176.6	-168.7	0	0	0	0	110.9	H78 A83 S84 A85 V145 L154 A156 F220 F224	H78-V81 HydrophobicContact CB-CB 3.92Å; H78-V81 HydrophobicContact CB-CG2 3.78Å; H78-V81 PolarHBondContact O-N 3.47Å; V81-A83 PolarHBondContact O-N 3.42Å; V81-S84 PolarHBondContact O-N 3.43Å; V81-A85 WeakPolarHBondContact O-CB 3.29Å; V81-A85 PolarHBondContact O-N 3.44Å; V81-V145 HydrophobicContact CG1-CG1 3.71Å; V81-V145 HydrophobicContact CG1-CG2 4.04Å; V81-L154 HydrophobicContact CG1-CD1 4.33Å; V81-L154 HydrophobicContact CG2-CD1 4.17Å; V81-L154 HydrophobicContact CG2-CD2 4.24Å; V81-A156 HydrophobicContact CG2-CB 3.85Å; V81-F220 HydrophobicContact CG1-CE1 3.87Å; V81-F220 HydrophobicContact CG1-CZ 4.29Å; V81-F220 HydrophobicContact CG2-CE1 4.22Å; V81-F220 HydrophobicContact CG2-CZ 4.07Å; V81-F224 HydrophobicContact CB-CD2 4.08Å; V81-F224 HydrophobicContact CB-CE2 3.68Å; V81-F224 HydrophobicContact CB-CZ 3.96Å; V81-F224 HydrophobicContact CG1-CB 4.43Å; V81-F224 HydrophobicContact CG1-CD1 3.79Å; V81-F224 HydrophobicContact CG1-CD2 3.39Å; V81-F224 HydrophobicContact CG1-CE1 3.86Å; V81-F224 HydrophobicContact CG1-CE2 3.43Å; V81-F224 VanDerWaalsContact CG1-CE2 3.43Å; V81-F224 HydrophobicContact CG1-CG 3.57Å; V81-F224 HydrophobicContact CG1-CZ 3.67Å
82	A	93	Very high	92.8	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.2	-42.5	175.9	0	0	0	0	0	112	V60 C75 H78 P79 S84 A85 I86 F224	V60-A82 HydrophobicContact CG1-CB 4.39Å; C75-A82 HydrophobicContact CB-CB 4.17Å; C75-A82 WeakPolarHBondContact SG-CB 3.49Å; H78-A82 WeakPolarHBondContact O-CB 3.12Å; H78-A82 PolarHBondContact O-N 3.35Å; P79-A82 PolarHBondContact O-N 3.5Å; A82-S84 VanDerWaalsContact C-N 3.32Å; A82-S84 PolarHBondContact O-N 2.99Å; A82-A85 WeakPolarHBondContact O-CB 3.44Å; A82-A85 PolarHBondContact O-N 3.47Å; A82-I86 WeakPolarHBondContact O-CD1 3.43Å; A82-I86 VanDerWaalsContact O-CG1 3.27Å; A82-I86 WeakPolarHBondContact O-CG1 3.18Å; A82-I86 PolarHBondContact O-N 3.25Å; A82-F224 HydrophobicContact CB-CZ 4.27Å
83	A	91.6	Very high	93	Very high	24 Å²	24	39.3 Å²	39.3	20%	0.198	19%	0.193	C	C	.	.	H	α-helix	trans	-58	-44.5	174.3	0	0	0	0	0	111.9	L55 V60 P79 D80 V81 I86 Q87	L55-A83 HydrophobicContact CD1-CB 4.13Å; L55-A83 HydrophobicContact CD2-CB 3.96Å; V60-A83 HydrophobicContact CG1-CB 3.99Å; V60-A83 HydrophobicContact CG2-CB 4.1Å; P79-A83 PolarHBondContact O-N 3.43Å; D80-A83 PolarHBondContact O-N 3.36Å; V81-A83 PolarHBondContact O-N 3.42Å; A83-I86 PolarHBondContact O-N 3.18Å; A83-Q87 PolarHBondContact O-N 2.03Å; A83-Q87 VanDerWaalsContact O-N 3.12Å
84	S	94	Very high	93.1	Very high	14 Å²	14	41.2 Å²	41.2	10%	0.098	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-37.9	176.7	-62.2	0	0	0	0	112.6	D80 V81 A82 I86 Q87 G88 A144	D80-S84 PolarHBondContact O-N 2.02Å; D80-S84 PolarHBondContact O-OG 2.02Å; V81-S84 PolarHBondContact O-N 3.43Å; A82-S84 VanDerWaalsContact C-N 3.32Å; A82-S84 PolarHBondContact O-N 2.99Å; S84-I86 VanDerWaalsContact C-N 3.35Å; S84-I86 PolarHBondContact O-N 3.05Å; S84-Q87 PolarHBondContact O-N 2.99Å; S84-G88 PolarHBondContact O-N 3.47Å; S84-A144 WeakPolarHBondContact O-CB 3.23Å
85	A	94.3	Very high	93.4	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-63.1	-40.8	175.9	0	0	0	0	0	112.1	V81 A82 G88 I89 V141 V145 F224	V81-A85 WeakPolarHBondContact O-CB 3.29Å; V81-A85 PolarHBondContact O-N 3.44Å; A82-A85 WeakPolarHBondContact O-CB 3.44Å; A82-A85 PolarHBondContact O-N 3.47Å; A85-G88 CarbonylContact O-C 3.48Å; A85-G88 WeakPolarHBondContact O-CA 3.36Å; A85-G88 PolarHBondContact O-N 3.1Å; A85-G88 VanDerWaalsContact O-N 3.12Å; A85-I89 WeakPolarHBondContact O-CG1 3.39Å; A85-I89 PolarHBondContact O-N 3.19Å; A85-V141 HydrophobicContact CB-CB 4.48Å; A85-V141 HydrophobicContact CB-CG1 3.72Å; A85-V141 HydrophobicContact CB-CG2 4.17Å; A85-V145 HydrophobicContact CB-CG2 3.92Å; A85-F224 HydrophobicContact CB-CD1 4.24Å; A85-F224 HydrophobicContact CB-CE1 3.57Å
86	I	91.3	Very high	93.6	Very high	9 Å²	9	40.5 Å²	40.5	5%	0.046	20%	0.197	C	C	.	.	H	α-helix	trans	-65.8	-42.1	177.4	-66	151.6	0	0	0	111.2	V60 L64 A82 A83 S84 G88 I89 Q90 K115	V60-I86 HydrophobicContact CG1-CD1 4.29Å; L64-I86 HydrophobicContact CD1-CD1 3.22Å; L64-I86 HydrophobicContact CD1-CG1 4.33Å; L64-I86 HydrophobicContact CD2-CD1 3.76Å; L64-I86 HydrophobicContact CD2-CG1 4.42Å; L64-I86 HydrophobicContact CG-CD1 4.09Å; A82-I86 WeakPolarHBondContact O-CD1 3.43Å; A82-I86 VanDerWaalsContact O-CG1 3.27Å; A82-I86 WeakPolarHBondContact O-CG1 3.18Å; A82-I86 PolarHBondContact O-N 3.25Å; A83-I86 PolarHBondContact O-N 3.18Å; S84-I86 VanDerWaalsContact C-N 3.35Å; S84-I86 PolarHBondContact O-N 3.05Å; I86-G88 PolarHBondContact O-N 3.3Å; I86-I89 WeakPolarHBondContact O-CB 3.47Å; I86-I89 PolarHBondContact O-N 2.85Å; I86-I89 VanDerWaalsContact O-N 3.11Å; I86-Q90 PolarHBondContact O-N 3.3Å; I86-K115 HydrophobicContact CG2-CB 3.49Å; I86-K115 VanDerWaalsContact CG2-CB 3.49Å; I86-K115 HydrophobicContact CG2-CD 3.96Å; I86-K115 HydrophobicContact CG2-CG 4.18Å
87	Q	92.4	Very high	93.7	Very high	112 Å²	112	38.4 Å²	38.4	52%	0.523	18%	0.182	S	C	.	.	H	α-helix	trans	-57.7	-41.1	171.4	-172.8	-178.2	5	0	0	110.9	A83 S84 I89 Q90 I91	A83-Q87 PolarHBondContact O-N 2.03Å; A83-Q87 VanDerWaalsContact O-N 3.12Å; S84-Q87 PolarHBondContact O-N 2.99Å; Q87-I89 VanDerWaalsContact C-N 3.34Å; Q87-I89 PolarHBondContact O-N 3.21Å; Q87-Q90 WeakPolarHBondContact O-CB 3.42Å; Q87-Q90 PolarHBondContact O-N 3.16Å; Q87-I91 HydrophobicContact CG-CD1 4.44Å; Q87-I91 WeakPolarHBondContact O-CG1 3.02Å; Q87-I91 PolarHBondContact O-N 3.42Å
88	G	94.8	Very high	93.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-40	173.7	0	0	0	0	0	114	S84 A85 I86 Q90 I91 A92 G140	S84-G88 PolarHBondContact O-N 3.47Å; A85-G88 CarbonylContact O-C 3.48Å; A85-G88 WeakPolarHBondContact O-CA 3.36Å; A85-G88 PolarHBondContact O-N 3.1Å; A85-G88 VanDerWaalsContact O-N 3.12Å; I86-G88 PolarHBondContact O-N 3.3Å; G88-Q90 VanDerWaalsContact C-N 3.35Å; G88-I91 PolarHBondContact O-N 3.34Å; G88-A92 WeakPolarHBondContact O-CB 3.3Å; G88-A92 PolarHBondContact O-N 3.44Å; G88-G140 WeakPolarHBondContact CA-O 3.46Å; G88-G140 WeakPolarHBondContact O-CA 3.23Å
89	I	93.3	Very high	94	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-65.3	-38.8	175	-65.8	168.2	0	0	0	111	A85 I86 Q87 A92 I93 P117 V141 L229	A85-I89 WeakPolarHBondContact O-CG1 3.39Å; A85-I89 PolarHBondContact O-N 3.19Å; I86-I89 WeakPolarHBondContact O-CB 3.47Å; I86-I89 PolarHBondContact O-N 2.85Å; I86-I89 VanDerWaalsContact O-N 3.11Å; Q87-I89 VanDerWaalsContact C-N 3.34Å; Q87-I89 PolarHBondContact O-N 3.21Å; I89-A92 WeakPolarHBondContact O-CA 3.46Å; I89-A92 WeakPolarHBondContact O-CB 3.47Å; I89-A92 PolarHBondContact O-N 3.25Å; I89-I93 HydrophobicContact CG2-CD1 3.93Å; I89-I93 HydrophobicContact CG2-CG1 4.45Å; I89-I93 WeakPolarHBondContact O-CG1 3.26Å; I89-I93 PolarHBondContact O-N 3.46Å; I89-P117 HydrophobicContact CG2-CG 3.72Å; I89-V141 HydrophobicContact CD1-CG2 3.99Å; I89-V141 HydrophobicContact CG1-CG2 3.61Å; I89-L229 HydrophobicContact CD1-CD2 4.45Å
90	Q	92.4	Very high	94.1	Very high	101 Å²	101	29.9 Å²	29.9	47%	0.472	15%	0.148	S	C	.	.	H	α-helix	trans	-64.8	-43.8	176.3	-68.7	178.7	-31.5	0	0	112.1	I86 Q87 G88 A92 I93 H94	I86-Q90 PolarHBondContact O-N 3.3Å; Q87-Q90 WeakPolarHBondContact O-CB 3.42Å; Q87-Q90 PolarHBondContact O-N 3.16Å; G88-Q90 VanDerWaalsContact C-N 3.35Å; Q90-A92 PolarHBondContact O-N 3.36Å; Q90-I93 PolarHBondContact O-N 2.97Å; Q90-H94 PolarHBondContact O-N 2.64Å
91	I	94.3	Very high	94.2	Very high	64 Å²	64	36 Å²	36	33%	0.328	17%	0.169	S	C	.	.	H	α-helix	trans	-57.8	-41	172.7	-64.5	169.7	0	0	0	110	Q87 G88 H94 E95 F283	Q87-I91 HydrophobicContact CG-CD1 4.44Å; Q87-I91 WeakPolarHBondContact O-CG1 3.02Å; Q87-I91 PolarHBondContact O-N 3.42Å; G88-I91 PolarHBondContact O-N 3.34Å; I91-H94 PolarHBondContact O-N 3.39Å; I91-E95 WeakPolarHBondContact O-CB 3.27Å; I91-E95 PolarHBondContact O-N 2.97Å; I91-F283 HydrophobicContact CG2-CB 4.23Å; I91-F283 HydrophobicContact CG2-CD1 3.66Å; I91-F283 HydrophobicContact CG2-CD2 4.44Å; I91-F283 HydrophobicContact CG2-CE1 4.16Å; I91-F283 HydrophobicContact CG2-CG 3.82Å
92	A	96	Very high	94	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-41.9	176.5	0	0	0	0	0	114	G88 I89 Q90 E95 C96 I136 F283	G88-A92 WeakPolarHBondContact O-CB 3.3Å; G88-A92 PolarHBondContact O-N 3.44Å; I89-A92 WeakPolarHBondContact O-CA 3.46Å; I89-A92 WeakPolarHBondContact O-CB 3.47Å; I89-A92 PolarHBondContact O-N 3.25Å; Q90-A92 PolarHBondContact O-N 3.36Å; A92-E95 PolarHBondContact O-N 3.31Å; A92-C96 WeakPolarHBondContact O-CB 3.03Å; A92-C96 PolarHBondContact O-N 3.17Å; A92-I136 HydrophobicContact CB-CG1 4Å; A92-I136 HydrophobicContact CB-CG2 4.43Å; A92-I136 WeakPolarHBondContact CB-O 3.25Å; A92-F283 HydrophobicContact CB-CE1 4.2Å; A92-F283 HydrophobicContact CB-CZ 3.88Å
93	I	93.6	Very high	94	Very high	19 Å²	19	41.8 Å²	41.8	10%	0.097	20%	0.198	C	C	.	.	H	α-helix	trans	-67.3	-44.3	178.2	-66.8	161.1	0	0	0	110.5	I89 Q90 E95 C96 Q97 L110 E111 P117	I89-I93 HydrophobicContact CG2-CD1 3.93Å; I89-I93 HydrophobicContact CG2-CG1 4.45Å; I89-I93 WeakPolarHBondContact O-CG1 3.26Å; I89-I93 PolarHBondContact O-N 3.46Å; Q90-I93 PolarHBondContact O-N 2.97Å; I93-E95 VanDerWaalsContact C-N 3.3Å; I93-E95 PolarHBondContact O-N 3.25Å; I93-C96 WeakPolarHBondContact O-CA 3.41Å; I93-C96 VanDerWaalsContact O-CB 3.29Å; I93-C96 WeakPolarHBondContact O-CB 3.47Å; I93-C96 PolarHBondContact O-N 3.44Å; I93-C96 VanDerWaalsContact O-N 3.1Å; I93-Q97 WeakPolarHBondContact O-CG 3.49Å; I93-Q97 PolarHBondContact O-N 2.85Å; I93-L110 HydrophobicContact CG1-CB 4.23Å; I93-L110 HydrophobicContact CG2-CB 4.09Å; I93-E111 HydrophobicContact CG2-CB 4.3Å; I93-P117 HydrophobicContact CD1-CB 3.99Å; I93-P117 HydrophobicContact CD1-CG 4.17Å
94	H	94.6	Very high	94	Very high	120 Å²	120	43.9 Å²	43.9	56%	0.556	20%	0.201	S	C	*	.	H	α-helix	trans	-62.1	-39.7	177	-178.2	-97.6	0	0	0	111.7	Q90 I91 Q97 H98	Q90-H94 PolarHBondContact O-N 2.64Å; I91-H94 PolarHBondContact O-N 3.39Å; H94-Q97 PolarHBondContact O-N 2.64Å; H94-H98 PolarHBondContact O-N 2.87Å
95	E	97.2	Very high	94	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-69	-34.8	173.7	-174.9	56.4	-153.2	0	0	112.4	I91 A92 I93 H98 Q99 I136 F283 R284	I91-E95 WeakPolarHBondContact O-CB 3.27Å; I91-E95 PolarHBondContact O-N 2.97Å; A92-E95 PolarHBondContact O-N 3.31Å; I93-E95 VanDerWaalsContact C-N 3.3Å; I93-E95 PolarHBondContact O-N 3.25Å; E95-H98 WeakPolarHBondContact O-CB 3.28Å; E95-H98 PolarHBondContact O-N 3.41Å; E95-H98 IonicContact OE1-CD2 3.48Å; E95-Q99 HydrophobicContact CG-CG 4.43Å; E95-Q99 VanDerWaalsContact O-CG 3.28Å; E95-Q99 WeakPolarHBondContact O-CG 3.44Å; E95-Q99 PolarHBondContact O-N 3.41Å; E95-Q99 PolarHBondContact OE1-NE2 2.96Å; E95-I136 HydrophobicContact CG-CD1 4.44Å; E95-F283 HydrophobicContact CB-CD1 3.64Å; E95-F283 HydrophobicContact CB-CE1 3.55Å; E95-F283 HydrophobicContact CG-CD1 3.75Å; E95-F283 HydrophobicContact CG-CE1 3.81Å; E95-R284 WeakPolarHBondContact OE1-CD 3.46Å; E95-R284 IonicContact OE1-NE 2.72Å; E95-R284 PolarHBondContact OE1-NE 3.34Å; E95-R284 VanDerWaalsContact OE1-NE 3.1Å; E95-R284 IonicContact OE2-CZ 3.1Å; E95-R284 IonicContact OE2-NE 2.92Å; E95-R284 PolarHBondContact OE2-NE 2.94Å; E95-R284 IonicContact OE2-NH2 3.94Å; E95-R284 PolarHBondContact OE2-NH2 3.37Å
96	C	96	Very high	93.8	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.5	-47.6	172.8	-177.1	0	0	0	0	111.3	A92 I93 H98 Q99 F100 C107 F132 I136	A92-C96 WeakPolarHBondContact O-CB 3.03Å; A92-C96 PolarHBondContact O-N 3.17Å; I93-C96 WeakPolarHBondContact O-CA 3.41Å; I93-C96 VanDerWaalsContact O-CB 3.29Å; I93-C96 WeakPolarHBondContact O-CB 3.47Å; I93-C96 PolarHBondContact O-N 3.44Å; I93-C96 VanDerWaalsContact O-N 3.1Å; C96-H98 VanDerWaalsContact C-N 3.28Å; C96-H98 PolarHBondContact O-N 3.21Å; C96-Q99 PolarHBondContact O-N 3.05Å; C96-F100 WeakPolarHBondContact O-CB 2.97Å; C96-F100 WeakPolarHBondContact O-CD2 3.12Å; C96-F100 PolarHBondContact O-N 3.4Å; C96-C107 HydrophobicContact CB-CB 3.9Å; C96-C107 WeakPolarHBondContact CB-SG 3.44Å; C96-C107 WeakPolarHBondContact SG-CB 3.29Å; C96-C107 CovalentContact SG-SG 2.03Å; C96-C107 PolarHBondContact SG-SG 2.91Å; C96-F132 HydrophobicContact CB-CE1 4.03Å; C96-I136 HydrophobicContact CB-CG2 4.34Å
97	Q	94.8	Very high	93.8	Very high	38 Å²	38	45.1 Å²	45.1	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-41.3	174.3	-68.8	173.9	-12.7	0	0	111.4	I93 H94 F100 R101 N106 C107 E111	I93-Q97 WeakPolarHBondContact O-CG 3.49Å; I93-Q97 PolarHBondContact O-N 2.85Å; H94-Q97 PolarHBondContact O-N 2.64Å; Q97-F100 PolarHBondContact O-N 2.82Å; Q97-R101 WeakPolarHBondContact O-CA 3.39Å; Q97-R101 WeakPolarHBondContact O-CB 3.06Å; Q97-R101 PolarHBondContact O-N 3.31Å; Q97-N106 WeakPolarHBondContact CA-O 3.27Å; Q97-C107 HydrophobicContact CG-CB 4.11Å; Q97-E111 PolarHBondContact NE2-OE2 3.29Å
98	H	96	Very high	93.5	Very high	57 Å²	57	42.2 Å²	42.2	26%	0.264	20%	0.198	S	C	.	.	H	α-helix	trans	-61.1	-48.6	175.7	-177.6	77.4	0	0	0	112.7	H94 E95 C96 F100 R101 R284	H94-H98 PolarHBondContact O-N 2.87Å; E95-H98 WeakPolarHBondContact O-CB 3.28Å; E95-H98 PolarHBondContact O-N 3.41Å; E95-H98 IonicContact OE1-CD2 3.48Å; C96-H98 VanDerWaalsContact C-N 3.28Å; C96-H98 PolarHBondContact O-N 3.21Å; H98-F100 VanDerWaalsContact C-N 3.27Å; H98-F100 PolarHBondContact O-N 3.46Å; H98-R101 WeakPolarHBondContact O-CG 2.84Å; H98-R284 PolarHBondContact CD2-NE 2.81Å; H98-R284 VanDerWaalsContact CD2-NE 3.29Å; H98-R284 PolarHBondContact CE1-NH1 3.42Å; H98-R284 VanDerWaalsContact CE1-NH1 3.28Å; H98-R284 PolarHBondContact NE2-NH1 2.91Å
99	Q	96.2	Very high	92.9	Very high	35 Å²	35	43.6 Å²	43.6	16%	0.164	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-26.1	-178.7	-67.9	-66.3	-27	0	0	113.1	E95 C96 F132	E95-Q99 HydrophobicContact CG-CG 4.43Å; E95-Q99 VanDerWaalsContact O-CG 3.28Å; E95-Q99 WeakPolarHBondContact O-CG 3.44Å; E95-Q99 PolarHBondContact O-N 3.41Å; E95-Q99 PolarHBondContact OE1-NE2 2.96Å; C96-Q99 PolarHBondContact O-N 3.05Å; Q99-F132 HydrophobicContact CB-CZ 4.4Å; Q99-F132 HydrophobicContact CG-CZ 4.44Å
100	F	94.6	Very high	92.5	Very high	3 Å²	3	43.8 Å²	43.8	1%	0.013	21%	0.209	C	C	.	.	H	α-helix	trans	-111.9	9	-175.4	-76.2	-100.9	0	0	0	114.3	C96 Q97 H98 D102 Q103 W105 F132 F294	C96-F100 WeakPolarHBondContact O-CB 2.97Å; C96-F100 WeakPolarHBondContact O-CD2 3.12Å; C96-F100 PolarHBondContact O-N 3.4Å; Q97-F100 PolarHBondContact O-N 2.82Å; H98-F100 VanDerWaalsContact C-N 3.27Å; H98-F100 PolarHBondContact O-N 3.46Å; F100-D102 PolarHBondContact O-N 3.22Å; F100-Q103 HydrophobicContact CB-CB 4.45Å; F100-Q103 HydrophobicContact CD1-CB 4.06Å; F100-Q103 HydrophobicContact CD1-CG 4.02Å; F100-Q103 PolarHBondContact O-N 3.29Å; F100-W105 WeakPolarHBondContact CB-O 3.36Å; F100-W105 AromaticContact CD1-CE3 3.51Å; F100-W105 HydrophobicContact CD1-CE3 3.51Å; F100-W105 AromaticContact CD1-CZ3 3.79Å; F100-W105 HydrophobicContact CD1-CZ3 3.79Å; F100-W105 WeakPolarHBondContact CD1-O 3.41Å; F100-W105 HydrophobicContact CD2-CZ3 4.13Å; F100-W105 AromaticContact CE1-CE3 3.64Å; F100-W105 HydrophobicContact CE1-CE3 3.64Å; F100-W105 AromaticContact CE1-CZ3 3.7Å; F100-W105 HydrophobicContact CE1-CZ3 3.7Å; F100-W105 HydrophobicContact CE2-CZ3 4.11Å; F100-W105 HydrophobicContact CG-CE3 4.01Å; F100-W105 AromaticContact CG-CZ3 3.99Å; F100-W105 HydrophobicContact CG-CZ3 3.99Å; F100-W105 HydrophobicContact CZ-CE3 4.29Å; F100-W105 AromaticContact CZ-CZ3 3.87Å; F100-W105 HydrophobicContact CZ-CZ3 3.87Å; F100-F132 HydrophobicContact CD2-CD1 4.37Å; F100-F132 HydrophobicContact CD2-CE1 4.1Å; F100-F132 HydrophobicContact CD2-CZ 4.48Å; F100-F132 AromaticContact CE2-CD1 3.47Å; F100-F132 HydrophobicContact CE2-CD1 3.47Å; F100-F132 VanDerWaalsContact CE2-CD1 3.47Å; F100-F132 HydrophobicContact CE2-CD2 4.11Å; F100-F132 AromaticContact CE2-CE1 3.48Å; F100-F132 HydrophobicContact CE2-CE1 3.48Å; F100-F132 VanDerWaalsContact CE2-CE1 3.48Å; F100-F132 HydrophobicContact CE2-CE2 4.09Å; F100-F132 AromaticContact CE2-CG 3.81Å; F100-F132 HydrophobicContact CE2-CG 3.81Å; F100-F132 AromaticContact CE2-CZ 3.8Å; F100-F132 HydrophobicContact CE2-CZ 3.8Å; F100-F132 HydrophobicContact CZ-CB 4.41Å; F100-F132 HydrophobicContact CZ-CD1 4.04Å; F100-F132 HydrophobicContact CZ-CD2 4.43Å; F100-F132 HydrophobicContact CZ-CE1 4.46Å; F100-F132 HydrophobicContact CZ-CG 4.03Å; F100-F294 HydrophobicContact CE1-CD1 4.46Å; F100-F294 AromaticContact CE1-CE1 3.94Å; F100-F294 HydrophobicContact CE1-CE1 3.94Å; F100-F294 AromaticContact CE1-CE2 3.99Å; F100-F294 HydrophobicContact CE1-CE2 3.99Å; F100-F294 AromaticContact CE1-CZ 3.67Å; F100-F294 HydrophobicContact CE1-CZ 3.67Å; F100-F294 HydrophobicContact CZ-CD1 4.13Å; F100-F294 AromaticContact CZ-CD2 3.97Å; F100-F294 HydrophobicContact CZ-CD2 3.97Å; F100-F294 HydrophobicContact CZ-CE1 4.05Å; F100-F294 AromaticContact CZ-CE2 3.83Å; F100-F294 HydrophobicContact CZ-CE2 3.83Å; F100-F294 HydrophobicContact CZ-CG 4.1Å; F100-F294 AromaticContact CZ-CZ 3.89Å; F100-F294 HydrophobicContact CZ-CZ 3.89Å
101	R	92.6	Very high	92	Very high	151 Å²	151	45.5 Å²	45.5	57%	0.57	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-33.2	-178.9	73.1	-174.7	-172.8	-176.5	-4.1	113.6	Q97 H98 R360	Q97-R101 WeakPolarHBondContact O-CA 3.39Å; Q97-R101 WeakPolarHBondContact O-CB 3.06Å; Q97-R101 PolarHBondContact O-N 3.31Å; H98-R101 WeakPolarHBondContact O-CG 2.84Å; R101-R360 PolarHBondContact O-NH2 3.15Å
102	D	91	Very high	90.9	Very high	68 Å²	68	44.9 Å²	44.9	36%	0.364	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	18	-175.1	-63	-38.7	0	0	0	112.7	F100 S369 D370	F100-D102 PolarHBondContact O-N 3.22Å; D102-S369 CarbonylContact O-C 3.58Å; D102-S369 WeakPolarHBondContact O-CB 3.43Å; D102-S369 PolarHBondContact O-OG 3.18Å; D102-D370 HydrophobicContact CB-CB 4.06Å; D102-D370 PolarHBondContact O-N 2.91Å
103	Q	92.1	Very high	89.3	Confident	53 Å²	53	56.7 Å²	56.7	25%	0.248	26%	0.26	C	S	.	.	S	Bend	trans	-120	154.4	178.4	-62.9	-62	-34	0	0	110.7	F100 W105 R360 S369	F100-Q103 HydrophobicContact CB-CB 4.45Å; F100-Q103 HydrophobicContact CD1-CB 4.06Å; F100-Q103 HydrophobicContact CD1-CG 4.02Å; F100-Q103 PolarHBondContact O-N 3.29Å; Q103-W105 VanDerWaalsContact C-N 3.34Å; Q103-W105 WeakPolarHBondContact CB-O 3.2Å; Q103-W105 CarbonylContact O-C 3.55Å; Q103-W105 PolarHBondContact O-N 3.04Å; Q103-R360 PolarHBondContact O-NH1 3.31Å; Q103-R360 PolarHBondContact O-NH2 2.91Å; Q103-S369 PolarHBondContact NE2-OG 2.02Å
104	R	93.4	Very high	87.7	Confident	69 Å²	69	59.3 Å²	59.3	26%	0.26	28%	0.275	S	S	.	.	S	Bend	trans	-57.9	-41.4	-179.9	-61.6	-178.8	-175.8	173.4	-2.3	113.4	D344 F345 C346 T357 R360 S374 C377	R104-D344 WeakPolarHBondContact CD-O 3.37Å; R104-D344 PolarHBondContact NH1-O 3.28Å; R104-D344 VanDerWaalsContact NH1-O 3.12Å; R104-F345 HydrophobicContact CB-CB 3.91Å; R104-C346 PolarHBondContact NH1-SG 2.77Å; R104-T357 HydrophobicContact CB-CG2 3.93Å; R104-T357 HydrophobicContact CG-CG2 4.01Å; R104-R360 VanDerWaalsContact C-NH1 3.26Å; R104-R360 VanDerWaalsContact CA-NH1 3.33Å; R104-R360 PolarHBondContact O-NH1 3.18Å; R104-S374 VanDerWaalsContact CZ-O 3.22Å; R104-S374 PolarHBondContact NE-O 3.41Å; R104-S374 PolarHBondContact NH2-O 2.83Å; R104-C377 VanDerWaalsContact CZ-SG 3.55Å
105	W	92.2	Very high	86.4	Confident	9 Å²	9	57.9 Å²	57.9	3%	0.034	27%	0.267	C	S	.	.	S	Bend	trans	-89.7	117	163.7	-179.8	77	0	0	0	109.1	F100 Q103 C107 L110 I122 E129 F345	F100-W105 WeakPolarHBondContact CB-O 3.36Å; F100-W105 AromaticContact CD1-CE3 3.51Å; F100-W105 HydrophobicContact CD1-CE3 3.51Å; F100-W105 AromaticContact CD1-CZ3 3.79Å; F100-W105 HydrophobicContact CD1-CZ3 3.79Å; F100-W105 WeakPolarHBondContact CD1-O 3.41Å; F100-W105 HydrophobicContact CD2-CZ3 4.13Å; F100-W105 AromaticContact CE1-CE3 3.64Å; F100-W105 HydrophobicContact CE1-CE3 3.64Å; F100-W105 AromaticContact CE1-CZ3 3.7Å; F100-W105 HydrophobicContact CE1-CZ3 3.7Å; F100-W105 HydrophobicContact CE2-CZ3 4.11Å; F100-W105 HydrophobicContact CG-CE3 4.01Å; F100-W105 AromaticContact CG-CZ3 3.99Å; F100-W105 HydrophobicContact CG-CZ3 3.99Å; F100-W105 HydrophobicContact CZ-CE3 4.29Å; F100-W105 AromaticContact CZ-CZ3 3.87Å; F100-W105 HydrophobicContact CZ-CZ3 3.87Å; Q103-W105 VanDerWaalsContact C-N 3.34Å; Q103-W105 WeakPolarHBondContact CB-O 3.2Å; Q103-W105 CarbonylContact O-C 3.55Å; Q103-W105 PolarHBondContact O-N 3.04Å; W105-C107 HydrophobicContact CH2-CB 3.94Å; W105-C107 VanDerWaalsContact CH2-SG 3.55Å; W105-C107 HydrophobicContact CZ2-CB 4.05Å; W105-C107 HydrophobicContact CZ3-CB 4.26Å; W105-L110 HydrophobicContact CZ2-CD1 4.37Å; W105-L110 HydrophobicContact CZ2-CG 4.43Å; W105-I122 HydrophobicContact CD2-CD1 4.34Å; W105-I122 VanDerWaalsContact CE2-CD1 3.44Å; W105-I122 HydrophobicContact CH2-CD1 4.47Å; W105-I122 HydrophobicContact CZ2-CD1 3.53Å; W105-I122 VanDerWaalsContact NE1-CD1 3.33Å; W105-E129 HydrophobicContact CB-CG 4.28Å; W105-E129 HydrophobicContact CD2-CB 3.88Å; W105-E129 HydrophobicContact CD2-CG 3.66Å; W105-E129 HydrophobicContact CE3-CB 3.69Å; W105-E129 HydrophobicContact CE3-CG 3.38Å; W105-E129 HydrophobicContact CG-CG 4.07Å; W105-E129 HydrophobicContact CH2-CB 4.02Å; W105-E129 HydrophobicContact CZ2-CB 4.22Å; W105-E129 HydrophobicContact CZ3-CB 3.76Å; W105-E129 HydrophobicContact CZ3-CG 3.91Å; W105-F345 HydrophobicContact CB-CB 4.48Å; W105-F345 HydrophobicContact CB-CD1 4.01Å; W105-F345 HydrophobicContact CB-CD2 3.98Å; W105-F345 HydrophobicContact CB-CE1 4.17Å; W105-F345 HydrophobicContact CB-CE2 4.12Å; W105-F345 HydrophobicContact CB-CG 3.91Å; W105-F345 HydrophobicContact CB-CZ 4.21Å; W105-F345 AromaticContact CD1-CE1 3.99Å; W105-F345 HydrophobicContact CG-CD1 4.41Å; W105-F345 HydrophobicContact CG-CE1 4.23Å; W105-F345 HydrophobicContact CG-CZ 4.41Å
106	N	91	Very high	85.3	Confident	39 Å²	39	57.8 Å²	57.8	21%	0.209	27%	0.266	C	S	.	.			trans	-109.5	11.1	-173.2	70.6	-12.9	0	0	0	113.7	Q97 S108	Q97-N106 WeakPolarHBondContact CA-O 3.27Å; N106-S108 VanDerWaalsContact CG-OG 3.24Å; N106-S108 PolarHBondContact ND2-OG 3.47Å; N106-S108 PolarHBondContact O-N 2.93Å; N106-S108 VanDerWaalsContact O-N 3.09Å; N106-S108 WeakPolarHBondContact OD1-CB 3.4Å; N106-S108 PolarHBondContact OD1-N 3.17Å; N106-S108 VanDerWaalsContact OD1-N 3.14Å; N106-S108 PolarHBondContact OD1-OG 3.37Å
107	C	91.3	Very high	84.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	64.6	5.9	180	-149.1	0	0	0	0	115.9	C96 Q97 W105 S109 L110	C96-C107 HydrophobicContact CB-CB 3.9Å; C96-C107 WeakPolarHBondContact CB-SG 3.44Å; C96-C107 WeakPolarHBondContact SG-CB 3.29Å; C96-C107 CovalentContact SG-SG 2.03Å; C96-C107 PolarHBondContact SG-SG 2.91Å; Q97-C107 HydrophobicContact CG-CB 4.11Å; W105-C107 HydrophobicContact CH2-CB 3.94Å; W105-C107 VanDerWaalsContact CH2-SG 3.55Å; W105-C107 HydrophobicContact CZ2-CB 4.05Å; W105-C107 HydrophobicContact CZ3-CB 4.26Å; C107-S109 PolarHBondContact O-N 3.09Å; C107-L110 PolarHBondContact O-N 2.85Å; C107-L110 WeakPolarHBondContact SG-CD1 3.48Å
108	S	86.4	Confident	83	Confident	52 Å²	52	56.3 Å²	56.3	36%	0.364	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-60.3	-33.7	-179.3	-68.4	0	0	0	0	113	N106 L110 E111	N106-S108 VanDerWaalsContact CG-OG 3.24Å; N106-S108 PolarHBondContact ND2-OG 3.47Å; N106-S108 PolarHBondContact O-N 2.93Å; N106-S108 VanDerWaalsContact O-N 3.09Å; N106-S108 WeakPolarHBondContact OD1-CB 3.4Å; N106-S108 PolarHBondContact OD1-N 3.17Å; N106-S108 VanDerWaalsContact OD1-N 3.14Å; N106-S108 PolarHBondContact OD1-OG 3.37Å; S108-L110 PolarHBondContact O-N 3.28Å; S108-E111 WeakPolarHBondContact O-CB 3.5Å; S108-E111 PolarHBondContact O-N 3.49Å; S108-E111 VanDerWaalsContact O-N 3.12Å
109	S	82.7	Confident	81.9	Confident	29 Å²	29	58.6 Å²	58.6	20%	0.203	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-69	-18	-177.2	-40.3	0	0	0	0	114.3	C107 E111 D353	C107-S109 PolarHBondContact O-N 3.09Å; S109-E111 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 2.97Å; S109-D353 WeakPolarHBondContact CB-OD1 3.44Å; S109-D353 WeakPolarHBondContact CB-OD2 3.24Å; S109-D353 PolarHBondContact OG-O 3.03Å
110	L	83.9	Confident	81	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-74.3	-18.8	174.4	-61.2	-165.2	0	0	0	112.9	I93 W105 C107 S108 T112 P117 S120 I122 F123 A133	I93-L110 HydrophobicContact CG1-CB 4.23Å; I93-L110 HydrophobicContact CG2-CB 4.09Å; W105-L110 HydrophobicContact CZ2-CD1 4.37Å; W105-L110 HydrophobicContact CZ2-CG 4.43Å; C107-L110 PolarHBondContact O-N 2.85Å; C107-L110 WeakPolarHBondContact SG-CD1 3.48Å; S108-L110 PolarHBondContact O-N 3.28Å; L110-T112 VanDerWaalsContact C-N 3.29Å; L110-T112 PolarHBondContact O-N 3.46Å; L110-T112 PolarHBondContact O-OG1 3.03Å; L110-P117 HydrophobicContact CB-CB 4.38Å; L110-S120 VanDerWaalsContact CD2-OG 3.24Å; L110-S120 WeakPolarHBondContact CD2-OG 3.29Å; L110-I122 HydrophobicContact CD2-CG2 3.54Å; L110-F123 HydrophobicContact CD1-CE2 4.37Å; L110-F123 HydrophobicContact CD1-CZ 4.34Å; L110-F123 HydrophobicContact CD2-CD2 4.32Å; L110-F123 HydrophobicContact CD2-CE2 3.67Å; L110-F123 HydrophobicContact CD2-CZ 4.4Å; L110-A133 HydrophobicContact CD1-CB 3.85Å
111	E	82.7	Confident	80.4	Confident	136 Å²	136	59.3 Å²	59.3	64%	0.636	28%	0.278	S	S	*	.			trans	-75	86.5	176.5	-168.1	172.2	-173	0	0	109.4	I93 Q97 S108 S109	I93-E111 HydrophobicContact CG2-CB 4.3Å; Q97-E111 PolarHBondContact NE2-OE2 3.29Å; S108-E111 WeakPolarHBondContact O-CB 3.5Å; S108-E111 PolarHBondContact O-N 3.49Å; S108-E111 VanDerWaalsContact O-N 3.12Å; S109-E111 VanDerWaalsContact C-N 3.25Å; S109-E111 PolarHBondContact O-N 2.97Å
112	T	71.5	Confident	80	Confident	51 Å²	51	52.1 Å²	52.1	31%	0.313	25%	0.251	S	S	.	.			trans	-99.3	139.4	-179.8	39.5	0	0	0	0	109	L110 N114	L110-T112 VanDerWaalsContact C-N 3.29Å; L110-T112 PolarHBondContact O-N 3.46Å; L110-T112 PolarHBondContact O-OG1 3.03Å; T112-N114 WeakPolarHBondContact CB-O 3.44Å; T112-N114 PolarHBondContact O-N 3.44Å; T112-N114 PolarHBondContact OG1-O 3.01Å
113	R	61.6	Low	79.8	Confident	249 Å²	249	49 Å²	49	94%	0.94	23%	0.234	S	C	*	.	S	Bend	trans	-57.5	-28.7	171.4	-67.6	-176	178.4	179.2	-0.5	111.2
114	N	60.2	Low	79.5	Confident	75 Å²	75	50.6 Å²	50.6	40%	0.401	25%	0.252	S	S	.	.	S	Bend	trans	-90.2	112	174.7	-62.2	-11.6	0	0	0	108.1	P65 T112 I116	P65-N114 HydrophobicContact CG-CB 3.93Å; T112-N114 WeakPolarHBondContact CB-O 3.44Å; T112-N114 PolarHBondContact O-N 3.44Å; T112-N114 PolarHBondContact OG1-O 3.01Å; N114-I116 PolarHBondContact O-N 3.36Å
115	K	67.3	Low	79.3	Confident	90 Å²	90	52 Å²	52	39%	0.391	26%	0.257	S	S	.	.	S	Bend	trans	-63.7	3.4	-157	-54.9	160.9	178.4	171.4	0	116.8	L64 I86	L64-K115 HydrophobicContact CD2-CB 3.78Å; L64-K115 HydrophobicContact CD2-CD 3.71Å; L64-K115 HydrophobicContact CD2-CG 4.24Å; I86-K115 HydrophobicContact CG2-CB 3.49Å; I86-K115 VanDerWaalsContact CG2-CB 3.49Å; I86-K115 HydrophobicContact CG2-CD 3.96Å; I86-K115 HydrophobicContact CG2-CG 4.18Å
116	I	73.5	Confident	79.3	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.026	26%	0.255	C	S	.	.			trans	-115	110.2	-178.7	-54	-178	0	0	0	108.8	L64 L67 N114 Y118	L64-I116 HydrophobicContact CB-CD1 4.12Å; L64-I116 HydrophobicContact CD2-CG1 4.32Å; L67-I116 HydrophobicContact CD2-CD1 3.26Å; L67-I116 HydrophobicContact CG-CD1 3.64Å; N114-I116 PolarHBondContact O-N 3.36Å; I116-Y118 HydrophobicContact CG2-CD2 3.44Å; I116-Y118 VanDerWaalsContact CG2-CD2 3.44Å; I116-Y118 HydrophobicContact CG2-CE2 4.33Å; I116-Y118 HydrophobicContact CG2-CG 4.15Å; I116-Y118 PolarHBondContact O-N 3.49Å; I116-Y118 VanDerWaalsContact O-N 3.07Å
117	P	70.8	Confident	79.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.006	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-74.1	-8.2	-169.4	35.1	-40.8	0	0	0	112.8	I89 I93 L110 E119 S120 F123	I89-P117 HydrophobicContact CG2-CG 3.72Å; I93-P117 HydrophobicContact CD1-CB 3.99Å; I93-P117 HydrophobicContact CD1-CG 4.17Å; L110-P117 HydrophobicContact CB-CB 4.38Å; P117-E119 PolarHBondContact O-N 2.87Å; P117-E119 VanDerWaalsContact O-N 3.14Å; P117-S120 WeakPolarHBondContact O-CB 3.33Å; P117-S120 PolarHBondContact O-N 3.42Å; P117-S120 PolarHBondContact O-OG 3.22Å; P117-F123 HydrophobicContact CB-CE2 3.77Å; P117-F123 HydrophobicContact CB-CZ 4.32Å; P117-F123 HydrophobicContact CG-CE2 4.05Å; P117-F123 HydrophobicContact CG-CZ 4.17Å; P117-F123 WeakPolarHBondContact O-CD2 3.38Å; P117-F123 WeakPolarHBondContact O-CE2 3.39Å
118	Y	71.6	Confident	79.6	Confident	7 Å²	7	54.3 Å²	54.3	3%	0.027	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-66.4	-8.2	-175.6	-76.1	-47.6	0	0	0	116.5	I116 F123 Y134 L229 R232	I116-Y118 HydrophobicContact CG2-CD2 3.44Å; I116-Y118 VanDerWaalsContact CG2-CD2 3.44Å; I116-Y118 HydrophobicContact CG2-CE2 4.33Å; I116-Y118 HydrophobicContact CG2-CG 4.15Å; I116-Y118 PolarHBondContact O-N 3.49Å; I116-Y118 VanDerWaalsContact O-N 3.07Å; Y118-F123 AromaticContact CD1-CD1 3.84Å; Y118-F123 HydrophobicContact CD1-CD1 3.84Å; Y118-F123 HydrophobicContact CD1-CD2 4.21Å; Y118-F123 AromaticContact CD1-CE1 3.96Å; Y118-F123 HydrophobicContact CD1-CE1 3.96Å; Y118-F123 HydrophobicContact CD1-CE2 4.38Å; Y118-F123 AromaticContact CD1-CG 3.95Å; Y118-F123 HydrophobicContact CD1-CG 3.95Å; Y118-F123 HydrophobicContact CD1-CZ 4.24Å; Y118-F123 AromaticContact CE1-CD1 3.99Å; Y118-F123 HydrophobicContact CE1-CD1 3.99Å; Y118-F123 AromaticContact CE1-CE1 3.78Å; Y118-F123 HydrophobicContact CE1-CE1 3.78Å; Y118-F123 HydrophobicContact CE1-CZ 4.21Å; Y118-Y134 AromaticContact CD1-CE1 3.93Å; Y118-Y134 HydrophobicContact CD1-CE1 3.93Å; Y118-Y134 AromaticContact CE1-CD1 3.71Å; Y118-Y134 HydrophobicContact CE1-CD1 3.71Å; Y118-Y134 AromaticContact CE1-CE1 3.51Å; Y118-Y134 HydrophobicContact CE1-CE1 3.51Å; Y118-L229 HydrophobicContact CE2-CD2 3.71Å; Y118-L229 WeakPolarHBondContact OH-CD2 3.45Å; Y118-R232 VanDerWaalsContact CB-NH1 3.27Å; Y118-R232 PolarHBondContact O-NH2 3.4Å
119	E	73.1	Confident	79.9	Confident	104 Å²	104	52.8 Å²	52.8	49%	0.486	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-82.7	-15.5	169.7	-63.8	-173.3	159.2	0	0	112.2	G66 P117	G66-E119 WeakPolarHBondContact CA-OE1 3.43Å; P117-E119 PolarHBondContact O-N 2.87Å; P117-E119 VanDerWaalsContact O-N 3.14Å
120	S	77.6	Confident	80.5	Confident	6 Å²	6	51.4 Å²	51.4	4%	0.042	24%	0.24	C	C	.	.	S	Bend	trans	-66	141	179.4	60.6	0	0	0	0	111.4	L110 P117 I122 F123	L110-S120 VanDerWaalsContact CD2-OG 3.24Å; L110-S120 WeakPolarHBondContact CD2-OG 3.29Å; P117-S120 WeakPolarHBondContact O-CB 3.33Å; P117-S120 PolarHBondContact O-N 3.42Å; P117-S120 PolarHBondContact O-OG 3.22Å; S120-I122 PolarHBondContact O-N 3.21Å; S120-I122 VanDerWaalsContact O-N 3.09Å; S120-F123 PolarHBondContact O-N 3.37Å; S120-F123 VanDerWaalsContact O-N 3.12Å; S120-F123 WeakPolarHBondContact OG-CD2 3.36Å
121	P	81.5	Confident	81	Confident	47 Å²	47	51.2 Å²	51.2	31%	0.305	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-58.3	-27.6	-175.5	-25.1	33.2	0	0	0	114	F123 S124 R351 D353	P121-F123 VanDerWaalsContact C-N 3.28Å; P121-F123 PolarHBondContact O-N 2.97Å; P121-S124 WeakPolarHBondContact O-CB 3.18Å; P121-S124 PolarHBondContact O-N 3.48Å; P121-R351 WeakPolarHBondContact CB-O 3.3Å; P121-D353 HydrophobicContact CB-CB 4.39Å; P121-D353 HydrophobicContact CG-CB 4.49Å
122	I	84.8	Confident	81.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-63.6	-32	-179.7	-163.1	168	0	0	0	112.8	W105 L110 S120 S124 R125 E129 S130 D353	W105-I122 HydrophobicContact CD2-CD1 4.34Å; W105-I122 VanDerWaalsContact CE2-CD1 3.44Å; W105-I122 HydrophobicContact CH2-CD1 4.47Å; W105-I122 HydrophobicContact CZ2-CD1 3.53Å; W105-I122 VanDerWaalsContact NE1-CD1 3.33Å; L110-I122 HydrophobicContact CD2-CG2 3.54Å; S120-I122 PolarHBondContact O-N 3.21Å; S120-I122 VanDerWaalsContact O-N 3.09Å; I122-S124 PolarHBondContact O-N 3.36Å; I122-R125 PolarHBondContact O-N 2.88Å; I122-R125 VanDerWaalsContact O-N 3.12Å; I122-E129 HydrophobicContact CD1-CB 3.8Å; I122-S130 WeakPolarHBondContact O-CB 3.12Å; I122-D353 HydrophobicContact CB-CB 3.94Å; I122-D353 HydrophobicContact CG2-CB 4.47Å
123	F	86.9	Confident	82.8	Confident	3 Å²	3	42.3 Å²	42.3	1%	0.013	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-71.7	-10.3	175.5	-76.5	-72	0	0	0	113.4	L110 P117 Y118 S120 P121 A133 Y134 H239	L110-F123 HydrophobicContact CD1-CE2 4.37Å; L110-F123 HydrophobicContact CD1-CZ 4.34Å; L110-F123 HydrophobicContact CD2-CD2 4.32Å; L110-F123 HydrophobicContact CD2-CE2 3.67Å; L110-F123 HydrophobicContact CD2-CZ 4.4Å; P117-F123 HydrophobicContact CB-CE2 3.77Å; P117-F123 HydrophobicContact CB-CZ 4.32Å; P117-F123 HydrophobicContact CG-CE2 4.05Å; P117-F123 HydrophobicContact CG-CZ 4.17Å; P117-F123 WeakPolarHBondContact O-CD2 3.38Å; P117-F123 WeakPolarHBondContact O-CE2 3.39Å; Y118-F123 AromaticContact CD1-CD1 3.84Å; Y118-F123 HydrophobicContact CD1-CD1 3.84Å; Y118-F123 HydrophobicContact CD1-CD2 4.21Å; Y118-F123 AromaticContact CD1-CE1 3.96Å; Y118-F123 HydrophobicContact CD1-CE1 3.96Å; Y118-F123 HydrophobicContact CD1-CE2 4.38Å; Y118-F123 AromaticContact CD1-CG 3.95Å; Y118-F123 HydrophobicContact CD1-CG 3.95Å; Y118-F123 HydrophobicContact CD1-CZ 4.24Å; Y118-F123 AromaticContact CE1-CD1 3.99Å; Y118-F123 HydrophobicContact CE1-CD1 3.99Å; Y118-F123 AromaticContact CE1-CE1 3.78Å; Y118-F123 HydrophobicContact CE1-CE1 3.78Å; Y118-F123 HydrophobicContact CE1-CZ 4.21Å; S120-F123 PolarHBondContact O-N 3.37Å; S120-F123 VanDerWaalsContact O-N 3.12Å; S120-F123 WeakPolarHBondContact OG-CD2 3.36Å; P121-F123 VanDerWaalsContact C-N 3.28Å; P121-F123 PolarHBondContact O-N 2.97Å; F123-A133 HydrophobicContact CE1-CB 3.7Å; F123-A133 HydrophobicContact CZ-CB 3.72Å; F123-Y134 AromaticContact CD1-CD1 3.74Å; F123-Y134 HydrophobicContact CD1-CD1 3.74Å; F123-Y134 HydrophobicContact CD1-CD2 4.04Å; F123-Y134 AromaticContact CD1-CE1 3.39Å; F123-Y134 HydrophobicContact CD1-CE1 3.39Å; F123-Y134 AromaticContact CD1-CE2 3.73Å; F123-Y134 HydrophobicContact CD1-CE2 3.73Å; F123-Y134 HydrophobicContact CD1-CG 4.05Å; F123-Y134 AromaticContact CD1-CZ 3.39Å; F123-Y134 AromaticContact CE1-CD1 3.78Å; F123-Y134 HydrophobicContact CE1-CD1 3.78Å; F123-Y134 HydrophobicContact CE1-CD2 4.4Å; F123-Y134 AromaticContact CE1-CE1 3.9Å; F123-Y134 HydrophobicContact CE1-CE1 3.9Å; F123-Y134 HydrophobicContact CE1-CG 4.04Å; F123-Y134 HydrophobicContact CG-CE1 4.36Å; F123-Y134 PolarHBondContact O-OH 3.23Å; F123-H239 PolarHBondContact O-CE1 2.93Å; F123-H239 PolarHBondContact O-NE2 3.17Å
124	S	85.7	Confident	84.3	Confident	87 Å²	87	30.5 Å²	30.5	61%	0.608	15%	0.15	S	C	*	.	G	3₁₀ helix	trans	-89.4	-6.6	172.6	-57	0	0	0	0	112.6	P121 I122	P121-S124 WeakPolarHBondContact O-CB 3.18Å; P121-S124 PolarHBondContact O-N 3.48Å; I122-S124 PolarHBondContact O-N 3.36Å
125	R	89.9	Confident	86.1	Confident	97 Å²	97	27 Å²	27	37%	0.366	13%	0.131	S	C	.	.	S	Bend	trans	-107.6	152.1	-175.3	-63	-63.1	-173	151.1	1.1	112.2	I122 F127 S130 L352	I122-R125 PolarHBondContact O-N 2.88Å; I122-R125 VanDerWaalsContact O-N 3.12Å; R125-F127 VanDerWaalsContact C-N 3.29Å; R125-F127 HydrophobicContact CB-CD1 4.32Å; R125-F127 HydrophobicContact CB-CD2 3.6Å; R125-F127 HydrophobicContact CB-CE1 4.22Å; R125-F127 HydrophobicContact CB-CE2 3.49Å; R125-F127 VanDerWaalsContact CB-CE2 3.49Å; R125-F127 HydrophobicContact CB-CG 4.01Å; R125-F127 HydrophobicContact CB-CZ 3.81Å; R125-F127 HydrophobicContact CG-CD2 4.25Å; R125-F127 HydrophobicContact CG-CE2 3.66Å; R125-F127 HydrophobicContact CG-CZ 3.9Å; R125-F127 PolarHBondContact O-N 3.19Å; R125-S130 WeakPolarHBondContact O-CB 3.43Å; R125-S130 PolarHBondContact O-OG 3.24Å; R125-L352 HydrophobicContact CG-CD2 4.2Å
126	G	90.9	Very high	87.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.113	C	C	.	.			trans	-87.1	25.2	-177.4	0	0	0	0	0	115.7	Y338 F339 E340	G126-Y338 WeakPolarHBondContact O-CB 3.15Å; G126-F339 PolarHBondContact O-N 3.23Å; G126-E340 PolarHBondContact N-OE2 3.47Å; G126-E340 PolarHBondContact O-N 2.97Å
127	F	94.3	Very high	88.6	Confident	11 Å²	11	22.8 Å²	22.8	5%	0.048	11%	0.114	C	C	.	.			trans	-77.1	167.7	-171.8	-56.1	-32.5	0	0	0	114	R125 E129 S130 A131 E340 K341 P343 L352	R125-F127 VanDerWaalsContact C-N 3.29Å; R125-F127 HydrophobicContact CB-CD1 4.32Å; R125-F127 HydrophobicContact CB-CD2 3.6Å; R125-F127 HydrophobicContact CB-CE1 4.22Å; R125-F127 HydrophobicContact CB-CE2 3.49Å; R125-F127 VanDerWaalsContact CB-CE2 3.49Å; R125-F127 HydrophobicContact CB-CG 4.01Å; R125-F127 HydrophobicContact CB-CZ 3.81Å; R125-F127 HydrophobicContact CG-CD2 4.25Å; R125-F127 HydrophobicContact CG-CE2 3.66Å; R125-F127 HydrophobicContact CG-CZ 3.9Å; R125-F127 PolarHBondContact O-N 3.19Å; F127-E129 VanDerWaalsContact C-N 3.25Å; F127-E129 PolarHBondContact O-N 2.92Å; F127-S130 PolarHBondContact N-OG 3.07Å; F127-S130 PolarHBondContact O-N 2.99Å; F127-S130 PolarHBondContact O-OG 3.44Å; F127-A131 PolarHBondContact O-N 3.31Å; F127-A131 VanDerWaalsContact O-N 3.15Å; F127-E340 HydrophobicContact CD1-CB 3.67Å; F127-E340 HydrophobicContact CE1-CB 3.79Å; F127-K341 WeakPolarHBondContact CE1-O 3.28Å; F127-P343 HydrophobicContact CE2-CG 4.18Å; F127-P343 HydrophobicContact CZ-CG 4.36Å; F127-L352 HydrophobicContact CE2-CD2 4.27Å; F127-L352 HydrophobicContact CZ-CD1 4.47Å; F127-L352 HydrophobicContact CZ-CD2 4.25Å
128	R	94.4	Very high	89.8	Confident	87 Å²	87	22.8 Å²	22.8	33%	0.328	11%	0.113	S	C	.	.	H	α-helix	trans	-63.7	-36.2	173.9	-65.6	-175.9	-177.2	-171.8	2.5	111.4	A131 F132 F294 Y338 S342	R128-A131 WeakPolarHBondContact O-CB 3.44Å; R128-A131 PolarHBondContact O-N 3.05Å; R128-F132 PolarHBondContact O-N 2.92Å; R128-F132 VanDerWaalsContact O-N 3.08Å; R128-F294 VanDerWaalsContact C-CE2 3.48Å; R128-F294 HydrophobicContact CB-CD2 4.1Å; R128-F294 HydrophobicContact CB-CE2 3.5Å; R128-F294 HydrophobicContact CB-CZ 4.11Å; R128-F294 WeakPolarHBondContact O-CD2 3.4Å; R128-F294 WeakPolarHBondContact O-CE2 3.25Å; R128-Y338 HydrophobicContact CB-CG 4.46Å; R128-Y338 HydrophobicContact CG-CD1 3.64Å; R128-Y338 HydrophobicContact CG-CD2 3.55Å; R128-Y338 HydrophobicContact CG-CE1 3.71Å; R128-Y338 HydrophobicContact CG-CE2 3.6Å; R128-Y338 HydrophobicContact CG-CG 3.58Å; R128-Y338 VanDerWaalsContact CZ-OH 3.28Å; R128-Y338 PolarHBondContact NE-OH 3.22Å; R128-Y338 PolarHBondContact NH2-OH 3.39Å; R128-S342 PolarHBondContact N-OG 2.95Å
129	E	93.9	Very high	91	Very high	19 Å²	19	22.4 Å²	22.4	9%	0.089	11%	0.112	C	C	.	.	H	α-helix	trans	-67.3	-42.3	-179	-67.3	70.2	-154.8	0	0	110.7	W105 I122 F127 A131 F132 A133 F294 S342 F345	W105-E129 HydrophobicContact CB-CG 4.28Å; W105-E129 HydrophobicContact CD2-CB 3.88Å; W105-E129 HydrophobicContact CD2-CG 3.66Å; W105-E129 HydrophobicContact CE3-CB 3.69Å; W105-E129 HydrophobicContact CE3-CG 3.38Å; W105-E129 HydrophobicContact CG-CG 4.07Å; W105-E129 HydrophobicContact CH2-CB 4.02Å; W105-E129 HydrophobicContact CZ2-CB 4.22Å; W105-E129 HydrophobicContact CZ3-CB 3.76Å; W105-E129 HydrophobicContact CZ3-CG 3.91Å; I122-E129 HydrophobicContact CD1-CB 3.8Å; F127-E129 VanDerWaalsContact C-N 3.25Å; F127-E129 PolarHBondContact O-N 2.92Å; E129-A131 VanDerWaalsContact C-N 3.34Å; E129-A131 PolarHBondContact O-N 3.41Å; E129-F132 PolarHBondContact O-N 3.18Å; E129-A133 WeakPolarHBondContact O-CB 3.48Å; E129-A133 PolarHBondContact O-N 3.35Å; E129-F294 HydrophobicContact CG-CE2 4.35Å; E129-S342 VanDerWaalsContact OE2-CB 3.24Å; E129-S342 WeakPolarHBondContact OE2-CB 3.26Å; E129-S342 PolarHBondContact OE2-OG 3.45Å; E129-F345 HydrophobicContact CG-CE2 4.08Å; E129-F345 HydrophobicContact CG-CZ 3.94Å
130	S	93.7	Very high	92.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66	-37.4	174.2	68.7	0	0	0	0	111.6	I122 R125 F127 F132 A133 Y134 M242	I122-S130 WeakPolarHBondContact O-CB 3.12Å; R125-S130 WeakPolarHBondContact O-CB 3.43Å; R125-S130 PolarHBondContact O-OG 3.24Å; F127-S130 PolarHBondContact N-OG 3.07Å; F127-S130 PolarHBondContact O-N 2.99Å; F127-S130 PolarHBondContact O-OG 3.44Å; S130-F132 PolarHBondContact O-N 3.46Å; S130-A133 PolarHBondContact O-N 3.12Å; S130-Y134 WeakPolarHBondContact O-CD2 3.25Å; S130-Y134 PolarHBondContact O-N 3.26Å; S130-M242 WeakPolarHBondContact OG-CE 3.43Å
131	A	95.4	Very high	93.1	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-58.8	-44.8	174.1	0	0	0	0	0	112.8	F127 R128 E129 A135 N246 V337	F127-A131 PolarHBondContact O-N 3.31Å; F127-A131 VanDerWaalsContact O-N 3.15Å; R128-A131 WeakPolarHBondContact O-CB 3.44Å; R128-A131 PolarHBondContact O-N 3.05Å; E129-A131 VanDerWaalsContact C-N 3.34Å; E129-A131 PolarHBondContact O-N 3.41Å; A131-A135 PolarHBondContact O-N 3.38Å; A131-N246 VanDerWaalsContact CA-ND2 3.31Å; A131-N246 WeakPolarHBondContact CA-ND2 3.41Å; A131-N246 WeakPolarHBondContact CB-ND2 3.45Å; A131-V337 VanDerWaalsContact CB-O 3.24Å; A131-V337 WeakPolarHBondContact CB-O 3.48Å
132	F	96.3	Very high	93.9	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.3	-44.1	173.5	179.7	-87.8	0	0	0	111.9	C96 Q99 F100 R128 E129 S130 Y134 A135 I136 L290 R291 F294 L336	C96-F132 HydrophobicContact CB-CE1 4.03Å; Q99-F132 HydrophobicContact CB-CZ 4.4Å; Q99-F132 HydrophobicContact CG-CZ 4.44Å; F100-F132 HydrophobicContact CD2-CD1 4.37Å; F100-F132 HydrophobicContact CD2-CE1 4.1Å; F100-F132 HydrophobicContact CD2-CZ 4.48Å; F100-F132 AromaticContact CE2-CD1 3.47Å; F100-F132 HydrophobicContact CE2-CD1 3.47Å; F100-F132 VanDerWaalsContact CE2-CD1 3.47Å; F100-F132 HydrophobicContact CE2-CD2 4.11Å; F100-F132 AromaticContact CE2-CE1 3.48Å; F100-F132 HydrophobicContact CE2-CE1 3.48Å; F100-F132 VanDerWaalsContact CE2-CE1 3.48Å; F100-F132 HydrophobicContact CE2-CE2 4.09Å; F100-F132 AromaticContact CE2-CG 3.81Å; F100-F132 HydrophobicContact CE2-CG 3.81Å; F100-F132 AromaticContact CE2-CZ 3.8Å; F100-F132 HydrophobicContact CE2-CZ 3.8Å; F100-F132 HydrophobicContact CZ-CB 4.41Å; F100-F132 HydrophobicContact CZ-CD1 4.04Å; F100-F132 HydrophobicContact CZ-CD2 4.43Å; F100-F132 HydrophobicContact CZ-CE1 4.46Å; F100-F132 HydrophobicContact CZ-CG 4.03Å; R128-F132 PolarHBondContact O-N 2.92Å; R128-F132 VanDerWaalsContact O-N 3.08Å; E129-F132 PolarHBondContact O-N 3.18Å; S130-F132 PolarHBondContact O-N 3.46Å; F132-Y134 VanDerWaalsContact C-N 3.34Å; F132-Y134 PolarHBondContact O-N 3.2Å; F132-A135 PolarHBondContact O-N 3.08Å; F132-A135 VanDerWaalsContact O-N 3.16Å; F132-I136 HydrophobicContact CD1-CB 4.47Å; F132-I136 HydrophobicContact CD1-CG2 4.18Å; F132-I136 HydrophobicContact CE1-CB 4Å; F132-I136 HydrophobicContact CE1-CG1 4.34Å; F132-I136 HydrophobicContact CE1-CG2 3.93Å; F132-I136 HydrophobicContact CZ-CB 4.27Å; F132-I136 HydrophobicContact CZ-CD1 4.42Å; F132-I136 HydrophobicContact CZ-CG1 4.38Å; F132-I136 WeakPolarHBondContact O-CG2 3.22Å; F132-I136 PolarHBondContact O-N 2.83Å; F132-L290 HydrophobicContact CD2-CB 4.09Å; F132-L290 HydrophobicContact CE2-CB 3.61Å; F132-L290 HydrophobicContact CZ-CB 4.47Å; F132-R291 HydrophobicContact CE2-CB 4.36Å; F132-F294 HydrophobicContact CB-CD2 3.83Å; F132-F294 HydrophobicContact CD2-CB 4.01Å; F132-L336 HydrophobicContact CB-CD1 4.34Å; F132-L336 HydrophobicContact CD2-CD1 4.45Å
133	A	94.9	Very high	94.5	Very high	1 Å²	1	16 Å²	16	1%	0.008	8%	0.077	C	C	.	.	H	α-helix	trans	-59.5	-42.1	180	0	0	0	0	0	112.3	L110 F123 E129 S130 I136 A137	L110-A133 HydrophobicContact CD1-CB 3.85Å; F123-A133 HydrophobicContact CE1-CB 3.7Å; F123-A133 HydrophobicContact CZ-CB 3.72Å; E129-A133 WeakPolarHBondContact O-CB 3.48Å; E129-A133 PolarHBondContact O-N 3.35Å; S130-A133 PolarHBondContact O-N 3.12Å; A133-I136 WeakPolarHBondContact O-CG2 3.33Å; A133-A137 VanDerWaalsContact O-CB 3.25Å; A133-A137 WeakPolarHBondContact O-CB 3.31Å; A133-A137 PolarHBondContact O-N 3.49Å; A133-A137 VanDerWaalsContact O-N 3.1Å
134	Y	94.8	Very high	95	Very high	1 Å²	1	16.4 Å²	16.4	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-61.3	-48.2	173.2	-81	-59.9	0	0	0	111.9	Y118 F123 S130 F132 A138 H239 M242 R243 N247	Y118-Y134 AromaticContact CD1-CE1 3.93Å; Y118-Y134 HydrophobicContact CD1-CE1 3.93Å; Y118-Y134 AromaticContact CE1-CD1 3.71Å; Y118-Y134 HydrophobicContact CE1-CD1 3.71Å; Y118-Y134 AromaticContact CE1-CE1 3.51Å; Y118-Y134 HydrophobicContact CE1-CE1 3.51Å; F123-Y134 AromaticContact CD1-CD1 3.74Å; F123-Y134 HydrophobicContact CD1-CD1 3.74Å; F123-Y134 HydrophobicContact CD1-CD2 4.04Å; F123-Y134 AromaticContact CD1-CE1 3.39Å; F123-Y134 HydrophobicContact CD1-CE1 3.39Å; F123-Y134 AromaticContact CD1-CE2 3.73Å; F123-Y134 HydrophobicContact CD1-CE2 3.73Å; F123-Y134 HydrophobicContact CD1-CG 4.05Å; F123-Y134 AromaticContact CD1-CZ 3.39Å; F123-Y134 AromaticContact CE1-CD1 3.78Å; F123-Y134 HydrophobicContact CE1-CD1 3.78Å; F123-Y134 HydrophobicContact CE1-CD2 4.4Å; F123-Y134 AromaticContact CE1-CE1 3.9Å; F123-Y134 HydrophobicContact CE1-CE1 3.9Å; F123-Y134 HydrophobicContact CE1-CG 4.04Å; F123-Y134 HydrophobicContact CG-CE1 4.36Å; F123-Y134 PolarHBondContact O-OH 3.23Å; S130-Y134 WeakPolarHBondContact O-CD2 3.25Å; S130-Y134 PolarHBondContact O-N 3.26Å; F132-Y134 VanDerWaalsContact C-N 3.34Å; F132-Y134 PolarHBondContact O-N 3.2Å; Y134-A138 WeakPolarHBondContact O-CB 3.39Å; Y134-A138 PolarHBondContact O-N 2.93Å; Y134-A138 VanDerWaalsContact O-N 3.07Å; Y134-H239 PolarHBondContact OH-CE1 2.85Å; Y134-H239 VanDerWaalsContact OH-CE1 3.27Å; Y134-M242 HydrophobicContact CD2-CE 4.09Å; Y134-M242 HydrophobicContact CE2-CE 3.89Å; Y134-R243 HydrophobicContact CD1-CB 4.39Å; Y134-R243 HydrophobicContact CD1-CG 3.65Å; Y134-R243 HydrophobicContact CD2-CB 4.47Å; Y134-R243 HydrophobicContact CE1-CB 4.13Å; Y134-R243 HydrophobicContact CE1-CG 3.42Å; Y134-R243 VanDerWaalsContact CE1-CG 3.42Å; Y134-R243 HydrophobicContact CE2-CB 4.22Å; Y134-R243 HydrophobicContact CE2-CG 4.39Å; Y134-R243 HydrophobicContact CG-CG 4.23Å; Y134-N247 WeakPolarHBondContact CB-OD1 3.24Å; Y134-N247 PolarHBondContact O-OD1 2.82Å
135	A	97	Very high	95.5	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-64.5	-46.7	-178.7	0	0	0	0	0	112.8	A131 F132 A137 A138 A139 N246 G250 L290 L336	A131-A135 PolarHBondContact O-N 3.38Å; F132-A135 PolarHBondContact O-N 3.08Å; F132-A135 VanDerWaalsContact O-N 3.16Å; A135-A137 PolarHBondContact O-N 2.72Å; A135-A138 PolarHBondContact O-N 2.89Å; A135-A139 WeakPolarHBondContact O-CB 3.35Å; A135-A139 PolarHBondContact O-N 3.35Å; A135-N246 VanDerWaalsContact CA-O 3.32Å; A135-N246 WeakPolarHBondContact CA-O 3.47Å; A135-N246 WeakPolarHBondContact CB-O 3.34Å; A135-G250 VanDerWaalsContact O-CA 3.23Å; A135-G250 WeakPolarHBondContact O-CA 3.35Å; A135-L290 HydrophobicContact CB-CD1 4.24Å; A135-L290 HydrophobicContact CB-CD2 4.05Å; A135-L336 HydrophobicContact CB-CD2 3.53Å
136	I	96.8	Very high	95.8	Very high	4 Å²	4	7.7 Å²	7.7	2%	0.021	4%	0.035	C	C	.	.	H	α-helix	trans	-67.8	-36.9	-178.9	-163.3	67.5	0	0	0	111.4	A92 E95 C96 F132 A133 A139 G140 F283 L290	A92-I136 HydrophobicContact CB-CG1 4Å; A92-I136 HydrophobicContact CB-CG2 4.43Å; A92-I136 WeakPolarHBondContact CB-O 3.25Å; E95-I136 HydrophobicContact CG-CD1 4.44Å; C96-I136 HydrophobicContact CB-CG2 4.34Å; F132-I136 HydrophobicContact CD1-CB 4.47Å; F132-I136 HydrophobicContact CD1-CG2 4.18Å; F132-I136 HydrophobicContact CE1-CB 4Å; F132-I136 HydrophobicContact CE1-CG1 4.34Å; F132-I136 HydrophobicContact CE1-CG2 3.93Å; F132-I136 HydrophobicContact CZ-CB 4.27Å; F132-I136 HydrophobicContact CZ-CD1 4.42Å; F132-I136 HydrophobicContact CZ-CG1 4.38Å; F132-I136 WeakPolarHBondContact O-CG2 3.22Å; F132-I136 PolarHBondContact O-N 2.83Å; A133-I136 WeakPolarHBondContact O-CG2 3.33Å; I136-A139 PolarHBondContact O-N 3.39Å; I136-G140 PolarHBondContact O-N 3.26Å; I136-F283 HydrophobicContact CD1-CE1 3.73Å; I136-F283 HydrophobicContact CD1-CZ 3.68Å; I136-F283 HydrophobicContact CG1-CE1 4.12Å; I136-F283 HydrophobicContact CG1-CZ 4.06Å; I136-L290 HydrophobicContact CB-CD1 4.18Å; I136-L290 HydrophobicContact CD1-CD1 3.69Å
137	A	95.4	Very high	96.1	Very high	4 Å²	4	9.6 Å²	9.6	3%	0.033	5%	0.045	C	C	.	.	H	α-helix	trans	-63.8	-45.8	175.3	0	0	0	0	0	111.6	A133 A135 A139 G140 V141	A133-A137 VanDerWaalsContact O-CB 3.25Å; A133-A137 WeakPolarHBondContact O-CB 3.31Å; A133-A137 PolarHBondContact O-N 3.49Å; A133-A137 VanDerWaalsContact O-N 3.1Å; A135-A137 PolarHBondContact O-N 2.72Å; A137-A139 VanDerWaalsContact C-N 3.34Å; A137-A139 PolarHBondContact O-N 2.95Å; A137-G140 PolarHBondContact O-N 2.87Å; A137-V141 PolarHBondContact O-N 3.48Å
138	A	96.6	Very high	96.2	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-65.2	-37.5	177.4	0	0	0	0	0	112.8	Y134 A135 V142 S225 L229 N247 R251	Y134-A138 WeakPolarHBondContact O-CB 3.39Å; Y134-A138 PolarHBondContact O-N 2.93Å; Y134-A138 VanDerWaalsContact O-N 3.07Å; A135-A138 PolarHBondContact O-N 2.89Å; A138-V142 PolarHBondContact O-N 3.45Å; A138-S225 PolarHBondContact O-OG 2.77Å; A138-L229 VanDerWaalsContact CA-CD1 3.45Å; A138-L229 HydrophobicContact CB-CD1 3.76Å; A138-N247 HydrophobicContact CB-CB 3.96Å; A138-N247 WeakPolarHBondContact CB-O 3.33Å; A138-R251 HydrophobicContact CB-CG 4.07Å
139	A	97.9	Very high	96.2	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.4	-44.1	171.2	0	0	0	0	0	111.8	A135 I136 A137 V141 V142 H143 G250 V254 F283 V286 L290	A135-A139 WeakPolarHBondContact O-CB 3.35Å; A135-A139 PolarHBondContact O-N 3.35Å; I136-A139 PolarHBondContact O-N 3.39Å; A137-A139 VanDerWaalsContact C-N 3.34Å; A137-A139 PolarHBondContact O-N 2.95Å; A139-V141 PolarHBondContact O-N 2.88Å; A139-V142 PolarHBondContact O-N 2.88Å; A139-H143 VanDerWaalsContact O-CB 3.26Å; A139-H143 WeakPolarHBondContact O-CB 3.05Å; A139-H143 PolarHBondContact O-N 3.42Å; A139-G250 WeakPolarHBondContact CB-O 3.49Å; A139-V254 HydrophobicContact CB-CG2 3.65Å; A139-V254 WeakPolarHBondContact O-CG2 3.39Å; A139-F283 HydrophobicContact CB-CE2 4.33Å; A139-V286 HydrophobicContact CB-CG1 3.89Å; A139-L290 HydrophobicContact CB-CD1 4.19Å
140	G	97.3	Very high	96.2	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-57.2	-46.9	177.1	0	0	0	0	0	112.8	G88 I136 A137 H143 A144	G88-G140 WeakPolarHBondContact CA-O 3.46Å; G88-G140 WeakPolarHBondContact O-CA 3.23Å; I136-G140 PolarHBondContact O-N 3.26Å; A137-G140 PolarHBondContact O-N 2.87Å; G140-H143 PolarHBondContact O-N 3.34Å; G140-A144 WeakPolarHBondContact O-CB 3.15Å; G140-A144 PolarHBondContact O-N 2.64Å
141	V	96.7	Very high	96.2	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.7	-50.1	177	174.6	0	0	0	0	111.3	A85 I89 A137 A139 H143 A144 V145 F224 L229	A85-V141 HydrophobicContact CB-CB 4.48Å; A85-V141 HydrophobicContact CB-CG1 3.72Å; A85-V141 HydrophobicContact CB-CG2 4.17Å; I89-V141 HydrophobicContact CD1-CG2 3.99Å; I89-V141 HydrophobicContact CG1-CG2 3.61Å; A137-V141 PolarHBondContact O-N 3.48Å; A139-V141 PolarHBondContact O-N 2.88Å; V141-H143 PolarHBondContact O-N 3.22Å; V141-A144 PolarHBondContact O-N 3Å; V141-V145 HydrophobicContact CG1-CG2 4.11Å; V141-V145 VanDerWaalsContact O-CB 3.28Å; V141-V145 WeakPolarHBondContact O-CB 3.21Å; V141-V145 VanDerWaalsContact O-CG2 3.26Å; V141-V145 WeakPolarHBondContact O-CG2 3Å; V141-V145 PolarHBondContact O-N 3.45Å; V141-F224 HydrophobicContact CG1-CD1 4.19Å; V141-L229 HydrophobicContact CB-CD1 4.36Å; V141-L229 HydrophobicContact CG2-CD1 3.95Å; V141-L229 HydrophobicContact CG2-CD2 4.33Å; V141-L229 HydrophobicContact CG2-CG 4.42Å
142	V	97.7	Very high	96	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.5	-45.1	179.3	172.7	0	0	0	0	111.2	A138 A139 S146 M218 R251 V254	A138-V142 PolarHBondContact O-N 3.45Å; A139-V142 PolarHBondContact O-N 2.88Å; V142-S146 WeakPolarHBondContact O-CB 3.22Å; V142-S146 PolarHBondContact O-N 2.99Å; V142-S146 PolarHBondContact O-OG 2.74Å; V142-M218 HydrophobicContact CG1-CE 3.47Å; V142-M218 VanDerWaalsContact CG1-CE 3.47Å; V142-R251 HydrophobicContact CG2-CB 4.04Å; V142-R251 HydrophobicContact CG2-CG 3.57Å; V142-V254 HydrophobicContact CG1-CB 4.25Å; V142-V254 HydrophobicContact CG1-CG1 4.26Å
143	H	97.8	Very high	95.8	Very high	22 Å²	22	20.1 Å²	20.1	10%	0.102	12%	0.12	C	C	.	.	H	α-helix	trans	-60.2	-50.6	-179.9	177.4	81.6	0	0	0	111.9	A139 G140 V141 N147 V254 T280 P281 F283	A139-H143 VanDerWaalsContact O-CB 3.26Å; A139-H143 WeakPolarHBondContact O-CB 3.05Å; A139-H143 PolarHBondContact O-N 3.42Å; G140-H143 PolarHBondContact O-N 3.34Å; V141-H143 PolarHBondContact O-N 3.22Å; H143-N147 PolarHBondContact CE1-ND2 3.11Å; H143-N147 VanDerWaalsContact CE1-ND2 3.27Å; H143-N147 PolarHBondContact NE2-ND2 3.12Å; H143-N147 VanDerWaalsContact O-CB 3.3Å; H143-N147 WeakPolarHBondContact O-CB 3.45Å; H143-N147 VanDerWaalsContact O-CG 3.27Å; H143-N147 PolarHBondContact O-N 3.07Å; H143-N147 VanDerWaalsContact O-N 3.15Å; H143-N147 PolarHBondContact O-ND2 3.44Å; H143-N147 VanDerWaalsContact O-ND2 3.15Å; H143-V254 HydrophobicContact CB-CG1 4.23Å; H143-T280 PolarHBondContact CE1-OG1 3.48Å; H143-T280 VanDerWaalsContact CE1-OG1 3.26Å; H143-T280 PolarHBondContact ND1-OG1 2.94Å; H143-P281 PolarHBondContact CE1-O 2.64Å; H143-P281 PolarHBondContact ND1-O 3.21Å; H143-F283 HydrophobicContact CB-CD2 3.89Å; H143-F283 HydrophobicContact CB-CE2 4.06Å; H143-F283 AromaticContact CD2-CD2 3.74Å; H143-F283 AromaticContact CG-CD2 3.66Å
144	A	97.2	Very high	95.6	Very high	12 Å²	12	20.5 Å²	20.5	10%	0.099	12%	0.123	C	C	.	.	H	α-helix	trans	-71.5	-44.8	-176.8	0	0	0	0	0	112.8	S84 G140 V141 N147 A148	S84-A144 WeakPolarHBondContact O-CB 3.23Å; G140-A144 WeakPolarHBondContact O-CB 3.15Å; G140-A144 PolarHBondContact O-N 2.64Å; V141-A144 PolarHBondContact O-N 3Å; A144-N147 PolarHBondContact O-N 2.95Å; A144-A148 WeakPolarHBondContact O-CB 3.41Å; A144-A148 PolarHBondContact O-N 3.15Å
145	V	97.2	Very high	95.4	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.2	-48.1	179.3	171.4	0	0	0	0	110.6	V81 A85 V141 N147 A148 C149 L154 F220 F224	V81-V145 HydrophobicContact CG1-CG1 3.71Å; V81-V145 HydrophobicContact CG1-CG2 4.04Å; A85-V145 HydrophobicContact CB-CG2 3.92Å; V141-V145 HydrophobicContact CG1-CG2 4.11Å; V141-V145 VanDerWaalsContact O-CB 3.28Å; V141-V145 WeakPolarHBondContact O-CB 3.21Å; V141-V145 VanDerWaalsContact O-CG2 3.26Å; V141-V145 WeakPolarHBondContact O-CG2 3Å; V141-V145 PolarHBondContact O-N 3.45Å; V145-N147 VanDerWaalsContact C-N 3.31Å; V145-N147 PolarHBondContact O-N 3.03Å; V145-A148 PolarHBondContact O-N 3.05Å; V145-A148 VanDerWaalsContact O-N 3.17Å; V145-C149 PolarHBondContact O-N 2.9Å; V145-C149 PolarHBondContact O-SG 3.42Å; V145-L154 HydrophobicContact CG1-CD1 4.28Å; V145-F220 HydrophobicContact CG1-CD1 3.86Å; V145-F220 HydrophobicContact CG1-CE1 3.8Å; V145-F224 HydrophobicContact CG2-CD1 4.11Å
146	S	96.5	Very high	95.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-38.8	-179	-47.5	0	0	0	0	111.5	V142 C149 A150 P216	V142-S146 WeakPolarHBondContact O-CB 3.22Å; V142-S146 PolarHBondContact O-N 2.99Å; V142-S146 PolarHBondContact O-OG 2.74Å; S146-C149 WeakPolarHBondContact O-CB 3.39Å; S146-C149 PolarHBondContact O-N 2.91Å; S146-A150 PolarHBondContact O-N 3.44Å; S146-P216 WeakPolarHBondContact O-CB 3.46Å
147	N	95.8	Very high	94.9	Very high	41 Å²	41	32.9 Å²	32.9	22%	0.219	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-39.8	174.4	-79	-26	0	0	0	112.7	H143 A144 V145 C149 A150 L151 T280	H143-N147 PolarHBondContact CE1-ND2 3.11Å; H143-N147 VanDerWaalsContact CE1-ND2 3.27Å; H143-N147 PolarHBondContact NE2-ND2 3.12Å; H143-N147 VanDerWaalsContact O-CB 3.3Å; H143-N147 WeakPolarHBondContact O-CB 3.45Å; H143-N147 VanDerWaalsContact O-CG 3.27Å; H143-N147 PolarHBondContact O-N 3.07Å; H143-N147 VanDerWaalsContact O-N 3.15Å; H143-N147 PolarHBondContact O-ND2 3.44Å; H143-N147 VanDerWaalsContact O-ND2 3.15Å; A144-N147 PolarHBondContact O-N 2.95Å; V145-N147 VanDerWaalsContact C-N 3.31Å; V145-N147 PolarHBondContact O-N 3.03Å; N147-C149 VanDerWaalsContact C-N 3.32Å; N147-C149 PolarHBondContact O-N 3.27Å; N147-A150 PolarHBondContact O-N 3.15Å; N147-L151 VanDerWaalsContact O-CG 3.29Å; N147-L151 WeakPolarHBondContact O-CG 3.49Å; N147-L151 PolarHBondContact O-N 2.96Å; N147-T280 PolarHBondContact ND2-OG1 3.37Å; N147-T280 WeakPolarHBondContact OD1-CG2 3.19Å; N147-T280 PolarHBondContact OD1-OG1 2.93Å
148	A	96.1	Very high	94.8	Very high	9 Å²	9	34.2 Å²	34.2	7%	0.074	20%	0.2	C	C	.	.	H	α-helix	trans	-64.3	-37.1	175.8	0	0	0	0	0	111.8	A144 V145 L151 G152 K153 L154	A144-A148 WeakPolarHBondContact O-CB 3.41Å; A144-A148 PolarHBondContact O-N 3.15Å; V145-A148 PolarHBondContact O-N 3.05Å; V145-A148 VanDerWaalsContact O-N 3.17Å; A148-L151 PolarHBondContact O-N 3.35Å; A148-G152 PolarHBondContact O-N 2.84Å; A148-K153 HydrophobicContact CB-CB 4.42Å; A148-K153 PolarHBondContact O-N 3.25Å; A148-L154 HydrophobicContact CB-CD1 3.63Å; A148-L154 HydrophobicContact CB-CD2 4.48Å; A148-L154 HydrophobicContact CB-CG 3.81Å
149	C	95.4	Very high	94.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60	-46.6	170	-60	0	0	0	0	111.5	V145 S146 N147 L151 G152 C157 F220	V145-C149 PolarHBondContact O-N 2.9Å; V145-C149 PolarHBondContact O-SG 3.42Å; S146-C149 WeakPolarHBondContact O-CB 3.39Å; S146-C149 PolarHBondContact O-N 2.91Å; N147-C149 VanDerWaalsContact C-N 3.32Å; N147-C149 PolarHBondContact O-N 3.27Å; C149-L151 VanDerWaalsContact C-N 3.26Å; C149-L151 PolarHBondContact O-N 2.86Å; C149-G152 PolarHBondContact O-N 3Å; C149-G152 VanDerWaalsContact O-N 3.1Å; C149-C157 VanDerWaalsContact CA-SG 3.52Å; C149-C157 HydrophobicContact CB-CB 3.8Å; C149-C157 WeakPolarHBondContact CB-SG 3.2Å; C149-C157 WeakPolarHBondContact SG-CB 3.3Å; C149-C157 CovalentContact SG-SG 2.02Å; C149-C157 PolarHBondContact SG-SG 2.99Å; C149-F220 VanDerWaalsContact SG-CD1 3.54Å
150	A	93.5	Very high	94.2	Very high	22 Å²	22	38.6 Å²	38.6	18%	0.182	23%	0.228	C	C	.	.	H	α-helix	trans	-66.8	-26.7	-180	0	0	0	0	0	113.8	S146 N147 G152 C214 P216	S146-A150 PolarHBondContact O-N 3.44Å; N147-A150 PolarHBondContact O-N 3.15Å; A150-G152 VanDerWaalsContact C-N 3.3Å; A150-C214 WeakPolarHBondContact CA-SG 3.15Å; A150-C214 PolarHBondContact O-SG 3.43Å; A150-P216 HydrophobicContact CB-CB 4.14Å; A150-P216 HydrophobicContact CB-CG 3.82Å
151	L	93.3	Very high	93.5	Very high	125 Å²	125	42.6 Å²	42.6	65%	0.654	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-4.5	175.7	-67.8	173.6	0	0	0	113	N147 A148 C149 K153	N147-L151 VanDerWaalsContact O-CG 3.29Å; N147-L151 WeakPolarHBondContact O-CG 3.49Å; N147-L151 PolarHBondContact O-N 2.96Å; A148-L151 PolarHBondContact O-N 3.35Å; C149-L151 VanDerWaalsContact C-N 3.26Å; C149-L151 PolarHBondContact O-N 2.86Å; L151-K153 VanDerWaalsContact C-N 3.26Å; L151-K153 HydrophobicContact CB-CD 4.39Å; L151-K153 HydrophobicContact CB-CG 4.02Å; L151-K153 HydrophobicContact CD1-CD 4.41Å; L151-K153 PolarHBondContact O-N 2.89Å
152	G	92.4	Very high	92.7	Very high	58 Å²	58	47.2 Å²	47.2	60%	0.598	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	20.4	-176.1	0	0	0	0	0	114	A148 C149 A150 L154	A148-G152 PolarHBondContact O-N 2.84Å; C149-G152 PolarHBondContact O-N 3Å; C149-G152 VanDerWaalsContact O-N 3.1Å; A150-G152 VanDerWaalsContact C-N 3.3Å; G152-L154 VanDerWaalsContact C-N 3.35Å
153	K	91.1	Very high	91.4	Very high	123 Å²	123	51.1 Å²	51.1	54%	0.535	31%	0.308	S	S	.	.			trans	-78.6	-19.7	-179.9	-69.2	-172.7	174.1	-170.1	0	113.7	A148 L151	A148-K153 HydrophobicContact CB-CB 4.42Å; A148-K153 PolarHBondContact O-N 3.25Å; L151-K153 VanDerWaalsContact C-N 3.26Å; L151-K153 HydrophobicContact CB-CD 4.39Å; L151-K153 HydrophobicContact CB-CG 4.02Å; L151-K153 HydrophobicContact CD1-CD 4.41Å; L151-K153 PolarHBondContact O-N 2.89Å
154	L	91.7	Very high	90	Very high	10 Å²	10	58.2 Å²	58.2	5%	0.052	33%	0.334	C	S	.	.			trans	-108.4	137.6	-174.8	-62.7	179.4	0	0	0	109.5	D80 V81 V145 A148 G152 C157	D80-L154 VanDerWaalsContact C-CD2 3.49Å; D80-L154 HydrophobicContact CB-CD2 3.91Å; D80-L154 WeakPolarHBondContact O-CD2 3.32Å; V81-L154 HydrophobicContact CG1-CD1 4.33Å; V81-L154 HydrophobicContact CG2-CD1 4.17Å; V81-L154 HydrophobicContact CG2-CD2 4.24Å; V145-L154 HydrophobicContact CG1-CD1 4.28Å; A148-L154 HydrophobicContact CB-CD1 3.63Å; A148-L154 HydrophobicContact CB-CD2 4.48Å; A148-L154 HydrophobicContact CB-CG 3.81Å; G152-L154 VanDerWaalsContact C-N 3.35Å; L154-C157 VanDerWaalsContact CB-SG 3.53Å; L154-C157 VanDerWaalsContact CD1-SG 3.57Å; L154-C157 VanDerWaalsContact O-O 3.06Å
155	K	89.9	Confident	88.5	Confident	204 Å²	204	58.4 Å²	58.4	89%	0.887	34%	0.337	S	S	*	.	S	Bend	trans	-79.9	-25.6	177.1	-64.4	-176.2	-178.1	178.5	0	112.1	D80	D80-K155 PolarHBondContact OD2-N 3.06Å
156	A	90.8	Very high	87.1	Confident	40 Å²	40	63.2 Å²	63.2	33%	0.331	36%	0.363	S	S	.	.	S	Bend	trans	-78.2	-16.7	-174.4	0	0	0	0	0	114.3	V81 F220	V81-A156 HydrophobicContact CG2-CB 3.85Å; A156-F220 HydrophobicContact CB-CE2 4.28Å; A156-F220 HydrophobicContact CB-CZ 3.88Å
157	C	93.6	Very high	85.8	Confident	20 Å²	20	68.2 Å²	68.2	14%	0.135	39%	0.386	C	S	.	.			trans	-147.8	162.6	-174.8	58.1	0	0	0	0	111.4	C149 L154 F220	C149-C157 VanDerWaalsContact CA-SG 3.52Å; C149-C157 HydrophobicContact CB-CB 3.8Å; C149-C157 WeakPolarHBondContact CB-SG 3.2Å; C149-C157 WeakPolarHBondContact SG-CB 3.3Å; C149-C157 CovalentContact SG-SG 2.02Å; C149-C157 PolarHBondContact SG-SG 2.99Å; L154-C157 VanDerWaalsContact CB-SG 3.53Å; L154-C157 VanDerWaalsContact CD1-SG 3.57Å; L154-C157 VanDerWaalsContact O-O 3.06Å; C157-F220 HydrophobicContact CB-CB 4.43Å; C157-F220 HydrophobicContact CB-CD1 3.63Å; C157-F220 HydrophobicContact CB-CD2 3.93Å; C157-F220 HydrophobicContact CB-CE1 3.75Å; C157-F220 HydrophobicContact CB-CE2 4.04Å; C157-F220 HydrophobicContact CB-CG 3.72Å; C157-F220 HydrophobicContact CB-CZ 3.96Å
158	G	92	Very high	84.7	Confident	33 Å²	33	71.9 Å²	71.9	34%	0.34	40%	0.402	S	S	.	.			trans	-141.4	-150.6	175.7	0	0	0	0	0	111.6
159	C	92.3	Very high	83.6	Confident	66 Å²	66	73.1 Å²	73.1	45%	0.446	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-68.3	148.9	173.9	-47.6	0	0	0	0	111.2	A161 C214 S215	C159-A161 PolarHBondContact O-N 3.06Å; C159-A161 VanDerWaalsContact O-N 3.09Å; C159-C214 VanDerWaalsContact CA-SG 3.58Å; C159-C214 HydrophobicContact CB-CB 4.06Å; C159-C214 WeakPolarHBondContact CB-SG 3.07Å; C159-C214 WeakPolarHBondContact SG-CB 3.21Å; C159-C214 CovalentContact SG-SG 2.02Å; C159-C214 PolarHBondContact SG-SG 2.76Å; C159-S215 CarbonylContact C-O 3.57Å; C159-S215 WeakPolarHBondContact CA-O 3.11Å
160	D	89.8	Confident	82.4	Confident	26 Å²	26	74.8 Å²	74.8	14%	0.139	42%	0.42	C	S	.	.			trans	-61.4	110.1	171.5	-179.4	3.3	0	0	0	110.7	S162 R163 S215 D217	D160-S162 VanDerWaalsContact C-N 3.26Å; D160-S162 VanDerWaalsContact CG-OG 3.23Å; D160-S162 PolarHBondContact O-N 3.01Å; D160-S162 WeakPolarHBondContact OD1-CB 3.41Å; D160-S162 PolarHBondContact OD1-N 3.45Å; D160-S162 PolarHBondContact OD1-OG 3.11Å; D160-S162 PolarHBondContact OD2-OG 3.42Å; D160-R163 PolarHBondContact O-N 2.82Å; D160-R163 VanDerWaalsContact OD2-CD 3.31Å; D160-R163 WeakPolarHBondContact OD2-CD 3.47Å; D160-R163 IonicContact OD2-NE 3.6Å; D160-S215 PolarHBondContact N-O 2.85Å; D160-D217 HydrophobicContact CB-CB 4.42Å
161	A	83.1	Confident	81.7	Confident	84 Å²	84	82.7 Å²	82.7	69%	0.694	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-67	-26.9	-179.2	0	0	0	0	0	112.8	C159 R163 R164	C159-A161 PolarHBondContact O-N 3.06Å; C159-A161 VanDerWaalsContact O-N 3.09Å; A161-R163 PolarHBondContact O-N 3.19Å; A161-R164 PolarHBondContact O-N 3.02Å
162	S	78.9	Confident	81.1	Confident	97 Å²	97	84.9 Å²	84.9	68%	0.678	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-69.6	-18.5	-177	72	0	0	0	0	113.3	D160	D160-S162 VanDerWaalsContact C-N 3.26Å; D160-S162 VanDerWaalsContact CG-OG 3.23Å; D160-S162 PolarHBondContact O-N 3.01Å; D160-S162 WeakPolarHBondContact OD1-CB 3.41Å; D160-S162 PolarHBondContact OD1-N 3.45Å; D160-S162 PolarHBondContact OD1-OG 3.11Å; D160-S162 PolarHBondContact OD2-OG 3.42Å
163	R	71.2	Confident	80.4	Confident	81 Å²	81	84.1 Å²	84.1	31%	0.306	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-116	14.8	-177.3	-65	176.2	177.2	173	-9.8	112.6	D160 A161 G165 Q278	D160-R163 PolarHBondContact O-N 2.82Å; D160-R163 VanDerWaalsContact OD2-CD 3.31Å; D160-R163 WeakPolarHBondContact OD2-CD 3.47Å; D160-R163 IonicContact OD2-NE 3.6Å; A161-R163 PolarHBondContact O-N 3.19Å; R163-G165 PolarHBondContact O-N 2.99Å; R163-Q278 VanDerWaalsContact NH1-NE2 3.17Å
164	R	68	Low	79.8	Confident	171 Å²	171	81.5 Å²	81.5	65%	0.645	42%	0.416	S	S	*	.			trans	-72	111.7	172.8	-155.8	173.5	-162.4	-168.9	0.5	107.5	A161 E167	A161-R164 PolarHBondContact O-N 3.02Å; R164-E167 IonicContact NH2-OE1 3.27Å
165	G	65.7	Low	79.4	Confident	16 Å²	16	86.5 Å²	86.5	17%	0.165	44%	0.439	C	S	.	.			trans	-68.4	165.9	174.9	0	0	0	0	0	111.8	R163 E167 W211	R163-G165 PolarHBondContact O-N 2.99Å; G165-E167 PolarHBondContact O-N 3.43Å; G165-W211 VanDerWaalsContact CA-CB 3.49Å; G165-W211 VanDerWaalsContact CA-O 3.27Å; G165-W211 WeakPolarHBondContact CA-O 3.43Å
166	D	68	Low	79.1	Confident	101 Å²	101	85.3 Å²	85.3	54%	0.54	43%	0.429	S	S	.	.			trans	-69.5	94.6	176.1	-175.1	-12.5	0	0	0	109.6	E168 A169 F170	D166-E168 PolarHBondContact O-N 3.41Å; D166-E168 WeakPolarHBondContact OD1-CB 3.35Å; D166-E168 PolarHBondContact OD1-N 3.44Å; D166-A169 HydrophobicContact CB-CB 3.83Å; D166-A169 PolarHBondContact O-N 2.91Å; D166-A169 PolarHBondContact OD1-N 3.49Å; D166-A169 VanDerWaalsContact OD1-N 3.08Å; D166-F170 PolarHBondContact O-N 3.48Å
167	E	69.7	Low	78.4	Confident	105 Å²	105	86.1 Å²	86.1	49%	0.491	43%	0.428	S	S	.	.	H	α-helix	trans	-59.8	-28.1	179.4	-65.6	-165.4	157.8	0	0	111.9	R164 G165 R171	R164-E167 IonicContact NH2-OE1 3.27Å; G165-E167 PolarHBondContact O-N 3.43Å; E167-R171 VanDerWaalsContact O-CG 3.27Å; E167-R171 WeakPolarHBondContact O-CG 3.23Å; E167-R171 PolarHBondContact O-N 3.18Å
168	E	72.9	Confident	77.8	Confident	118 Å²	118	90.7 Å²	90.7	55%	0.551	45%	0.447	S	S	*	.	H	α-helix	trans	-72.4	-42.9	177	-64.3	-171.1	-172.4	0	0	111.7	D166 F170 R171 R172	D166-E168 PolarHBondContact O-N 3.41Å; D166-E168 WeakPolarHBondContact OD1-CB 3.35Å; D166-E168 PolarHBondContact OD1-N 3.44Å; E168-F170 PolarHBondContact O-N 3.18Å; E168-R171 PolarHBondContact O-N 3.33Å; E168-R172 VanDerWaalsContact O-CG 3.3Å; E168-R172 WeakPolarHBondContact O-CG 3.49Å; E168-R172 PolarHBondContact O-N 2.84Å; E168-R172 IonicContact OE2-CZ 3.7Å; E168-R172 IonicContact OE2-NH2 3.93Å; E168-R172 PolarHBondContact OE2-NH2 3.34Å
169	A	71.5	Confident	77.3	Confident	35 Å²	35	92.7 Å²	92.7	29%	0.289	45%	0.449	S	S	.	.	H	α-helix	trans	-56.1	-43	174	0	0	0	0	0	110.8	D166 R172 K173	D166-A169 HydrophobicContact CB-CB 3.83Å; D166-A169 PolarHBondContact O-N 2.91Å; D166-A169 PolarHBondContact OD1-N 3.49Å; D166-A169 VanDerWaalsContact OD1-N 3.08Å; A169-R172 PolarHBondContact O-N 3.08Å; A169-K173 WeakPolarHBondContact O-CB 3.38Å; A169-K173 PolarHBondContact O-N 3.5Å
170	F	71.3	Confident	76.8	Confident	36 Å²	36	92.3 Å²	92.3	16%	0.158	44%	0.443	C	S	.	.	H	α-helix	trans	-61.8	-46.7	176.3	-174.7	-101.7	0	0	0	112.9	D166 E168 R172 K173 L174 E210 L273 T275	D166-F170 PolarHBondContact O-N 3.48Å; E168-F170 PolarHBondContact O-N 3.18Å; F170-R172 VanDerWaalsContact C-N 3.32Å; F170-R172 PolarHBondContact O-N 3.07Å; F170-K173 PolarHBondContact O-N 3.19Å; F170-L174 WeakPolarHBondContact O-CB 3.14Å; F170-L174 PolarHBondContact O-N 2.81Å; F170-E210 WeakPolarHBondContact CA-OE2 3.26Å; F170-E210 WeakPolarHBondContact CB-OE2 3.44Å; F170-E210 HydrophobicContact CD2-CB 4.34Å; F170-E210 WeakPolarHBondContact CD2-OE2 3.44Å; F170-E210 PolarHBondContact N-OE2 3.34Å; F170-L273 HydrophobicContact CD2-CD1 4.16Å; F170-L273 HydrophobicContact CE2-CD1 3.58Å; F170-L273 HydrophobicContact CE2-CD2 4.01Å; F170-L273 HydrophobicContact CE2-CG 3.76Å; F170-L273 HydrophobicContact CZ-CD1 4.3Å; F170-L273 HydrophobicContact CZ-CD2 3.86Å; F170-L273 HydrophobicContact CZ-CG 4.04Å; F170-T275 WeakPolarHBondContact CE2-OG1 3.21Å; F170-T275 WeakPolarHBondContact CZ-OG1 2.98Å
171	R	78.3	Confident	76	Confident	187 Å²	187	93.5 Å²	93.5	71%	0.706	46%	0.456	S	S	*	.	H	α-helix	trans	-61	-42.1	177.3	-72	175.4	72.1	84.8	4.2	111.5	E167 E168 L174 H175	E167-R171 VanDerWaalsContact O-CG 3.27Å; E167-R171 WeakPolarHBondContact O-CG 3.23Å; E167-R171 PolarHBondContact O-N 3.18Å; E168-R171 PolarHBondContact O-N 3.33Å; R171-L174 PolarHBondContact O-N 3.45Å; R171-H175 WeakPolarHBondContact O-CB 3.34Å; R171-H175 PolarHBondContact O-N 3.44Å
172	R	81.3	Confident	75.7	Confident	171 Å²	171	94.5 Å²	94.5	65%	0.645	45%	0.449	S	S	*	.	H	α-helix	trans	-64.3	-42.7	177.1	-68.5	175.1	-160.8	-173.5	9.7	111.4	E168 A169 F170 H175 R176	E168-R172 VanDerWaalsContact O-CG 3.3Å; E168-R172 WeakPolarHBondContact O-CG 3.49Å; E168-R172 PolarHBondContact O-N 2.84Å; E168-R172 IonicContact OE2-CZ 3.7Å; E168-R172 IonicContact OE2-NH2 3.93Å; E168-R172 PolarHBondContact OE2-NH2 3.34Å; A169-R172 PolarHBondContact O-N 3.08Å; F170-R172 VanDerWaalsContact C-N 3.32Å; F170-R172 PolarHBondContact O-N 3.07Å; R172-H175 PolarHBondContact O-N 2.92Å; R172-R176 PolarHBondContact O-N 3.4Å
173	K	77.9	Confident	75.6	Confident	42 Å²	42	96.4 Å²	96.4	18%	0.183	45%	0.448	C	S	.	.	H	α-helix	trans	-66.4	-43.7	177.2	-173.6	175.9	-177.4	177.6	0	112.6	A169 F170 H175 R176 L177 S208 E210 L273	A169-K173 WeakPolarHBondContact O-CB 3.38Å; A169-K173 PolarHBondContact O-N 3.5Å; F170-K173 PolarHBondContact O-N 3.19Å; K173-H175 VanDerWaalsContact C-N 3.34Å; K173-H175 PolarHBondContact O-N 3.15Å; K173-R176 PolarHBondContact O-N 3.22Å; K173-L177 HydrophobicContact CG-CD1 4.2Å; K173-L177 WeakPolarHBondContact O-CG 3.45Å; K173-L177 PolarHBondContact O-N 3.19Å; K173-S208 VanDerWaalsContact NZ-CB 3.35Å; K173-S208 PolarHBondContact NZ-O 3.09Å; K173-S208 PolarHBondContact NZ-OG 3.26Å; K173-E210 WeakPolarHBondContact CD-OE1 3.49Å; K173-E210 IonicContact NZ-OE1 2.81Å; K173-L273 HydrophobicContact CD-CD1 3.97Å; K173-L273 HydrophobicContact CG-CD1 4.13Å
174	L	77.7	Confident	75.4	Confident	68 Å²	68	101.8 Å²	101.8	36%	0.356	47%	0.468	S	S	.	.	H	α-helix	trans	-58.6	-47.1	175	175.1	62.9	0	0	0	110.9	F170 R171 R176 L177 Q178 L273	F170-L174 WeakPolarHBondContact O-CB 3.14Å; F170-L174 PolarHBondContact O-N 2.81Å; R171-L174 PolarHBondContact O-N 3.45Å; L174-R176 VanDerWaalsContact C-N 3.35Å; L174-R176 PolarHBondContact O-N 2.98Å; L174-L177 PolarHBondContact O-N 3.33Å; L174-Q178 WeakPolarHBondContact O-CB 3.46Å; L174-Q178 PolarHBondContact O-N 3.4Å; L174-L273 HydrophobicContact CB-CD2 3.88Å; L174-L273 HydrophobicContact CD1-CD2 3.33Å; L174-L273 HydrophobicContact CG-CD2 4.15Å
175	H	83.4	Confident	75	Confident	116 Å²	116	96 Å²	96	54%	0.537	46%	0.461	S	S	.	.	H	α-helix	trans	-59.7	-44	177.5	-175.4	-100.8	0	0	0	112	R171 R172 K173 Q178 L179	R171-H175 WeakPolarHBondContact O-CB 3.34Å; R171-H175 PolarHBondContact O-N 3.44Å; R172-H175 PolarHBondContact O-N 2.92Å; K173-H175 VanDerWaalsContact C-N 3.34Å; K173-H175 PolarHBondContact O-N 3.15Å; H175-Q178 PolarHBondContact O-N 2.92Å; H175-L179 WeakPolarHBondContact O-CG 3.38Å; H175-L179 PolarHBondContact O-N 2.94Å
176	R	84.5	Confident	74.5	Confident	178 Å²	178	104.4 Å²	104.4	67%	0.672	49%	0.493	S	S	*	.	H	α-helix	trans	-59.5	-49.2	175.3	-177.4	178	178	166.1	1.8	112.2	R172 K173 L174 Q178 L179 D180	R172-R176 PolarHBondContact O-N 3.4Å; K173-R176 PolarHBondContact O-N 3.22Å; L174-R176 VanDerWaalsContact C-N 3.35Å; L174-R176 PolarHBondContact O-N 2.98Å; R176-Q178 VanDerWaalsContact C-N 3.31Å; R176-Q178 PolarHBondContact O-N 2.81Å; R176-L179 PolarHBondContact O-N 3.41Å; R176-D180 PolarHBondContact O-N 3.04Å
177	L	76.1	Confident	73.5	Confident	58 Å²	58	102.6 Å²	102.6	30%	0.304	50%	0.499	S	S	.	.	H	α-helix	trans	-65.4	-34.7	-179.8	-70.6	172.8	0	0	0	112.7	K173 L174 D180 A181 L273	K173-L177 HydrophobicContact CG-CD1 4.2Å; K173-L177 WeakPolarHBondContact O-CG 3.45Å; K173-L177 PolarHBondContact O-N 3.19Å; L174-L177 PolarHBondContact O-N 3.33Å; L177-D180 PolarHBondContact O-N 3.5Å; L177-A181 WeakPolarHBondContact O-CB 3.5Å; L177-A181 PolarHBondContact O-N 3.47Å; L177-L273 HydrophobicContact CD1-CB 3.78Å; L177-L273 HydrophobicContact CD1-CD1 3.95Å; L177-L273 HydrophobicContact CD1-CD2 4.38Å; L177-L273 HydrophobicContact CD1-CG 4.25Å
178	Q	80.2	Confident	72.3	Confident	116 Å²	116	105 Å²	105	54%	0.542	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-39.7	175.8	-171.8	172.7	-2.5	0	0	111.5	L174 H175 R176 A181 L182	L174-Q178 WeakPolarHBondContact O-CB 3.46Å; L174-Q178 PolarHBondContact O-N 3.4Å; H175-Q178 PolarHBondContact O-N 2.92Å; R176-Q178 VanDerWaalsContact C-N 3.31Å; R176-Q178 PolarHBondContact O-N 2.81Å; Q178-A181 PolarHBondContact O-N 2.69Å; Q178-L182 WeakPolarHBondContact O-CG 3.49Å; Q178-L182 PolarHBondContact O-N 3.47Å
179	L	82.3	Confident	71.1	Confident	75 Å²	75	104.3 Å²	104.3	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-65.1	-44.9	173.5	-71.8	173	0	0	0	112	H175 R176 A181 L182 Q183	H175-L179 WeakPolarHBondContact O-CG 3.38Å; H175-L179 PolarHBondContact O-N 2.94Å; R176-L179 PolarHBondContact O-N 3.41Å; L179-A181 VanDerWaalsContact C-N 3.26Å; L179-A181 PolarHBondContact O-N 3.07Å; L179-L182 PolarHBondContact O-N 3.4Å; L179-Q183 WeakPolarHBondContact O-CG 3.27Å; L179-Q183 PolarHBondContact O-N 3.19Å
180	D	80	Confident	69.5	Low	58 Å²	58	111.9 Å²	111.9	31%	0.31	55%	0.551	S	S	.	*	H	α-helix	trans	-60.4	-38	177.1	-67.4	-15.9	0	0	0	111.4	R176 L177 R184	R176-D180 PolarHBondContact O-N 3.04Å; L177-D180 PolarHBondContact O-N 3.5Å; D180-R184 WeakPolarHBondContact O-CG 3.31Å; D180-R184 PolarHBondContact O-N 3.1Å
181	A	73.6	Confident	67.9	Low	50 Å²	50	113.4 Å²	113.4	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-67.3	-40.9	175.8	0	0	0	0	0	112.5	L177 Q178 L179 R184 G185	L177-A181 WeakPolarHBondContact O-CB 3.5Å; L177-A181 PolarHBondContact O-N 3.47Å; Q178-A181 PolarHBondContact O-N 2.69Å; L179-A181 VanDerWaalsContact C-N 3.26Å; L179-A181 PolarHBondContact O-N 3.07Å; A181-R184 PolarHBondContact O-N 2.85Å; A181-G185 PolarHBondContact O-N 3.4Å
182	L	76.8	Confident	65.8	Low	105 Å²	105	111.5 Å²	111.5	55%	0.55	59%	0.586	S	S	.	*	H	α-helix	trans	-66.1	-39.4	176	-74.6	167	0	0	0	112.1	Q178 L179 G185 K186	Q178-L182 WeakPolarHBondContact O-CG 3.49Å; Q178-L182 PolarHBondContact O-N 3.47Å; L179-L182 PolarHBondContact O-N 3.4Å; L182-G185 PolarHBondContact O-N 3.04Å; L182-K186 PolarHBondContact O-N 2.86Å
183	Q	78.1	Confident	63.9	Low	138 Å²	138	108.9 Å²	108.9	65%	0.645	59%	0.591	S	S	*	*	H	α-helix	trans	-65.5	-40.6	176.3	-72.6	178.1	-0.3	0	0	111.6	L179 G185 K186	L179-Q183 WeakPolarHBondContact O-CG 3.27Å; L179-Q183 PolarHBondContact O-N 3.19Å; Q183-G185 VanDerWaalsContact C-N 3.32Å; Q183-G185 PolarHBondContact O-N 3.09Å; Q183-K186 PolarHBondContact O-N 2.97Å
184	R	66.7	Low	61.8	Low	193 Å²	193	115.3 Å²	115.3	73%	0.728	62%	0.622	S	S	*	*	H	α-helix	trans	-65.4	-33.9	172.6	-75.8	178.5	178.2	154	1.7	112.9	D180 A181 K186 G187	D180-R184 WeakPolarHBondContact O-CG 3.31Å; D180-R184 PolarHBondContact O-N 3.1Å; A181-R184 PolarHBondContact O-N 2.85Å; R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.5Å; R184-G187 PolarHBondContact O-N 2.03Å
185	G	59.6	Low	60	Low	49 Å²	49	121.3 Å²	121.3	51%	0.505	65%	0.648	S	S	.	*	H	α-helix	trans	-70.7	-23.5	177.9	0	0	0	0	0	114.8	A181 L182 Q183 G187	A181-G185 PolarHBondContact O-N 3.4Å; L182-G185 PolarHBondContact O-N 3.04Å; Q183-G185 VanDerWaalsContact C-N 3.32Å; Q183-G185 PolarHBondContact O-N 3.09Å; G185-G187 VanDerWaalsContact C-N 3.31Å
186	K	54.8	Low	57.8	Low	193 Å²	193	121.4 Å²	121.4	84%	0.839	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-3	176.7	-77.2	-174.4	175.9	-174.3	0	114.3	L182 Q183 R184	L182-K186 PolarHBondContact O-N 2.86Å; Q183-K186 PolarHBondContact O-N 2.97Å; R184-K186 VanDerWaalsContact C-N 3.35Å; R184-K186 PolarHBondContact O-N 3.5Å
187	G	46.7	Very low	55.4	Low	64 Å²	64	117.5 Å²	117.5	66%	0.66	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	1.5	178.4	0	0	0	0	0	115.8	R184 G185 S189	R184-G187 PolarHBondContact O-N 2.03Å; G185-G187 VanDerWaalsContact C-N 3.31Å; G187-S189 PolarHBondContact O-N 3.14Å
188	L	45.8	Very low	53.5	Low	156 Å²	156	122.6 Å²	122.6	82%	0.817	69%	0.691	S	S	*	*			trans	-96.4	67.5	-179.1	-75.4	125.1	0	0	0	111.4
189	S	47.7	Very low	51.4	Low	103 Å²	103	122.4 Å²	122.4	72%	0.72	70%	0.7	S	S	*	*	S	Bend	trans	-107	114.3	157.2	-172.8	0	0	0	0	107.2	G187	G187-S189 PolarHBondContact O-N 3.14Å
190	H	37.6	Very low	49.1	Very low	193 Å²	193	125.1 Å²	125.1	89%	0.894	72%	0.72	S	S	*	*	S	Bend	trans	21.3	104.2	165.3	-70.4	-73.6	0	0	0	118.3
191	G	36.4	Very low	46.9	Very low	68 Å²	68	126.6 Å²	126.6	70%	0.701	74%	0.74	S	S	*	*			trans	178.2	127.2	159.9	0	0	0	0	0	109.5	P193	G191-P193 VanDerWaalsContact O-CD 3.25Å; G191-P193 WeakPolarHBondContact O-CD 3.45Å
192	V	34.6	Very low	44.9	Very low	148 Å²	148	129.4 Å²	129.4	90%	0.897	76%	0.757	S	S	*	*			trans	-80.6	118.8	159.1	172	0	0	0	0	105.5
193	P	41.3	Very low	43	Very low	116 Å²	116	130.9 Å²	130.9	75%	0.753	77%	0.772	S	S	*	*			trans	-113.2	127.9	157.8	3.1	20.2	0	0	0	108.8	G191	G191-P193 VanDerWaalsContact O-CD 3.25Å; G191-P193 WeakPolarHBondContact O-CD 3.45Å
194	E	34.1	Very low	41	Very low	177 Å²	177	127.5 Å²	127.5	83%	0.827	78%	0.775	S	S	*	*			trans	-42.8	149.7	165.4	-78.3	163.4	100.8	0	0	112.7	P196	E194-P196 VanDerWaalsContact O-CD 3.29Å; E194-P196 WeakPolarHBondContact O-CD 3.25Å
195	H	40.1	Very low	40.1	Very low	193 Å²	193	125 Å²	125	89%	0.894	78%	0.775	S	S	*	*			trans	-42.8	134.9	172	-70.4	-70.6	0	0	0	112.8
196	P	37.5	Very low	39.5	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	79%	0.786	S	S	*	*				-124.5	137.8	125.8	7.8	13.4	0	0	0	110.2	E194 L198	E194-P196 VanDerWaalsContact O-CD 3.29Å; E194-P196 WeakPolarHBondContact O-CD 3.25Å; P196-L198 PolarHBondContact O-N 2.69Å
197	A	34.4	Very low	39.6	Very low	96 Å²	96	127.3 Å²	127.3	79%	0.793	78%	0.78	S	S	*	*			trans	-24.6	114.1	177.8	0	0	0	0	0	115.2
198	L	36.2	Very low	40.6	Very low	165 Å²	165	126.4 Å²	126.4	86%	0.864	76%	0.763	S	S	*	*			trans	-54.3	124.7	159.2	-90.1	148.6	0	0	0	107.9	P196 T200	P196-L198 PolarHBondContact O-N 2.69Å; L198-T200 PolarHBondContact O-N 2.84Å
199	P	35.9	Very low	42	Very low	111 Å²	111	121.9 Å²	121.9	72%	0.721	74%	0.736	S	S	*	*			trans	-59.5	129.5	168.9	11.9	-8.3	0	0	0	107.4	A201	P199-A201 PolarHBondContact O-N 2.97Å
200	T	33.6	Very low	43.6	Very low	133 Å²	133	118.9 Å²	118.9	82%	0.816	71%	0.71	S	S	*	*			trans	-31.1	121.5	171	19.1	0	0	0	0	110.9	L198 S202	L198-T200 PolarHBondContact O-N 2.84Å; T200-S202 PolarHBondContact O-N 3.43Å
201	A	33	Very low	45.8	Very low	89 Å²	89	113.7 Å²	113.7	74%	0.736	68%	0.683	S	S	*	*			trans	-37.2	109.5	177.1	0	0	0	0	0	110.6	P199 P203	P199-A201 PolarHBondContact O-N 2.97Å; A201-P203 WeakPolarHBondContact O-CD 3.47Å; A201-P203 VanDerWaalsContact O-N 3.08Å
202	S	32.2	Very low	48.1	Very low	109 Å²	109	110.8 Å²	110.8	76%	0.762	65%	0.653	S	S	*	*			trans	-58.8	115.9	169.3	-51.8	0	0	0	0	107.3	T200 G204	T200-S202 PolarHBondContact O-N 3.43Å; S202-G204 PolarHBondContact O-N 3.11Å
203	P	35.9	Very low	50.5	Low	135 Å²	135	106.1 Å²	106.1	88%	0.877	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	83.9	177.1	30.6	-28.4	0	0	0	106.7	A201	A201-P203 WeakPolarHBondContact O-CD 3.47Å; A201-P203 VanDerWaalsContact O-N 3.08Å
204	G	37.4	Very low	52.9	Low	67 Å²	67	102.1 Å²	102.1	69%	0.691	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-165.5	-18.8	-173.6	0	0	0	0	0	118.8	S202	S202-G204 PolarHBondContact O-N 3.11Å
205	L	46.9	Very low	55.7	Low	142 Å²	142	93.9 Å²	93.9	74%	0.743	57%	0.571	S	S	*	*	S	Bend	trans	-120.7	-21.5	-175.3	-152.5	70.3	0	0	0	115.3	D207 S208	L205-D207 VanDerWaalsContact C-N 3.3Å; L205-D207 PolarHBondContact O-N 3.43Å; L205-S208 PolarHBondContact O-OG 3.43Å
206	Q	47.5	Very low	58.2	Low	157 Å²	157	84.8 Å²	84.8	73%	0.734	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-13.7	-177.8	-71	-174.7	5.5	0	0	114.4
207	D	56.2	Low	60.9	Low	133 Å²	133	80.9 Å²	80.9	71%	0.711	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	5.4	178.3	-90.2	-28.4	0	0	0	114.6	L205 W209 K274	L205-D207 VanDerWaalsContact C-N 3.3Å; L205-D207 PolarHBondContact O-N 3.43Å; D207-W209 PolarHBondContact O-N 3.45Å; D207-K274 IonicContact OD1-NZ 3.98Å
208	S	68.3	Low	63.7	Low	44 Å²	44	76.9 Å²	76.9	31%	0.308	47%	0.467	S	S	.	.			trans	-77.7	88.7	174.6	63.8	0	0	0	0	110.5	K173 L205	K173-S208 VanDerWaalsContact NZ-CB 3.35Å; K173-S208 PolarHBondContact NZ-O 3.09Å; K173-S208 PolarHBondContact NZ-OG 3.26Å; L205-S208 PolarHBondContact O-OG 3.43Å
209	W	76.3	Confident	66.5	Low	62 Å²	62	70 Å²	70	24%	0.235	44%	0.435	C	S	.	.			trans	-99.8	157.9	165.9	60	-83.7	0	0	0	109.8	D207 W211 R260 K274 C276	D207-W209 PolarHBondContact O-N 3.45Å; W209-W211 AromaticContact CH2-CD2 3.85Å; W209-W211 HydrophobicContact CH2-CD2 3.85Å; W209-W211 AromaticContact CH2-CE2 3.33Å; W209-W211 HydrophobicContact CH2-CE3 4.35Å; W209-W211 HydrophobicContact CH2-CG 4.38Å; W209-W211 AromaticContact CH2-CH2 3.95Å; W209-W211 HydrophobicContact CH2-CH2 3.95Å; W209-W211 AromaticContact CH2-CZ2 3.42Å; W209-W211 HydrophobicContact CH2-CZ2 3.42Å; W209-W211 VanDerWaalsContact CH2-CZ2 3.42Å; W209-W211 HydrophobicContact CH2-CZ3 4.39Å; W209-W211 AromaticContact CH2-NE1 3.57Å; W209-W211 AromaticContact CZ3-CD1 3.97Å; W209-W211 AromaticContact CZ3-CD2 3.46Å; W209-W211 HydrophobicContact CZ3-CD2 3.46Å; W209-W211 VanDerWaalsContact CZ3-CD2 3.46Å; W209-W211 AromaticContact CZ3-CE2 3.49Å; W209-W211 VanDerWaalsContact CZ3-CE2 3.49Å; W209-W211 AromaticContact CZ3-CE3 3.83Å; W209-W211 HydrophobicContact CZ3-CE3 3.83Å; W209-W211 AromaticContact CZ3-CG 3.81Å; W209-W211 HydrophobicContact CZ3-CG 3.81Å; W209-W211 HydrophobicContact CZ3-CH2 4.2Å; W209-W211 AromaticContact CZ3-CZ2 3.9Å; W209-W211 HydrophobicContact CZ3-CZ2 3.9Å; W209-W211 HydrophobicContact CZ3-CZ3 4.17Å; W209-W211 AromaticContact CZ3-NE1 3.79Å; W209-R260 VanDerWaalsContact NE1-NH1 3.16Å; W209-K274 HydrophobicContact CB-CD 4.23Å; W209-K274 HydrophobicContact CB-CG 3.59Å; W209-C276 HydrophobicContact CD2-CB 4.19Å; W209-C276 HydrophobicContact CE3-CB 3.45Å; W209-C276 VanDerWaalsContact CE3-CB 3.45Å; W209-C276 VanDerWaalsContact CE3-SG 3.51Å; W209-C276 HydrophobicContact CZ3-CB 3.82Å
210	E	80.9	Confident	69.3	Low	40 Å²	40	66.1 Å²	66.1	19%	0.187	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	146.6	179.6	-68.4	172.5	-162.4	0	0	110	F170 K173 K274 T275 C276	F170-E210 WeakPolarHBondContact CA-OE2 3.26Å; F170-E210 WeakPolarHBondContact CB-OE2 3.44Å; F170-E210 HydrophobicContact CD2-CB 4.34Å; F170-E210 WeakPolarHBondContact CD2-OE2 3.44Å; F170-E210 PolarHBondContact N-OE2 3.34Å; K173-E210 WeakPolarHBondContact CD-OE1 3.49Å; K173-E210 IonicContact NZ-OE1 2.81Å; E210-K274 PolarHBondContact N-O 3.29Å; E210-T275 WeakPolarHBondContact O-CA 3.48Å; E210-C276 PolarHBondContact O-N 2.87Å
211	W	83	Confident	72.3	Confident	84 Å²	84	59.8 Å²	59.8	32%	0.318	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	142.8	170.5	-72.1	109.5	0	0	0	109.1	G165 W209 C276 Q278	G165-W211 VanDerWaalsContact CA-CB 3.49Å; G165-W211 VanDerWaalsContact CA-O 3.27Å; G165-W211 WeakPolarHBondContact CA-O 3.43Å; W209-W211 AromaticContact CH2-CD2 3.85Å; W209-W211 HydrophobicContact CH2-CD2 3.85Å; W209-W211 AromaticContact CH2-CE2 3.33Å; W209-W211 HydrophobicContact CH2-CE3 4.35Å; W209-W211 HydrophobicContact CH2-CG 4.38Å; W209-W211 AromaticContact CH2-CH2 3.95Å; W209-W211 HydrophobicContact CH2-CH2 3.95Å; W209-W211 AromaticContact CH2-CZ2 3.42Å; W209-W211 HydrophobicContact CH2-CZ2 3.42Å; W209-W211 VanDerWaalsContact CH2-CZ2 3.42Å; W209-W211 HydrophobicContact CH2-CZ3 4.39Å; W209-W211 AromaticContact CH2-NE1 3.57Å; W209-W211 AromaticContact CZ3-CD1 3.97Å; W209-W211 AromaticContact CZ3-CD2 3.46Å; W209-W211 HydrophobicContact CZ3-CD2 3.46Å; W209-W211 VanDerWaalsContact CZ3-CD2 3.46Å; W209-W211 AromaticContact CZ3-CE2 3.49Å; W209-W211 VanDerWaalsContact CZ3-CE2 3.49Å; W209-W211 AromaticContact CZ3-CE3 3.83Å; W209-W211 HydrophobicContact CZ3-CE3 3.83Å; W209-W211 AromaticContact CZ3-CG 3.81Å; W209-W211 HydrophobicContact CZ3-CG 3.81Å; W209-W211 HydrophobicContact CZ3-CH2 4.2Å; W209-W211 AromaticContact CZ3-CZ2 3.9Å; W209-W211 HydrophobicContact CZ3-CZ2 3.9Å; W209-W211 HydrophobicContact CZ3-CZ3 4.17Å; W209-W211 AromaticContact CZ3-NE1 3.79Å; W211-C276 WeakPolarHBondContact CA-O 3.09Å; W211-Q278 HydrophobicContact CH2-CG 3.84Å; W211-Q278 HydrophobicContact CZ3-CG 3.77Å
212	G	84.6	Confident	75.3	Confident	7 Å²	7	58.6 Å²	58.6	7%	0.072	35%	0.347	C	S	.	.			trans	-177.1	-166.3	174.2	0	0	0	0	0	109.4	T275 C276 W277	G212-T275 VanDerWaalsContact CA-CG2 3.45Å; G212-C276 PolarHBondContact N-O 3.49Å; G212-W277 VanDerWaalsContact O-CB 3.29Å; G212-W277 WeakPolarHBondContact O-CB 3.05Å
213	G	85.9	Confident	78.3	Confident	49 Å²	49	59.8 Å²	59.8	51%	0.505	34%	0.335	S	S	.	.	S	Bend	trans	65.1	-156.4	-175.1	0	0	0	0	0	112.6
214	C	91.1	Very high	81.2	Confident	33 Å²	33	53.9 Å²	53.9	22%	0.223	30%	0.296	C	S	.	.			trans	-118.8	107.8	-177.4	-173	0	0	0	0	110.4	A150 C159	A150-C214 WeakPolarHBondContact CA-SG 3.15Å; A150-C214 PolarHBondContact O-SG 3.43Å; C159-C214 VanDerWaalsContact CA-SG 3.58Å; C159-C214 HydrophobicContact CB-CB 4.06Å; C159-C214 WeakPolarHBondContact CB-SG 3.07Å; C159-C214 WeakPolarHBondContact SG-CB 3.21Å; C159-C214 CovalentContact SG-SG 2.02Å; C159-C214 PolarHBondContact SG-SG 2.76Å
215	S	92.3	Very high	84	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.021	26%	0.263	C	S	.	.			trans	-84.1	134.9	170.9	-63.9	0	0	0	0	109.7	C159 D160 D217 Q278	C159-S215 CarbonylContact C-O 3.57Å; C159-S215 WeakPolarHBondContact CA-O 3.11Å; D160-S215 PolarHBondContact N-O 2.85Å; S215-D217 PolarHBondContact O-N 3.21Å; S215-Q278 PolarHBondContact OG-N 3Å
216	P	93	Very high	86.3	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.013	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-58.2	132.1	173.7	-24.7	33.3	0	0	0	112.9	S146 A150 M218 M258 Q278 T280	S146-P216 WeakPolarHBondContact O-CB 3.46Å; A150-P216 HydrophobicContact CB-CB 4.14Å; A150-P216 HydrophobicContact CB-CG 3.82Å; P216-M218 HydrophobicContact CB-SD 4.18Å; P216-M218 PolarHBondContact O-N 3.47Å; P216-M258 HydrophobicContact CB-CE 4.39Å; P216-M258 HydrophobicContact CG-CE 4.37Å; P216-Q278 WeakPolarHBondContact CD-O 3.37Å; P216-T280 HydrophobicContact CB-CG2 4.33Å; P216-T280 HydrophobicContact CG-CG2 4.16Å
217	D	94	Very high	88.4	Confident	37 Å²	37	46.2 Å²	46.2	20%	0.198	24%	0.239	C	C	.	.			trans	-74.4	89.3	169.3	-176.3	-7	0	0	0	110.2	D160 S215 G219 F220 G221	D160-D217 HydrophobicContact CB-CB 4.42Å; S215-D217 PolarHBondContact O-N 3.21Å; D217-G219 PolarHBondContact O-N 3.32Å; D217-G219 WeakPolarHBondContact OD1-CA 3.17Å; D217-G219 PolarHBondContact OD1-N 2.92Å; D217-F220 HydrophobicContact CB-CB 4.16Å; D217-F220 PolarHBondContact O-N 3.22Å; D217-F220 PolarHBondContact OD1-N 2.91Å; D217-F220 WeakPolarHBondContact OD2-CB 3.33Å; D217-G221 PolarHBondContact O-N 3.01Å
218	M	93.7	Very high	90.1	Very high	13 Å²	13	39.9 Å²	39.9	6%	0.064	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-27.8	177	-62.6	-53.5	-66.2	0	0	112.8	V142 P216 G221 E222 V254 M255 M258 T280	V142-M218 HydrophobicContact CG1-CE 3.47Å; V142-M218 VanDerWaalsContact CG1-CE 3.47Å; P216-M218 HydrophobicContact CB-SD 4.18Å; P216-M218 PolarHBondContact O-N 3.47Å; M218-G221 PolarHBondContact O-N 3.5Å; M218-E222 WeakPolarHBondContact O-CB 3.49Å; M218-E222 PolarHBondContact O-N 3.01Å; M218-V254 HydrophobicContact CE-CB 4.22Å; M218-V254 HydrophobicContact CE-CG1 3.61Å; M218-M255 HydrophobicContact CB-CG 4.31Å; M218-M255 HydrophobicContact CE-CB 4.49Å; M218-M255 HydrophobicContact CE-CG 3.77Å; M218-M258 HydrophobicContact CG-CE 3.6Å; M218-M258 HydrophobicContact CG-CG 4.31Å; M218-M258 HydrophobicContact CG-SD 3.25Å; M218-M258 WeakPolarHBondContact CG-SD 3.45Å; M218-M258 HydrophobicContact SD-CE 3.81Å; M218-M258 HydrophobicContact SD-CG 4.47Å; M218-M258 HydrophobicContact SD-SD 3.98Å; M218-T280 HydrophobicContact SD-CG2 4.01Å
219	G	94.5	Very high	91.3	Very high	20 Å²	20	37.8 Å²	37.8	21%	0.206	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-42	178.8	0	0	0	0	0	111	D217 R223	D217-G219 PolarHBondContact O-N 3.32Å; D217-G219 WeakPolarHBondContact OD1-CA 3.17Å; D217-G219 PolarHBondContact OD1-N 2.92Å; G219-R223 VanDerWaalsContact C-CZ 3.5Å; G219-R223 VanDerWaalsContact C-NH1 3.35Å; G219-R223 WeakPolarHBondContact O-CB 3.04Å; G219-R223 VanDerWaalsContact O-CG 3.29Å; G219-R223 WeakPolarHBondContact O-CG 3.36Å; G219-R223 PolarHBondContact O-N 3.12Å; G219-R223 PolarHBondContact O-NH1 3.08Å
220	F	95.9	Very high	91.9	Very high	30 Å²	30	36.1 Å²	36.1	13%	0.132	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-48.1	172.2	-177.6	-89.8	0	0	0	111.5	V81 V145 C149 A156 C157 D217 E222 R223 F224	V81-F220 HydrophobicContact CG1-CE1 3.87Å; V81-F220 HydrophobicContact CG1-CZ 4.29Å; V81-F220 HydrophobicContact CG2-CE1 4.22Å; V81-F220 HydrophobicContact CG2-CZ 4.07Å; V145-F220 HydrophobicContact CG1-CD1 3.86Å; V145-F220 HydrophobicContact CG1-CE1 3.8Å; C149-F220 VanDerWaalsContact SG-CD1 3.54Å; A156-F220 HydrophobicContact CB-CE2 4.28Å; A156-F220 HydrophobicContact CB-CZ 3.88Å; C157-F220 HydrophobicContact CB-CB 4.43Å; C157-F220 HydrophobicContact CB-CD1 3.63Å; C157-F220 HydrophobicContact CB-CD2 3.93Å; C157-F220 HydrophobicContact CB-CE1 3.75Å; C157-F220 HydrophobicContact CB-CE2 4.04Å; C157-F220 HydrophobicContact CB-CG 3.72Å; C157-F220 HydrophobicContact CB-CZ 3.96Å; D217-F220 HydrophobicContact CB-CB 4.16Å; D217-F220 PolarHBondContact O-N 3.22Å; D217-F220 PolarHBondContact OD1-N 2.91Å; D217-F220 WeakPolarHBondContact OD2-CB 3.33Å; F220-E222 PolarHBondContact O-N 3.35Å; F220-R223 PolarHBondContact O-N 3.18Å; F220-F224 WeakPolarHBondContact O-CB 3.36Å; F220-F224 PolarHBondContact O-N 2.99Å
221	G	95.9	Very high	91.9	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.1	-44.1	177.9	0	0	0	0	0	113.2	D217 M218 S225	D217-G221 PolarHBondContact O-N 3.01Å; M218-G221 PolarHBondContact O-N 3.5Å; G221-S225 VanDerWaalsContact O-CB 3.25Å; G221-S225 WeakPolarHBondContact O-CB 3.06Å; G221-S225 PolarHBondContact O-N 3.4Å
222	E	96.4	Very high	91.5	Very high	63 Å²	63	33.9 Å²	33.9	29%	0.294	18%	0.179	S	C	.	.	H	α-helix	trans	-63.9	-46.4	177.3	-170.5	-167.6	-168	0	0	112.2	M218 F220 S225 K226 R251 M255	M218-E222 WeakPolarHBondContact O-CB 3.49Å; M218-E222 PolarHBondContact O-N 3.01Å; F220-E222 PolarHBondContact O-N 3.35Å; E222-S225 PolarHBondContact O-N 3.26Å; E222-K226 WeakPolarHBondContact O-CB 3.37Å; E222-K226 PolarHBondContact O-N 2.74Å; E222-R251 HydrophobicContact CG-CB 4.46Å; E222-M255 HydrophobicContact CB-CE 4.41Å; E222-M255 HydrophobicContact CB-SD 3.93Å; E222-M255 HydrophobicContact CG-SD 3.87Å; E222-M255 WeakPolarHBondContact OE2-CE 3.34Å
223	R	95.9	Very high	90.5	Very high	135 Å²	135	38.1 Å²	38.1	51%	0.509	20%	0.197	S	C	.	.	H	α-helix	trans	-61.1	-48.7	177.8	-74.7	-173.1	-59.8	-90	3.4	111.2	G219 F220 S225 K226 D227	G219-R223 VanDerWaalsContact C-CZ 3.5Å; G219-R223 VanDerWaalsContact C-NH1 3.35Å; G219-R223 WeakPolarHBondContact O-CB 3.04Å; G219-R223 VanDerWaalsContact O-CG 3.29Å; G219-R223 WeakPolarHBondContact O-CG 3.36Å; G219-R223 PolarHBondContact O-N 3.12Å; G219-R223 PolarHBondContact O-NH1 3.08Å; F220-R223 PolarHBondContact O-N 3.18Å; R223-S225 PolarHBondContact O-N 2.03Å; R223-K226 VanDerWaalsContact O-CB 3.25Å; R223-K226 WeakPolarHBondContact O-CB 3.45Å; R223-K226 PolarHBondContact O-N 3.01Å; R223-D227 PolarHBondContact O-N 2.81Å
224	F	96	Very high	89.5	Confident	10 Å²	10	39.7 Å²	39.7	4%	0.044	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-44.8	177.7	-173	-87.6	0	0	0	111.7	V74 H78 V81 A82 A85 V141 V145 F220 K226 D227 F228	V74-F224 HydrophobicContact CG1-CD2 4.45Å; V74-F224 HydrophobicContact CG1-CE2 3.86Å; V74-F224 HydrophobicContact CG1-CZ 4.22Å; H78-F224 HydrophobicContact CB-CE2 4.23Å; V81-F224 HydrophobicContact CB-CD2 4.08Å; V81-F224 HydrophobicContact CB-CE2 3.68Å; V81-F224 HydrophobicContact CB-CZ 3.96Å; V81-F224 HydrophobicContact CG1-CB 4.43Å; V81-F224 HydrophobicContact CG1-CD1 3.79Å; V81-F224 HydrophobicContact CG1-CD2 3.39Å; V81-F224 HydrophobicContact CG1-CE1 3.86Å; V81-F224 HydrophobicContact CG1-CE2 3.43Å; V81-F224 VanDerWaalsContact CG1-CE2 3.43Å; V81-F224 HydrophobicContact CG1-CG 3.57Å; V81-F224 HydrophobicContact CG1-CZ 3.67Å; A82-F224 HydrophobicContact CB-CZ 4.27Å; A85-F224 HydrophobicContact CB-CD1 4.24Å; A85-F224 HydrophobicContact CB-CE1 3.57Å; V141-F224 HydrophobicContact CG1-CD1 4.19Å; V145-F224 HydrophobicContact CG2-CD1 4.11Å; F220-F224 WeakPolarHBondContact O-CB 3.36Å; F220-F224 PolarHBondContact O-N 2.99Å; F224-K226 VanDerWaalsContact C-N 3.29Å; F224-K226 PolarHBondContact O-N 2.91Å; F224-D227 PolarHBondContact O-N 3.14Å; F224-F228 HydrophobicContact CD1-CB 4.27Å; F224-F228 HydrophobicContact CE1-CB 3.9Å; F224-F228 HydrophobicContact CE1-CD1 4.49Å; F224-F228 HydrophobicContact CE1-CG 4.07Å; F224-F228 HydrophobicContact CZ-CB 4.36Å; F224-F228 HydrophobicContact CZ-CD2 4.44Å; F224-F228 HydrophobicContact CZ-CG 4.42Å; F224-F228 VanDerWaalsContact O-CB 3.23Å; F224-F228 WeakPolarHBondContact O-CB 3.44Å; F224-F228 PolarHBondContact O-N 3.38Å
225	S	95.6	Very high	88	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.007	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-39.8	176.1	-176.8	0	0	0	0	111.8	A138 G221 E222 R223 L229	A138-S225 PolarHBondContact O-OG 2.77Å; G221-S225 VanDerWaalsContact O-CB 3.25Å; G221-S225 WeakPolarHBondContact O-CB 3.06Å; G221-S225 PolarHBondContact O-N 3.4Å; E222-S225 PolarHBondContact O-N 3.26Å; R223-S225 PolarHBondContact O-N 2.03Å; S225-L229 VanDerWaalsContact O-CB 3.22Å; S225-L229 WeakPolarHBondContact O-CB 3.48Å; S225-L229 WeakPolarHBondContact O-CG 3.26Å; S225-L229 PolarHBondContact O-N 3.3Å
226	K	94.7	Very high	87.1	Confident	118 Å²	118	54.5 Å²	54.5	51%	0.513	25%	0.254	S	S	.	.	I	π-helix	trans	-58.6	-57.2	172.5	-162.9	176.6	174.7	-175.4	0	111.1	E222 R223 F224 F228 L229 D230 R251	E222-K226 WeakPolarHBondContact O-CB 3.37Å; E222-K226 PolarHBondContact O-N 2.74Å; R223-K226 VanDerWaalsContact O-CB 3.25Å; R223-K226 WeakPolarHBondContact O-CB 3.45Å; R223-K226 PolarHBondContact O-N 3.01Å; F224-K226 VanDerWaalsContact C-N 3.29Å; F224-K226 PolarHBondContact O-N 2.91Å; K226-F228 VanDerWaalsContact C-N 3.26Å; K226-F228 PolarHBondContact O-N 2.91Å; K226-L229 PolarHBondContact O-N 3.29Å; K226-D230 HydrophobicContact CG-CB 4.43Å; K226-D230 WeakPolarHBondContact CG-OD2 3.47Å; K226-D230 WeakPolarHBondContact O-CA 3.35Å; K226-D230 WeakPolarHBondContact O-CB 3.38Å; K226-D230 PolarHBondContact O-N 3.21Å; K226-R251 VanDerWaalsContact CG-NH1 3.33Å
227	D	93	Very high	86.7	Confident	87 Å²	87	58.8 Å²	58.8	47%	0.465	28%	0.276	S	S	.	.	I	π-helix	trans	-67.6	-30.3	-172.1	-64.3	-17.2	0	0	0	111.6	V74 R223 F224 S231	V74-D227 HydrophobicContact CG2-CB 4.16Å; R223-D227 PolarHBondContact O-N 2.81Å; F224-D227 PolarHBondContact O-N 3.14Å; D227-S231 WeakPolarHBondContact O-CB 3.41Å; D227-S231 PolarHBondContact O-OG 3.36Å
228	F	92.2	Very high	86.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	28%	0.275	C	S	.	.	I	π-helix	trans	-85.8	-35.5	179.7	-169	-110.4	0	0	0	114	L67 Q71 V74 F224 K226	L67-F228 HydrophobicContact CD2-CE2 3.92Å; L67-F228 HydrophobicContact CD2-CZ 3.85Å; Q71-F228 HydrophobicContact CB-CE2 4.34Å; Q71-F228 VanDerWaalsContact CG-O 3.3Å; Q71-F228 WeakPolarHBondContact CG-O 3.05Å; Q71-F228 PolarHBondContact NE2-O 3.47Å; V74-F228 HydrophobicContact CG1-CB 4.42Å; V74-F228 HydrophobicContact CG1-CD2 4.26Å; F224-F228 HydrophobicContact CD1-CB 4.27Å; F224-F228 HydrophobicContact CE1-CB 3.9Å; F224-F228 HydrophobicContact CE1-CD1 4.49Å; F224-F228 HydrophobicContact CE1-CG 4.07Å; F224-F228 HydrophobicContact CZ-CB 4.36Å; F224-F228 HydrophobicContact CZ-CD2 4.44Å; F224-F228 HydrophobicContact CZ-CG 4.42Å; F224-F228 VanDerWaalsContact O-CB 3.23Å; F224-F228 WeakPolarHBondContact O-CB 3.44Å; F224-F228 PolarHBondContact O-N 3.38Å; K226-F228 VanDerWaalsContact C-N 3.26Å; K226-F228 PolarHBondContact O-N 2.91Å
229	L	92	Very high	86.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.281	C	S	.	.	I	π-helix	trans	-100.2	-33.4	-174.9	-56.2	-175.4	0	0	0	113.7	I89 Y118 A138 V141 S225 K226	I89-L229 HydrophobicContact CD1-CD2 4.45Å; Y118-L229 HydrophobicContact CE2-CD2 3.71Å; Y118-L229 WeakPolarHBondContact OH-CD2 3.45Å; A138-L229 VanDerWaalsContact CA-CD1 3.45Å; A138-L229 HydrophobicContact CB-CD1 3.76Å; V141-L229 HydrophobicContact CB-CD1 4.36Å; V141-L229 HydrophobicContact CG2-CD1 3.95Å; V141-L229 HydrophobicContact CG2-CD2 4.33Å; V141-L229 HydrophobicContact CG2-CG 4.42Å; S225-L229 VanDerWaalsContact O-CB 3.22Å; S225-L229 WeakPolarHBondContact O-CB 3.48Å; S225-L229 WeakPolarHBondContact O-CG 3.26Å; S225-L229 PolarHBondContact O-N 3.3Å; K226-L229 PolarHBondContact O-N 3.29Å
230	D	90.4	Very high	85.8	Confident	27 Å²	27	59.4 Å²	59.4	14%	0.144	28%	0.275	C	S	.	.	I	π-helix	trans	-86.7	-15.5	-176.7	-61.8	-17.7	0	0	0	112.3	K226 R232 L244 N247 R251	K226-D230 HydrophobicContact CG-CB 4.43Å; K226-D230 WeakPolarHBondContact CG-OD2 3.47Å; K226-D230 WeakPolarHBondContact O-CA 3.35Å; K226-D230 WeakPolarHBondContact O-CB 3.38Å; K226-D230 PolarHBondContact O-N 3.21Å; D230-R232 VanDerWaalsContact C-N 3.25Å; D230-R232 PolarHBondContact O-N 2.95Å; D230-L244 HydrophobicContact CB-CD2 3.41Å; D230-L244 VanDerWaalsContact CB-CD2 3.41Å; D230-N247 PolarHBondContact OD1-ND2 3.16Å; D230-R251 IonicContact OD1-NH2 2.95Å; D230-R251 IonicContact OD2-CZ 3.61Å; D230-R251 IonicContact OD2-NH1 3.28Å; D230-R251 PolarHBondContact OD2-NH1 3.25Å; D230-R251 IonicContact OD2-NH2 3.91Å; D230-R251 PolarHBondContact OD2-NH2 3.05Å
231	S	79.5	Confident	85.4	Confident	17 Å²	17	60.1 Å²	60.1	12%	0.119	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-5.1	-176.1	59.6	0	0	0	0	115.6	R70 Q71 D227 E233	R70-S231 VanDerWaalsContact CD-O 3.23Å; R70-S231 WeakPolarHBondContact CD-O 3.31Å; Q71-S231 WeakPolarHBondContact CG-OG 3.48Å; D227-S231 WeakPolarHBondContact O-CB 3.41Å; D227-S231 PolarHBondContact O-OG 3.36Å; S231-E233 PolarHBondContact O-N 3.38Å
232	R	75.4	Confident	85.2	Confident	59 Å²	59	60.1 Å²	60.1	22%	0.223	28%	0.277	C	S	.	.	S	Bend	trans	-61.2	135.3	171.8	-65.8	-176.5	82.1	-168.1	10.5	109.9	Y118 D230 R243	Y118-R232 VanDerWaalsContact CB-NH1 3.27Å; Y118-R232 PolarHBondContact O-NH2 3.4Å; D230-R232 VanDerWaalsContact C-N 3.25Å; D230-R232 PolarHBondContact O-N 2.95Å; R232-R243 PolarHBondContact O-NH2 2.93Å
233	E	63.9	Low	85	Confident	96 Å²	96	58 Å²	58	45%	0.449	27%	0.266	S	S	.	.			trans	-36.9	123.3	-168.5	-69.2	-59	145.1	0	0	114.4	S231 H235	S231-E233 PolarHBondContact O-N 3.38Å; E233-H235 PolarHBondContact O-N 3.06Å; E233-H235 VanDerWaalsContact O-N 3.08Å; E233-H235 PolarHBondContact O-ND1 2.94Å
234	P	63.8	Low	84.8	Confident	83 Å²	83	54.5 Å²	54.5	54%	0.539	26%	0.257	S	S	.	.			trans	-75.4	102.1	-175.8	30.9	-32.6	0	0	0	109.4
235	H	60.9	Low	84.7	Confident	117 Å²	117	55 Å²	55	54%	0.542	26%	0.26	S	S	.	.			trans	-85.7	128.6	157.3	-59.1	66.7	0	0	0	105.6	E233 D237 A240	E233-H235 PolarHBondContact O-N 3.06Å; E233-H235 VanDerWaalsContact O-N 3.08Å; E233-H235 PolarHBondContact O-ND1 2.94Å; H235-D237 HydrophobicContact CB-CB 4.13Å; H235-D237 WeakPolarHBondContact CB-OD2 3.33Å; H235-D237 IonicContact CG-OD2 3.57Å; H235-D237 PolarHBondContact O-N 3.27Å; H235-A240 WeakPolarHBondContact O-CB 3.46Å
236	R	72.4	Confident	84.7	Confident	229 Å²	229	55 Å²	55	86%	0.864	26%	0.259	S	S	*	.			trans	-64.7	6.5	178.4	-70.4	-179.2	174.4	179.6	-1	113
237	D	83.8	Confident	84.7	Confident	92 Å²	92	49.4 Å²	49.4	49%	0.492	24%	0.235	S	C	.	.	S	Bend	trans	-64.4	158.3	-178.1	-52.9	-8.9	0	0	0	112.6	H235 H239 A240 R241	H235-D237 HydrophobicContact CB-CB 4.13Å; H235-D237 WeakPolarHBondContact CB-OD2 3.33Å; H235-D237 IonicContact CG-OD2 3.57Å; H235-D237 PolarHBondContact O-N 3.27Å; D237-H239 PolarHBondContact O-N 2.86Å; D237-H239 VanDerWaalsContact O-N 3.14Å; D237-A240 PolarHBondContact O-N 2.93Å; D237-R241 PolarHBondContact O-N 2.99Å
238	I	87	Confident	84.9	Confident	32 Å²	32	50.5 Å²	50.5	16%	0.164	23%	0.233	C	C	.	.	H	α-helix	trans	-53.5	-34.5	175.9	-170.3	174.2	0	0	0	112.8	R241 M242 I300 P302 F339	I238-R241 PolarHBondContact O-N 3.31Å; I238-M242 WeakPolarHBondContact O-CB 3.44Å; I238-M242 PolarHBondContact O-N 2.83Å; I238-I300 HydrophobicContact CD1-CD1 4.27Å; I238-I300 HydrophobicContact CG1-CD1 4.07Å; I238-P302 HydrophobicContact CD1-CB 3.95Å; I238-F339 HydrophobicContact CD1-CB 3.35Å; I238-F339 HydrophobicContact CD1-CD1 4.05Å; I238-F339 HydrophobicContact CD1-CD2 3.99Å; I238-F339 HydrophobicContact CD1-CG 3.55Å; I238-F339 HydrophobicContact CG1-CB 4.13Å; I238-F339 HydrophobicContact CG1-CD1 3.93Å; I238-F339 HydrophobicContact CG1-CE1 4.5Å; I238-F339 HydrophobicContact CG1-CG 3.96Å; I238-F339 HydrophobicContact CG2-CD1 4.38Å; I238-F339 HydrophobicContact CG2-CD2 4.1Å; I238-F339 HydrophobicContact CG2-CE1 4.26Å; I238-F339 HydrophobicContact CG2-CE2 3.98Å; I238-F339 HydrophobicContact CG2-CG 4.32Å; I238-F339 HydrophobicContact CG2-CZ 4.07Å
239	H	88.3	Confident	85.1	Confident	42 Å²	42	50.5 Å²	50.5	19%	0.194	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-43.6	-178.1	-174.3	-100.2	0	0	0	112.5	F123 Y134 D237 R241 M242 R243 F339	F123-H239 PolarHBondContact O-CE1 2.93Å; F123-H239 PolarHBondContact O-NE2 3.17Å; Y134-H239 PolarHBondContact OH-CE1 2.85Å; Y134-H239 VanDerWaalsContact OH-CE1 3.27Å; D237-H239 PolarHBondContact O-N 2.86Å; D237-H239 VanDerWaalsContact O-N 3.14Å; H239-R241 VanDerWaalsContact C-N 3.32Å; H239-R241 PolarHBondContact O-N 3.27Å; H239-M242 PolarHBondContact O-N 3.14Å; H239-R243 WeakPolarHBondContact O-CB 3.32Å; H239-R243 PolarHBondContact O-N 3.32Å; H239-F339 HydrophobicContact CB-CE1 4.16Å; H239-F339 HydrophobicContact CB-CZ 4.05Å; H239-F339 AromaticContact CD2-CE1 3.9Å; H239-F339 AromaticContact CD2-CZ 3.86Å
240	A	88.3	Confident	85.3	Confident	9 Å²	9	50.5 Å²	50.5	7%	0.074	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-38.3	175.5	0	0	0	0	0	111.4	H235 D237 R243 L244	H235-A240 WeakPolarHBondContact O-CB 3.46Å; D237-A240 PolarHBondContact O-N 2.93Å; A240-R243 PolarHBondContact O-N 3.34Å; A240-L244 WeakPolarHBondContact O-CB 3.47Å; A240-L244 VanDerWaalsContact O-CG 3.23Å; A240-L244 WeakPolarHBondContact O-CG 3.23Å; A240-L244 PolarHBondContact O-N 3.31Å
241	R	88.6	Confident	85.7	Confident	46 Å²	46	49.7 Å²	49.7	17%	0.174	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-44.6	176.6	-65.1	172.8	63.7	-165	-3	111.7	D237 I238 H239 H245 G308 Q309 L310	D237-R241 PolarHBondContact O-N 2.99Å; I238-R241 PolarHBondContact O-N 3.31Å; H239-R241 VanDerWaalsContact C-N 3.32Å; H239-R241 PolarHBondContact O-N 3.27Å; R241-H245 WeakPolarHBondContact O-CB 3.18Å; R241-H245 PolarHBondContact O-N 3.02Å; R241-G308 PolarHBondContact NH2-O 3.16Å; R241-Q309 PolarHBondContact NH2-O 2.92Å; R241-L310 HydrophobicContact CB-CD2 4.25Å
242	M	91.4	Very high	86.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.2	-51.1	173.6	-178.1	-170.3	85.2	0	0	111	S130 Y134 I238 H239 H245 N246 V337 F339	S130-M242 WeakPolarHBondContact OG-CE 3.43Å; Y134-M242 HydrophobicContact CD2-CE 4.09Å; Y134-M242 HydrophobicContact CE2-CE 3.89Å; I238-M242 WeakPolarHBondContact O-CB 3.44Å; I238-M242 PolarHBondContact O-N 2.83Å; H239-M242 PolarHBondContact O-N 3.14Å; M242-H245 PolarHBondContact O-N 3.25Å; M242-N246 VanDerWaalsContact CG-ND2 3.33Å; M242-N246 WeakPolarHBondContact CG-ND2 3.28Å; M242-N246 WeakPolarHBondContact O-CB 3.12Å; M242-N246 PolarHBondContact O-N 2.91Å; M242-N246 PolarHBondContact O-ND2 3.43Å; M242-V337 HydrophobicContact CG-CG2 4.19Å; M242-V337 VanDerWaalsContact CG-O 3.3Å; M242-V337 WeakPolarHBondContact CG-O 3.32Å; M242-F339 HydrophobicContact CB-CD1 4.14Å; M242-F339 HydrophobicContact CB-CE1 4.2Å; M242-F339 HydrophobicContact CE-CE1 4.16Å; M242-F339 HydrophobicContact CG-CD1 4.32Å; M242-F339 HydrophobicContact CG-CE1 4.5Å; M242-F339 HydrophobicContact SD-CD1 3.52Å; M242-F339 VanDerWaalsContact SD-CD1 3.52Å; M242-F339 HydrophobicContact SD-CE1 3.54Å; M242-F339 VanDerWaalsContact SD-CE1 3.54Å
243	R	91.6	Very high	87.5	Confident	18 Å²	18	48.7 Å²	48.7	7%	0.068	22%	0.223	C	C	.	.	H	α-helix	trans	-55.6	-54.3	178.5	175.9	179	78.7	-165.1	7.1	112.1	Y134 R232 H239 A240 H245 N246 N247	Y134-R243 HydrophobicContact CD1-CB 4.39Å; Y134-R243 HydrophobicContact CD1-CG 3.65Å; Y134-R243 HydrophobicContact CD2-CB 4.47Å; Y134-R243 HydrophobicContact CE1-CB 4.13Å; Y134-R243 HydrophobicContact CE1-CG 3.42Å; Y134-R243 VanDerWaalsContact CE1-CG 3.42Å; Y134-R243 HydrophobicContact CE2-CB 4.22Å; Y134-R243 HydrophobicContact CE2-CG 4.39Å; Y134-R243 HydrophobicContact CG-CG 4.23Å; R232-R243 PolarHBondContact O-NH2 2.93Å; H239-R243 WeakPolarHBondContact O-CB 3.32Å; H239-R243 PolarHBondContact O-N 3.32Å; A240-R243 PolarHBondContact O-N 3.34Å; R243-H245 VanDerWaalsContact C-N 3.3Å; R243-H245 PolarHBondContact O-N 3.34Å; R243-N246 PolarHBondContact O-N 3.21Å; R243-N247 VanDerWaalsContact O-CB 3.31Å; R243-N247 WeakPolarHBondContact O-CB 3.47Å; R243-N247 VanDerWaalsContact O-CG 3.22Å; R243-N247 PolarHBondContact O-N 2.87Å; R243-N247 PolarHBondContact O-OD1 2.88Å
244	L	92.1	Very high	89.1	Confident	61 Å²	61	44.1 Å²	44.1	32%	0.319	20%	0.202	S	C	.	.	H	α-helix	trans	-61.3	-39.6	-177.9	-68.2	175.5	0	0	0	112	D230 A240 R248	D230-L244 HydrophobicContact CB-CD2 3.41Å; D230-L244 VanDerWaalsContact CB-CD2 3.41Å; A240-L244 WeakPolarHBondContact O-CB 3.47Å; A240-L244 VanDerWaalsContact O-CG 3.23Å; A240-L244 WeakPolarHBondContact O-CG 3.23Å; A240-L244 PolarHBondContact O-N 3.31Å; L244-R248 WeakPolarHBondContact O-CB 3.45Å; L244-R248 PolarHBondContact O-N 3.12Å; L244-R248 VanDerWaalsContact O-N 3.08Å
245	H	93.4	Very high	90.5	Very high	22 Å²	22	43 Å²	43	10%	0.102	19%	0.19	C	C	.	.	H	α-helix	trans	-63.2	-54.1	175.4	-178.4	84.6	0	0	0	111.3	R241 M242 R243 N247 R248 V249 L310 P333 D335 V337	R241-H245 WeakPolarHBondContact O-CB 3.18Å; R241-H245 PolarHBondContact O-N 3.02Å; M242-H245 PolarHBondContact O-N 3.25Å; R243-H245 VanDerWaalsContact C-N 3.3Å; R243-H245 PolarHBondContact O-N 3.34Å; H245-N247 VanDerWaalsContact C-N 3.34Å; H245-N247 PolarHBondContact O-N 3.12Å; H245-R248 WeakPolarHBondContact O-CA 3.34Å; H245-R248 WeakPolarHBondContact O-CB 3.3Å; H245-R248 PolarHBondContact O-N 2.92Å; H245-V249 WeakPolarHBondContact NE2-CG2 3.29Å; H245-V249 WeakPolarHBondContact O-CG2 3.02Å; H245-V249 PolarHBondContact O-N 3.4Å; H245-L310 HydrophobicContact CB-CD1 4.21Å; H245-P333 PolarHBondContact CE1-O 3.23Å; H245-D335 PolarHBondContact NE2-O 2.84Å; H245-V337 HydrophobicContact CB-CG2 4.01Å; H245-V337 VanDerWaalsContact CD2-CG2 3.45Å; H245-V337 WeakPolarHBondContact CD2-CG2 3.46Å
246	N	95.8	Very high	92.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.6	-36.6	-177.3	-67.2	-32.5	0	0	0	112.1	A131 A135 M242 R243 R248 V249 G250 L336 V337	A131-N246 VanDerWaalsContact CA-ND2 3.31Å; A131-N246 WeakPolarHBondContact CA-ND2 3.41Å; A131-N246 WeakPolarHBondContact CB-ND2 3.45Å; A135-N246 VanDerWaalsContact CA-O 3.32Å; A135-N246 WeakPolarHBondContact CA-O 3.47Å; A135-N246 WeakPolarHBondContact CB-O 3.34Å; M242-N246 VanDerWaalsContact CG-ND2 3.33Å; M242-N246 WeakPolarHBondContact CG-ND2 3.28Å; M242-N246 WeakPolarHBondContact O-CB 3.12Å; M242-N246 PolarHBondContact O-N 2.91Å; M242-N246 PolarHBondContact O-ND2 3.43Å; R243-N246 PolarHBondContact O-N 3.21Å; N246-R248 VanDerWaalsContact C-N 3.33Å; N246-R248 PolarHBondContact O-N 3.38Å; N246-V249 PolarHBondContact O-N 3.14Å; N246-G250 PolarHBondContact O-N 3.42Å; N246-L336 HydrophobicContact CB-CD2 4.18Å; N246-L336 WeakPolarHBondContact OD1-CA 3.34Å; N246-L336 WeakPolarHBondContact OD1-CD2 3.22Å; N246-V337 PolarHBondContact ND2-O 2.87Å; N246-V337 PolarHBondContact OD1-N 3.35Å; N246-V337 PolarHBondContact OD1-O 2.56Å
247	N	95.7	Very high	93.1	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-59.2	-43.1	170.9	-75.4	-4.4	0	0	0	111.3	Y134 A138 D230 R243 H245 G250 R251	Y134-N247 WeakPolarHBondContact CB-OD1 3.24Å; Y134-N247 PolarHBondContact O-OD1 2.82Å; A138-N247 HydrophobicContact CB-CB 3.96Å; A138-N247 WeakPolarHBondContact CB-O 3.33Å; D230-N247 PolarHBondContact OD1-ND2 3.16Å; R243-N247 VanDerWaalsContact O-CB 3.31Å; R243-N247 WeakPolarHBondContact O-CB 3.47Å; R243-N247 VanDerWaalsContact O-CG 3.22Å; R243-N247 PolarHBondContact O-N 2.87Å; R243-N247 PolarHBondContact O-OD1 2.88Å; H245-N247 VanDerWaalsContact C-N 3.34Å; H245-N247 PolarHBondContact O-N 3.12Å; N247-G250 PolarHBondContact O-N 3.45Å; N247-R251 VanDerWaalsContact O-CG 3.27Å; N247-R251 WeakPolarHBondContact O-CG 3.21Å; N247-R251 PolarHBondContact O-N 2.85Å; N247-R251 PolarHBondContact O-NE 2.92Å
248	R	95.7	Very high	93.6	Very high	110 Å²	110	31.9 Å²	31.9	42%	0.415	15%	0.148	S	C	.	.	H	α-helix	trans	-62.8	-47.4	175.7	-172.9	-168.6	-55.3	120	2.2	111.5	L244 H245 N246 G250 R251 Q252	L244-R248 WeakPolarHBondContact O-CB 3.45Å; L244-R248 PolarHBondContact O-N 3.12Å; L244-R248 VanDerWaalsContact O-N 3.08Å; H245-R248 WeakPolarHBondContact O-CA 3.34Å; H245-R248 WeakPolarHBondContact O-CB 3.3Å; H245-R248 PolarHBondContact O-N 2.92Å; N246-R248 VanDerWaalsContact C-N 3.33Å; N246-R248 PolarHBondContact O-N 3.38Å; R248-G250 VanDerWaalsContact C-N 3.26Å; R248-G250 PolarHBondContact O-N 2.91Å; R248-R251 PolarHBondContact O-N 3.15Å; R248-Q252 HydrophobicContact CG-CG 4.4Å; R248-Q252 WeakPolarHBondContact O-CB 3.25Å; R248-Q252 WeakPolarHBondContact O-CG 2.97Å; R248-Q252 PolarHBondContact O-N 3.1Å
249	V	96.7	Very high	93.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.4	-43	177.7	172.8	0	0	0	0	111	H245 N246 A253 L290 A334 L336	H245-V249 WeakPolarHBondContact NE2-CG2 3.29Å; H245-V249 WeakPolarHBondContact O-CG2 3.02Å; H245-V249 PolarHBondContact O-N 3.4Å; N246-V249 PolarHBondContact O-N 3.14Å; V249-A253 WeakPolarHBondContact O-CB 3.01Å; V249-A253 PolarHBondContact O-N 3.39Å; V249-L290 HydrophobicContact CG1-CD2 4.35Å; V249-A334 VanDerWaalsContact CG1-O 3.27Å; V249-A334 WeakPolarHBondContact CG1-O 3.06Å; V249-L336 HydrophobicContact CB-CD2 4.15Å; V249-L336 HydrophobicContact CG1-CD2 3.73Å; V249-L336 HydrophobicContact CG1-CG 4.42Å
250	G	97.5	Very high	93.9	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-48.8	174.9	0	0	0	0	0	113.8	A135 A139 N246 N247 R248 A253	A135-G250 VanDerWaalsContact O-CA 3.23Å; A135-G250 WeakPolarHBondContact O-CA 3.35Å; A139-G250 WeakPolarHBondContact CB-O 3.49Å; N246-G250 PolarHBondContact O-N 3.42Å; N247-G250 PolarHBondContact O-N 3.45Å; R248-G250 VanDerWaalsContact C-N 3.26Å; R248-G250 PolarHBondContact O-N 2.91Å; G250-A253 WeakPolarHBondContact O-CB 3.06Å; G250-A253 PolarHBondContact O-N 3.45Å
251	R	97.5	Very high	94.1	Very high	9 Å²	9	44.7 Å²	44.7	3%	0.034	19%	0.193	C	C	.	.	H	α-helix	trans	-61	-47	177.7	-67.4	178.8	-80.9	-174.4	-13.5	111.9	A138 V142 E222 K226 D230 N247 R248 A253 V254 M255	A138-R251 HydrophobicContact CB-CG 4.07Å; V142-R251 HydrophobicContact CG2-CB 4.04Å; V142-R251 HydrophobicContact CG2-CG 3.57Å; E222-R251 HydrophobicContact CG-CB 4.46Å; K226-R251 VanDerWaalsContact CG-NH1 3.33Å; D230-R251 IonicContact OD1-NH2 2.95Å; D230-R251 IonicContact OD2-CZ 3.61Å; D230-R251 IonicContact OD2-NH1 3.28Å; D230-R251 PolarHBondContact OD2-NH1 3.25Å; D230-R251 IonicContact OD2-NH2 3.91Å; D230-R251 PolarHBondContact OD2-NH2 3.05Å; N247-R251 VanDerWaalsContact O-CG 3.27Å; N247-R251 WeakPolarHBondContact O-CG 3.21Å; N247-R251 PolarHBondContact O-N 2.85Å; N247-R251 PolarHBondContact O-NE 2.92Å; R248-R251 PolarHBondContact O-N 3.15Å; R251-A253 VanDerWaalsContact C-N 3.31Å; R251-A253 PolarHBondContact O-N 3.33Å; R251-V254 PolarHBondContact O-N 3.24Å; R251-V254 VanDerWaalsContact O-N 3.15Å; R251-M255 WeakPolarHBondContact O-CG 3.42Å; R251-M255 PolarHBondContact O-N 3.23Å
252	Q	96.1	Very high	94.2	Very high	55 Å²	55	44.8 Å²	44.8	26%	0.257	20%	0.201	S	C	.	.	H	α-helix	trans	-60.7	-39.4	177.5	-74.8	178.7	-21.5	0	0	112.1	R248 V254 M255 E256	R248-Q252 HydrophobicContact CG-CG 4.4Å; R248-Q252 WeakPolarHBondContact O-CB 3.25Å; R248-Q252 WeakPolarHBondContact O-CG 2.97Å; R248-Q252 PolarHBondContact O-N 3.1Å; Q252-V254 PolarHBondContact O-N 2.85Å; Q252-V254 VanDerWaalsContact O-N 3.14Å; Q252-M255 PolarHBondContact O-N 2.98Å; Q252-M255 VanDerWaalsContact O-N 3.09Å; Q252-E256 WeakPolarHBondContact O-CB 3.37Å; Q252-E256 VanDerWaalsContact O-CG 3.28Å; Q252-E256 WeakPolarHBondContact O-CG 3.4Å; Q252-E256 PolarHBondContact O-N 2.89Å
253	A	96.8	Very high	94.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.5	-33	177.3	0	0	0	0	0	112.8	V249 G250 R251 N257 V286 L289 L290	V249-A253 WeakPolarHBondContact O-CB 3.01Å; V249-A253 PolarHBondContact O-N 3.39Å; G250-A253 WeakPolarHBondContact O-CB 3.06Å; G250-A253 PolarHBondContact O-N 3.45Å; R251-A253 VanDerWaalsContact C-N 3.31Å; R251-A253 PolarHBondContact O-N 3.33Å; A253-N257 WeakPolarHBondContact O-CB 3.03Å; A253-N257 PolarHBondContact O-ND2 2.92Å; A253-V286 HydrophobicContact CB-CG1 4.3Å; A253-L289 HydrophobicContact CB-CD2 4.03Å; A253-L290 HydrophobicContact CB-CD2 3.98Å; A253-L290 HydrophobicContact CB-CG 4.31Å
254	V	97	Very high	94.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-77.1	-45.3	175	-170.9	0	0	0	0	111.4	A139 V142 H143 M218 R251 Q252 N257 P281 V286	A139-V254 HydrophobicContact CB-CG2 3.65Å; A139-V254 WeakPolarHBondContact O-CG2 3.39Å; V142-V254 HydrophobicContact CG1-CB 4.25Å; V142-V254 HydrophobicContact CG1-CG1 4.26Å; H143-V254 HydrophobicContact CB-CG1 4.23Å; M218-V254 HydrophobicContact CE-CB 4.22Å; M218-V254 HydrophobicContact CE-CG1 3.61Å; R251-V254 PolarHBondContact O-N 3.24Å; R251-V254 VanDerWaalsContact O-N 3.15Å; Q252-V254 PolarHBondContact O-N 2.85Å; Q252-V254 VanDerWaalsContact O-N 3.14Å; V254-N257 PolarHBondContact O-N 3.45Å; V254-P281 HydrophobicContact CG1-CG 4.16Å; V254-V286 HydrophobicContact CG2-CG1 4.07Å; V254-V286 HydrophobicContact CG2-CG2 4.32Å
255	M	94.6	Very high	94	Very high	59 Å²	59	52.6 Å²	52.6	29%	0.291	24%	0.239	S	C	.	.	H	α-helix	trans	-67.3	-40.7	-175.9	-64.1	172.2	70.8	0	0	112.7	M218 E222 R251 Q252 N257	M218-M255 HydrophobicContact CB-CG 4.31Å; M218-M255 HydrophobicContact CE-CB 4.49Å; M218-M255 HydrophobicContact CE-CG 3.77Å; E222-M255 HydrophobicContact CB-CE 4.41Å; E222-M255 HydrophobicContact CB-SD 3.93Å; E222-M255 HydrophobicContact CG-SD 3.87Å; E222-M255 WeakPolarHBondContact OE2-CE 3.34Å; R251-M255 WeakPolarHBondContact O-CG 3.42Å; R251-M255 PolarHBondContact O-N 3.23Å; Q252-M255 PolarHBondContact O-N 2.98Å; Q252-M255 VanDerWaalsContact O-N 3.09Å; M255-N257 VanDerWaalsContact C-N 3.27Å; M255-N257 PolarHBondContact O-N 3.44Å
256	E	93	Very high	93.5	Very high	113 Å²	113	52.5 Å²	52.5	53%	0.528	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-21	-179.6	-68.8	170.7	172.1	0	0	112.8	Q252 R293	Q252-E256 WeakPolarHBondContact O-CB 3.37Å; Q252-E256 VanDerWaalsContact O-CG 3.28Å; Q252-E256 WeakPolarHBondContact O-CG 3.4Å; Q252-E256 PolarHBondContact O-N 2.89Å; E256-R293 IonicContact OE2-NH2 3.45Å; E256-R293 PolarHBondContact OE2-NH2 2.81Å
257	N	94.5	Very high	93	Very high	62 Å²	62	57.5 Å²	57.5	33%	0.332	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	22.7	-174.1	-66.1	-90.3	0	0	0	112.8	A253 V254 M255 P281 L289	A253-N257 WeakPolarHBondContact O-CB 3.03Å; A253-N257 PolarHBondContact O-ND2 2.92Å; V254-N257 PolarHBondContact O-N 3.45Å; M255-N257 VanDerWaalsContact C-N 3.27Å; M255-N257 PolarHBondContact O-N 3.44Å; N257-P281 HydrophobicContact CB-CB 4.29Å; N257-P281 HydrophobicContact CB-CG 4.21Å; N257-P281 WeakPolarHBondContact O-CB 3.4Å; N257-L289 WeakPolarHBondContact ND2-CD2 3.48Å
258	M	93.3	Very high	92.5	Very high	30 Å²	30	64.2 Å²	64.2	15%	0.148	32%	0.321	C	S	.	.			trans	-60.2	142.9	169	-67.2	-169	87.7	0	0	110.8	P216 M218 Q278	P216-M258 HydrophobicContact CB-CE 4.39Å; P216-M258 HydrophobicContact CG-CE 4.37Å; M218-M258 HydrophobicContact CG-CE 3.6Å; M218-M258 HydrophobicContact CG-CG 4.31Å; M218-M258 HydrophobicContact CG-SD 3.25Å; M218-M258 WeakPolarHBondContact CG-SD 3.45Å; M218-M258 HydrophobicContact SD-CE 3.81Å; M218-M258 HydrophobicContact SD-CG 4.47Å; M218-M258 HydrophobicContact SD-SD 3.98Å; M258-Q278 HydrophobicContact CE-CB 3.68Å; M258-Q278 HydrophobicContact SD-CB 4.47Å; M258-Q278 PolarHBondContact SD-OE1 2.85Å; M258-Q278 VanDerWaalsContact SD-OE1 3.33Å
259	R	91.5	Very high	91.9	Very high	107 Å²	107	61.5 Å²	61.5	40%	0.404	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	144.5	178.8	65.7	177.7	177.2	164.5	-12.7	111	K261 Q278 V279 E282	R259-K261 PolarHBondContact O-N 2.85Å; R259-Q278 CarbonylContact O-C 3.53Å; R259-Q278 WeakPolarHBondContact O-CA 3.45Å; R259-V279 HydrophobicContact CG-CG2 3.31Å; R259-V279 PolarHBondContact N-O 2.96Å; R259-V279 PolarHBondContact O-N 3.48Å; R259-E282 IonicContact CZ-OE1 3.87Å; R259-E282 IonicContact NH1-OE1 3.49Å; R259-E282 IonicContact NH2-OE1 3.81Å; R259-E282 PolarHBondContact NH2-OE1 3.29Å
260	R	90.9	Very high	91.4	Very high	137 Å²	137	63 Å²	63	52%	0.517	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.2	168.1	-174.4	179.7	66.4	-163.9	-1.5	108.6	W209 C276 W277	W209-R260 VanDerWaalsContact NE1-NH1 3.16Å; R260-C276 HydrophobicContact CG-CB 3.66Å; R260-W277 WeakPolarHBondContact CA-O 3.24Å
261	K	92.3	Very high	91	Very high	108 Å²	108	66.2 Å²	66.2	47%	0.47	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.2	170.6	-168.3	171.6	-175.9	176.1	0	108.6	R259 C276 W277 V279	R259-K261 PolarHBondContact O-N 2.85Å; K261-C276 CarbonylContact O-C 3.57Å; K261-C276 VanDerWaalsContact O-CA 3.22Å; K261-C276 WeakPolarHBondContact O-CA 3.31Å; K261-W277 PolarHBondContact N-O 2.96Å; K261-W277 PolarHBondContact O-N 2.84Å; K261-V279 HydrophobicContact CB-CG1 3.98Å; K261-V279 HydrophobicContact CB-CG2 3.95Å; K261-V279 HydrophobicContact CD-CG1 4.41Å
262	C	91.8	Very high	90.3	Very high	49 Å²	49	71.2 Å²	71.2	33%	0.331	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.1	-179.2	-52.7	0	0	0	0	110.6	T275 C276	C262-T275 CarbonylContact C-O 3.58Å; C262-T275 WeakPolarHBondContact CA-O 3.18Å; C262-C276 HydrophobicContact CB-CB 4.01Å; C262-C276 WeakPolarHBondContact CB-SG 3.27Å; C262-C276 WeakPolarHBondContact SG-CB 3.39Å; C262-C276 CovalentContact SG-SG 2.03Å; C262-C276 PolarHBondContact SG-SG 2.04Å
263	K	91.4	Very high	89.7	Confident	121 Å²	121	68.9 Å²	68.9	53%	0.526	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.3	168.7	-178.3	173.9	-178.4	179.8	0	109.3	H265 K274 T275 W277	K263-H265 PolarHBondContact O-CD2 2.97Å; K263-H265 VanDerWaalsContact O-CD2 3.25Å; K263-K274 CarbonylContact O-C 3.53Å; K263-K274 WeakPolarHBondContact O-CA 3.48Å; K263-K274 WeakPolarHBondContact O-CB 3.14Å; K263-T275 PolarHBondContact N-O 2.9Å; K263-T275 PolarHBondContact O-N 2.95Å; K263-W277 HydrophobicContact CB-CH2 3.6Å; K263-W277 HydrophobicContact CB-CZ3 3.85Å; K263-W277 HydrophobicContact CD-CH2 4.49Å
264	C	91.9	Very high	89.3	Confident	41 Å²	41	70.8 Å²	70.8	28%	0.277	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.1	177.6	-59.1	0	0	0	0	109.7	C271	C264-C271 HydrophobicContact CB-CB 3.88Å; C264-C271 WeakPolarHBondContact CB-SG 3.45Å; C264-C271 VanDerWaalsContact SG-CA 3.56Å; C264-C271 WeakPolarHBondContact SG-CB 3.39Å; C264-C271 CovalentContact SG-SG 2.03Å; C264-C271 PolarHBondContact SG-SG 2.81Å
265	H	87.2	Confident	88.8	Confident	81 Å²	81	71.3 Å²	71.3	38%	0.375	38%	0.384	S	S	.	.			trans	-121	2	-172.6	-67.2	-77.6	0	0	0	113.2	K263 L273	K263-H265 PolarHBondContact O-CD2 2.97Å; K263-H265 VanDerWaalsContact O-CD2 3.25Å; H265-L273 HydrophobicContact CB-CD2 4.21Å; H265-L273 HydrophobicContact CB-CG 4.42Å; H265-L273 PolarHBondContact N-O 3.46Å
266	G	82.8	Confident	88.6	Confident	20 Å²	20	68.5 Å²	68.5	21%	0.206	37%	0.37	C	S	.	.	S	Bend	trans	-70.3	167.4	177.5	0	0	0	0	0	112.8	S268 G269 S270	G266-S268 PolarHBondContact O-N 3.38Å; G266-G269 PolarHBondContact O-N 3.12Å; G266-G269 VanDerWaalsContact O-N 3.11Å; G266-S270 WeakPolarHBondContact CA-O 3.3Å; G266-S270 PolarHBondContact N-O 3.21Å; G266-S270 PolarHBondContact O-N 2.75Å
267	T	84.1	Confident	88.6	Confident	104 Å²	104	65.8 Å²	65.8	64%	0.638	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-53.1	134	177.9	48	0	0	0	0	111.1	G269 S270	T267-G269 PolarHBondContact O-N 3.43Å; T267-G269 VanDerWaalsContact O-N 3.08Å; T267-S270 VanDerWaalsContact O-CB 3.26Å; T267-S270 WeakPolarHBondContact O-CB 3.33Å; T267-S270 PolarHBondContact O-N 3.25Å
268	S	85.4	Confident	88.4	Confident	143 Å²	143	64.3 Å²	64.3	100%	1	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	52.9	28.1	-177.9	-54.2	0	0	0	0	115.2	G266	G266-S268 PolarHBondContact O-N 3.38Å
269	G	84.6	Confident	88.5	Confident	53 Å²	53	64 Å²	64	55%	0.546	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	89.1	10.7	-179.4	0	0	0	0	0	114.9	G266 T267	G266-G269 PolarHBondContact O-N 3.12Å; G266-G269 VanDerWaalsContact O-N 3.11Å; T267-G269 PolarHBondContact O-N 3.43Å; T267-G269 VanDerWaalsContact O-N 3.08Å
270	S	85.4	Confident	88.6	Confident	31 Å²	31	59.4 Å²	59.4	22%	0.217	33%	0.33	C	S	.	.			trans	-56	137.8	175	169.5	0	0	0	0	112.4	G266 T267 Q272	G266-S270 WeakPolarHBondContact CA-O 3.3Å; G266-S270 PolarHBondContact N-O 3.21Å; G266-S270 PolarHBondContact O-N 2.75Å; T267-S270 VanDerWaalsContact O-CB 3.26Å; T267-S270 WeakPolarHBondContact O-CB 3.33Å; T267-S270 PolarHBondContact O-N 3.25Å; S270-Q272 WeakPolarHBondContact OG-CG 3.24Å; S270-Q272 PolarHBondContact OG-N 2.84Å; S270-Q272 PolarHBondContact OG-OE1 2.9Å
271	C	88.6	Confident	88.8	Confident	67 Å²	67	53.1 Å²	53.1	45%	0.453	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	14	-179.6	-65.7	0	0	0	0	114.3	C264 L273	C264-C271 HydrophobicContact CB-CB 3.88Å; C264-C271 WeakPolarHBondContact CB-SG 3.45Å; C264-C271 VanDerWaalsContact SG-CA 3.56Å; C264-C271 WeakPolarHBondContact SG-CB 3.39Å; C264-C271 CovalentContact SG-SG 2.03Å; C264-C271 PolarHBondContact SG-SG 2.81Å; C271-L273 PolarHBondContact O-N 3.01Å
272	Q	83.1	Confident	89	Confident	115 Å²	115	53.2 Å²	53.2	54%	0.537	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-34.3	173.4	-70.6	159.5	-10.2	0	0	111.9	S270	S270-Q272 WeakPolarHBondContact OG-CG 3.24Å; S270-Q272 PolarHBondContact OG-N 2.84Å; S270-Q272 PolarHBondContact OG-OE1 2.9Å
273	L	84	Confident	89.3	Confident	5 Å²	5	51.7 Å²	51.7	3%	0.026	30%	0.297	C	S	.	.	S	Bend	trans	-114.9	120	166.6	-175	67	0	0	0	108.5	F170 K173 L174 L177 H265 C271	F170-L273 HydrophobicContact CD2-CD1 4.16Å; F170-L273 HydrophobicContact CE2-CD1 3.58Å; F170-L273 HydrophobicContact CE2-CD2 4.01Å; F170-L273 HydrophobicContact CE2-CG 3.76Å; F170-L273 HydrophobicContact CZ-CD1 4.3Å; F170-L273 HydrophobicContact CZ-CD2 3.86Å; F170-L273 HydrophobicContact CZ-CG 4.04Å; K173-L273 HydrophobicContact CD-CD1 3.97Å; K173-L273 HydrophobicContact CG-CD1 4.13Å; L174-L273 HydrophobicContact CB-CD2 3.88Å; L174-L273 HydrophobicContact CD1-CD2 3.33Å; L174-L273 HydrophobicContact CG-CD2 4.15Å; L177-L273 HydrophobicContact CD1-CB 3.78Å; L177-L273 HydrophobicContact CD1-CD1 3.95Å; L177-L273 HydrophobicContact CD1-CD2 4.38Å; L177-L273 HydrophobicContact CD1-CG 4.25Å; H265-L273 HydrophobicContact CB-CD2 4.21Å; H265-L273 HydrophobicContact CB-CG 4.42Å; H265-L273 PolarHBondContact N-O 3.46Å; C271-L273 PolarHBondContact O-N 3.01Å
274	K	87.1	Confident	89.6	Confident	40 Å²	40	51.2 Å²	51.2	17%	0.174	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.3	176.4	68.9	-166.2	177.6	-165	0	110.8	D207 W209 E210 K263	D207-K274 IonicContact OD1-NZ 3.98Å; W209-K274 HydrophobicContact CB-CD 4.23Å; W209-K274 HydrophobicContact CB-CG 3.59Å; E210-K274 PolarHBondContact N-O 3.29Å; K263-K274 CarbonylContact O-C 3.53Å; K263-K274 WeakPolarHBondContact O-CA 3.48Å; K263-K274 WeakPolarHBondContact O-CB 3.14Å
275	T	87.5	Confident	89.8	Confident	12 Å²	12	52.8 Å²	52.8	7%	0.074	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.8	174.6	-52.2	0	0	0	0	108.1	F170 E210 G212 C262 K263	F170-T275 WeakPolarHBondContact CE2-OG1 3.21Å; F170-T275 WeakPolarHBondContact CZ-OG1 2.98Å; E210-T275 WeakPolarHBondContact O-CA 3.48Å; G212-T275 VanDerWaalsContact CA-CG2 3.45Å; C262-T275 CarbonylContact C-O 3.58Å; C262-T275 WeakPolarHBondContact CA-O 3.18Å; K263-T275 PolarHBondContact N-O 2.9Å; K263-T275 PolarHBondContact O-N 2.95Å
276	C	90.7	Very high	90.3	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	148.6	179.9	-50.4	0	0	0	0	112.3	W209 E210 W211 G212 R260 K261 C262	W209-C276 HydrophobicContact CD2-CB 4.19Å; W209-C276 HydrophobicContact CE3-CB 3.45Å; W209-C276 VanDerWaalsContact CE3-CB 3.45Å; W209-C276 VanDerWaalsContact CE3-SG 3.51Å; W209-C276 HydrophobicContact CZ3-CB 3.82Å; E210-C276 PolarHBondContact O-N 2.87Å; W211-C276 WeakPolarHBondContact CA-O 3.09Å; G212-C276 PolarHBondContact N-O 3.49Å; R260-C276 HydrophobicContact CG-CB 3.66Å; K261-C276 CarbonylContact O-C 3.57Å; K261-C276 VanDerWaalsContact O-CA 3.22Å; K261-C276 WeakPolarHBondContact O-CA 3.31Å; C262-C276 HydrophobicContact CB-CB 4.01Å; C262-C276 WeakPolarHBondContact CB-SG 3.27Å; C262-C276 WeakPolarHBondContact SG-CB 3.39Å; C262-C276 CovalentContact SG-SG 2.03Å; C262-C276 PolarHBondContact SG-SG 2.04Å
277	W	91.5	Very high	91	Very high	56 Å²	56	48 Å²	48	21%	0.212	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	164.1	171.2	50.6	106	0	0	0	109.7	G212 R260 K261 K263 V279	G212-W277 VanDerWaalsContact O-CB 3.29Å; G212-W277 WeakPolarHBondContact O-CB 3.05Å; R260-W277 WeakPolarHBondContact CA-O 3.24Å; K261-W277 PolarHBondContact N-O 2.96Å; K261-W277 PolarHBondContact O-N 2.84Å; K263-W277 HydrophobicContact CB-CH2 3.6Å; K263-W277 HydrophobicContact CB-CZ3 3.85Å; K263-W277 HydrophobicContact CD-CH2 4.49Å; W277-V279 HydrophobicContact CG-CG1 4.48Å; W277-V279 VanDerWaalsContact NE1-CG1 3.33Å
278	Q	92.1	Very high	91.6	Very high	31 Å²	31	45.4 Å²	45.4	15%	0.145	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	144.6	167.6	-62.1	-150.5	18	0	0	110.1	R163 W211 S215 P216 M258 R259	R163-Q278 VanDerWaalsContact NH1-NE2 3.17Å; W211-Q278 HydrophobicContact CH2-CG 3.84Å; W211-Q278 HydrophobicContact CZ3-CG 3.77Å; S215-Q278 PolarHBondContact OG-N 3Å; P216-Q278 WeakPolarHBondContact CD-O 3.37Å; M258-Q278 HydrophobicContact CE-CB 3.68Å; M258-Q278 HydrophobicContact SD-CB 4.47Å; M258-Q278 PolarHBondContact SD-OE1 2.85Å; M258-Q278 VanDerWaalsContact SD-OE1 3.33Å; R259-Q278 CarbonylContact O-C 3.53Å; R259-Q278 WeakPolarHBondContact O-CA 3.45Å
279	V	93.9	Very high	92.2	Very high	23 Å²	23	40.6 Å²	40.6	14%	0.139	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	150.6	171.3	-60.3	0	0	0	0	108.8	R259 K261 W277	R259-V279 HydrophobicContact CG-CG2 3.31Å; R259-V279 PolarHBondContact N-O 2.96Å; R259-V279 PolarHBondContact O-N 3.48Å; K261-V279 HydrophobicContact CB-CG1 3.98Å; K261-V279 HydrophobicContact CB-CG2 3.95Å; K261-V279 HydrophobicContact CD-CG1 4.41Å; W277-V279 HydrophobicContact CG-CG1 4.48Å; W277-V279 VanDerWaalsContact NE1-CG1 3.33Å
280	T	94.7	Very high	92.8	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-58	149.1	171.8	60.6	0	0	0	0	110.2	H143 N147 P216 M218	H143-T280 PolarHBondContact CE1-OG1 3.48Å; H143-T280 VanDerWaalsContact CE1-OG1 3.26Å; H143-T280 PolarHBondContact ND1-OG1 2.94Å; N147-T280 PolarHBondContact ND2-OG1 3.37Å; N147-T280 WeakPolarHBondContact OD1-CG2 3.19Å; N147-T280 PolarHBondContact OD1-OG1 2.93Å; P216-T280 HydrophobicContact CB-CG2 4.33Å; P216-T280 HydrophobicContact CG-CG2 4.16Å; M218-T280 HydrophobicContact SD-CG2 4.01Å
281	P	95.7	Very high	93.3	Very high	6 Å²	6	37.7 Å²	37.7	4%	0.039	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-57.3	156.6	169.7	24.1	-32.7	0	0	0	110.9	H143 V254 N257 F283 V286	H143-P281 PolarHBondContact CE1-O 2.64Å; H143-P281 PolarHBondContact ND1-O 3.21Å; V254-P281 HydrophobicContact CG1-CG 4.16Å; N257-P281 HydrophobicContact CB-CB 4.29Å; N257-P281 HydrophobicContact CB-CG 4.21Å; N257-P281 WeakPolarHBondContact O-CB 3.4Å; P281-F283 PolarHBondContact O-N 3.45Å; P281-V286 HydrophobicContact CB-CG2 3.98Å; P281-V286 HydrophobicContact CG-CG2 3.46Å; P281-V286 VanDerWaalsContact CG-CG2 3.46Å
282	E	96.2	Very high	93.7	Very high	109 Å²	109	36.7 Å²	36.7	51%	0.509	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-62.5	135.4	165.6	-70.8	173.5	-164.8	0	0	108.9	R259 R284 T285 V286	R259-E282 IonicContact CZ-OE1 3.87Å; R259-E282 IonicContact NH1-OE1 3.49Å; R259-E282 IonicContact NH2-OE1 3.81Å; R259-E282 PolarHBondContact NH2-OE1 3.29Å; E282-R284 PolarHBondContact O-N 3.15Å; E282-R284 VanDerWaalsContact O-N 3.15Å; E282-T285 VanDerWaalsContact O-CB 3.3Å; E282-T285 WeakPolarHBondContact O-CB 3.33Å; E282-T285 PolarHBondContact O-N 3.42Å; E282-V286 PolarHBondContact O-N 3.19Å
283	F	97.1	Very high	94.3	Very high	17 Å²	17	32 Å²	32	8%	0.075	16%	0.164	C	C	.	.	H	α-helix	trans	-63.2	-28.1	-171.1	-161.4	-98.3	0	0	0	112.6	I91 A92 E95 I136 A139 H143 P281 T285 V286 G287	I91-F283 HydrophobicContact CG2-CB 4.23Å; I91-F283 HydrophobicContact CG2-CD1 3.66Å; I91-F283 HydrophobicContact CG2-CD2 4.44Å; I91-F283 HydrophobicContact CG2-CE1 4.16Å; I91-F283 HydrophobicContact CG2-CG 3.82Å; A92-F283 HydrophobicContact CB-CE1 4.2Å; A92-F283 HydrophobicContact CB-CZ 3.88Å; E95-F283 HydrophobicContact CB-CD1 3.64Å; E95-F283 HydrophobicContact CB-CE1 3.55Å; E95-F283 HydrophobicContact CG-CD1 3.75Å; E95-F283 HydrophobicContact CG-CE1 3.81Å; I136-F283 HydrophobicContact CD1-CE1 3.73Å; I136-F283 HydrophobicContact CD1-CZ 3.68Å; I136-F283 HydrophobicContact CG1-CE1 4.12Å; I136-F283 HydrophobicContact CG1-CZ 4.06Å; A139-F283 HydrophobicContact CB-CE2 4.33Å; H143-F283 HydrophobicContact CB-CD2 3.89Å; H143-F283 HydrophobicContact CB-CE2 4.06Å; H143-F283 AromaticContact CD2-CD2 3.74Å; H143-F283 AromaticContact CG-CD2 3.66Å; P281-F283 PolarHBondContact O-N 3.45Å; F283-T285 VanDerWaalsContact C-N 3.3Å; F283-T285 PolarHBondContact O-N 3.33Å; F283-V286 WeakPolarHBondContact O-CB 3.4Å; F283-V286 PolarHBondContact O-N 3.08Å; F283-V286 VanDerWaalsContact O-N 3.14Å; F283-G287 PolarHBondContact O-N 3.48Å
284	R	97.1	Very high	94.8	Very high	111 Å²	111	32.6 Å²	32.6	42%	0.419	17%	0.166	S	C	.	.	H	α-helix	trans	-57.4	-39.1	170.6	-178.4	56.8	56	82.3	3.7	112.9	E95 H98 E282 G287 A288	E95-R284 WeakPolarHBondContact OE1-CD 3.46Å; E95-R284 IonicContact OE1-NE 2.72Å; E95-R284 PolarHBondContact OE1-NE 3.34Å; E95-R284 VanDerWaalsContact OE1-NE 3.1Å; E95-R284 IonicContact OE2-CZ 3.1Å; E95-R284 IonicContact OE2-NE 2.92Å; E95-R284 PolarHBondContact OE2-NE 2.94Å; E95-R284 IonicContact OE2-NH2 3.94Å; E95-R284 PolarHBondContact OE2-NH2 3.37Å; H98-R284 PolarHBondContact CD2-NE 2.81Å; H98-R284 VanDerWaalsContact CD2-NE 3.29Å; H98-R284 PolarHBondContact CE1-NH1 3.42Å; H98-R284 VanDerWaalsContact CE1-NH1 3.28Å; H98-R284 PolarHBondContact NE2-NH1 2.91Å; E282-R284 PolarHBondContact O-N 3.15Å; E282-R284 VanDerWaalsContact O-N 3.15Å; R284-G287 PolarHBondContact O-N 3.44Å; R284-A288 WeakPolarHBondContact O-CB 3.42Å; R284-A288 PolarHBondContact O-N 3.33Å
285	T	97.1	Very high	95.1	Very high	75 Å²	75	36.1 Å²	36.1	46%	0.46	18%	0.183	S	C	.	.	H	α-helix	trans	-65.7	-41	176.1	-51.6	0	0	0	0	110.9	E282 F283 A288 L289	E282-T285 VanDerWaalsContact O-CB 3.3Å; E282-T285 WeakPolarHBondContact O-CB 3.33Å; E282-T285 PolarHBondContact O-N 3.42Å; F283-T285 VanDerWaalsContact C-N 3.3Å; F283-T285 PolarHBondContact O-N 3.33Å; T285-A288 PolarHBondContact O-N 2.86Å; T285-L289 WeakPolarHBondContact O-CB 3.45Å; T285-L289 PolarHBondContact O-N 2.94Å
286	V	97.7	Very high	95.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-44	176.1	-178.2	0	0	0	0	110.9	A139 A253 V254 P281 E282 F283 A288 L289 L290	A139-V286 HydrophobicContact CB-CG1 3.89Å; A253-V286 HydrophobicContact CB-CG1 4.3Å; V254-V286 HydrophobicContact CG2-CG1 4.07Å; V254-V286 HydrophobicContact CG2-CG2 4.32Å; P281-V286 HydrophobicContact CB-CG2 3.98Å; P281-V286 HydrophobicContact CG-CG2 3.46Å; P281-V286 VanDerWaalsContact CG-CG2 3.46Å; E282-V286 PolarHBondContact O-N 3.19Å; F283-V286 WeakPolarHBondContact O-CB 3.4Å; F283-V286 PolarHBondContact O-N 3.08Å; F283-V286 VanDerWaalsContact O-N 3.14Å; V286-A288 PolarHBondContact O-N 3.4Å; V286-L289 PolarHBondContact O-N 3.02Å; V286-L290 HydrophobicContact CG1-CD1 4.11Å; V286-L290 HydrophobicContact CG1-CG 4.47Å; V286-L290 WeakPolarHBondContact O-CG 3.44Å; V286-L290 PolarHBondContact O-N 3.22Å
287	G	97.6	Very high	95.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.4	-48.1	174.3	0	0	0	0	0	112.4	F283 R284 L289 L290 R291	F283-G287 PolarHBondContact O-N 3.48Å; R284-G287 PolarHBondContact O-N 3.44Å; G287-L289 PolarHBondContact O-N 3.27Å; G287-L290 PolarHBondContact O-N 3.09Å; G287-R291 VanDerWaalsContact O-CB 3.27Å; G287-R291 WeakPolarHBondContact O-CB 3.4Å; G287-R291 PolarHBondContact O-N 2.03Å
288	A	97.5	Very high	95.5	Very high	49 Å²	49	39 Å²	39	41%	0.405	20%	0.197	S	C	.	.	H	α-helix	trans	-64.3	-39.6	177.9	0	0	0	0	0	112.6	R284 T285 V286 R291 S292	R284-A288 WeakPolarHBondContact O-CB 3.42Å; R284-A288 PolarHBondContact O-N 3.33Å; T285-A288 PolarHBondContact O-N 2.86Å; V286-A288 PolarHBondContact O-N 3.4Å; A288-R291 WeakPolarHBondContact O-CB 3.45Å; A288-R291 PolarHBondContact O-N 3.48Å; A288-S292 PolarHBondContact O-N 3.28Å
289	L	96.8	Very high	95.4	Very high	42 Å²	42	39.2 Å²	39.2	22%	0.22	20%	0.199	C	C	.	.	H	α-helix	trans	-63.6	-48	176.5	178.5	62.9	0	0	0	111.5	A253 N257 T285 V286 G287 R291 S292 R293	A253-L289 HydrophobicContact CB-CD2 4.03Å; N257-L289 WeakPolarHBondContact ND2-CD2 3.48Å; T285-L289 WeakPolarHBondContact O-CB 3.45Å; T285-L289 PolarHBondContact O-N 2.94Å; V286-L289 PolarHBondContact O-N 3.02Å; G287-L289 PolarHBondContact O-N 3.27Å; L289-R291 VanDerWaalsContact C-N 3.28Å; L289-R291 PolarHBondContact O-N 3.28Å; L289-S292 WeakPolarHBondContact O-CB 3.43Å; L289-S292 PolarHBondContact O-N 2.96Å; L289-R293 WeakPolarHBondContact O-CG 3.01Å; L289-R293 PolarHBondContact O-N 3.24Å
290	L	97.7	Very high	95.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-33.7	176.7	-70.4	177	0	0	0	111.5	F132 A135 I136 A139 V249 A253 V286 G287 R293 F294	F132-L290 HydrophobicContact CD2-CB 4.09Å; F132-L290 HydrophobicContact CE2-CB 3.61Å; F132-L290 HydrophobicContact CZ-CB 4.47Å; A135-L290 HydrophobicContact CB-CD1 4.24Å; A135-L290 HydrophobicContact CB-CD2 4.05Å; I136-L290 HydrophobicContact CB-CD1 4.18Å; I136-L290 HydrophobicContact CD1-CD1 3.69Å; A139-L290 HydrophobicContact CB-CD1 4.19Å; V249-L290 HydrophobicContact CG1-CD2 4.35Å; A253-L290 HydrophobicContact CB-CD2 3.98Å; A253-L290 HydrophobicContact CB-CG 4.31Å; V286-L290 HydrophobicContact CG1-CD1 4.11Å; V286-L290 HydrophobicContact CG1-CG 4.47Å; V286-L290 WeakPolarHBondContact O-CG 3.44Å; V286-L290 PolarHBondContact O-N 3.22Å; G287-L290 PolarHBondContact O-N 3.09Å; L290-R293 CarbonylContact O-C 3.55Å; L290-R293 PolarHBondContact O-N 3.41Å; L290-F294 PolarHBondContact O-N 3.29Å
291	R	96.3	Very high	94.4	Very high	22 Å²	22	44.4 Å²	44.4	8%	0.083	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-41.8	174.9	179.8	63.3	179.4	165.4	5.6	111.3	F132 G287 A288 L289 R293 F294 H295	F132-R291 HydrophobicContact CE2-CB 4.36Å; G287-R291 VanDerWaalsContact O-CB 3.27Å; G287-R291 WeakPolarHBondContact O-CB 3.4Å; G287-R291 PolarHBondContact O-N 2.03Å; A288-R291 WeakPolarHBondContact O-CB 3.45Å; A288-R291 PolarHBondContact O-N 3.48Å; L289-R291 VanDerWaalsContact C-N 3.28Å; L289-R291 PolarHBondContact O-N 3.28Å; R291-R293 VanDerWaalsContact C-N 3.33Å; R291-R293 PolarHBondContact O-N 2.98Å; R291-F294 VanDerWaalsContact NH1-CD1 3.28Å; R291-F294 WeakPolarHBondContact O-CB 3.41Å; R291-F294 PolarHBondContact O-N 3.08Å; R291-H295 PolarHBondContact NE-NE2 3.43Å; R291-H295 PolarHBondContact NH2-CE1 2.98Å; R291-H295 VanDerWaalsContact NH2-CE1 3.32Å; R291-H295 PolarHBondContact NH2-NE2 3.42Å; R291-H295 PolarHBondContact O-CD2 3.48Å; R291-H295 PolarHBondContact O-N 3.29Å
292	S	95.9	Very high	93.3	Very high	47 Å²	47	48.5 Å²	48.5	33%	0.329	24%	0.242	S	C	.	.	H	α-helix	trans	-61.1	-41.7	171.9	-169.4	0	0	0	0	111.7	A288 L289 F294 H295 R296	A288-S292 PolarHBondContact O-N 3.28Å; L289-S292 WeakPolarHBondContact O-CB 3.43Å; L289-S292 PolarHBondContact O-N 2.96Å; S292-F294 VanDerWaalsContact C-N 3.34Å; S292-H295 PolarHBondContact O-N 3.28Å; S292-R296 PolarHBondContact OG-NH1 3.44Å; S292-R296 PolarHBondContact OG-NH2 3.09Å
293	R	95.4	Very high	92.1	Very high	17 Å²	17	47.8 Å²	47.8	6%	0.064	24%	0.239	C	C	.	.	H	α-helix	trans	-66.2	-32.8	175.3	-67.8	172.9	-178.7	-158.3	9.5	112.3	E256 L289 L290 R291 R296 A297 A334 L336	E256-R293 IonicContact OE2-NH2 3.45Å; E256-R293 PolarHBondContact OE2-NH2 2.81Å; L289-R293 WeakPolarHBondContact O-CG 3.01Å; L289-R293 PolarHBondContact O-N 3.24Å; L290-R293 CarbonylContact O-C 3.55Å; L290-R293 PolarHBondContact O-N 3.41Å; R291-R293 VanDerWaalsContact C-N 3.33Å; R291-R293 PolarHBondContact O-N 2.98Å; R293-R296 CarbonylContact O-C 3.4Å; R293-R296 PolarHBondContact O-N 3.13Å; R293-A297 PolarHBondContact O-N 3.14Å; R293-A334 VanDerWaalsContact CD-O 3.24Å; R293-A334 WeakPolarHBondContact CD-O 3.44Å; R293-A334 PolarHBondContact NE-O 3.23Å; R293-A334 PolarHBondContact NH1-O 3.45Å; R293-L336 HydrophobicContact CB-CD1 4.35Å; R293-L336 HydrophobicContact CB-CG 4.19Å
294	F	95.8	Very high	90.4	Very high	16 Å²	16	54.7 Å²	54.7	7%	0.07	28%	0.276	C	S	.	.	H	α-helix	trans	-62.6	-42.6	174.2	168.4	-89.9	0	0	0	112.4	F100 R128 E129 F132 L290 R291 S292 R296 A297 L336	F100-F294 HydrophobicContact CE1-CD1 4.46Å; F100-F294 AromaticContact CE1-CE1 3.94Å; F100-F294 HydrophobicContact CE1-CE1 3.94Å; F100-F294 AromaticContact CE1-CE2 3.99Å; F100-F294 HydrophobicContact CE1-CE2 3.99Å; F100-F294 AromaticContact CE1-CZ 3.67Å; F100-F294 HydrophobicContact CE1-CZ 3.67Å; F100-F294 HydrophobicContact CZ-CD1 4.13Å; F100-F294 AromaticContact CZ-CD2 3.97Å; F100-F294 HydrophobicContact CZ-CD2 3.97Å; F100-F294 HydrophobicContact CZ-CE1 4.05Å; F100-F294 AromaticContact CZ-CE2 3.83Å; F100-F294 HydrophobicContact CZ-CE2 3.83Å; F100-F294 HydrophobicContact CZ-CG 4.1Å; F100-F294 AromaticContact CZ-CZ 3.89Å; F100-F294 HydrophobicContact CZ-CZ 3.89Å; R128-F294 VanDerWaalsContact C-CE2 3.48Å; R128-F294 HydrophobicContact CB-CD2 4.1Å; R128-F294 HydrophobicContact CB-CE2 3.5Å; R128-F294 HydrophobicContact CB-CZ 4.11Å; R128-F294 WeakPolarHBondContact O-CD2 3.4Å; R128-F294 WeakPolarHBondContact O-CE2 3.25Å; E129-F294 HydrophobicContact CG-CE2 4.35Å; F132-F294 HydrophobicContact CB-CD2 3.83Å; F132-F294 HydrophobicContact CD2-CB 4.01Å; L290-F294 PolarHBondContact O-N 3.29Å; R291-F294 VanDerWaalsContact NH1-CD1 3.28Å; R291-F294 WeakPolarHBondContact O-CB 3.41Å; R291-F294 PolarHBondContact O-N 3.08Å; S292-F294 VanDerWaalsContact C-N 3.34Å; F294-R296 VanDerWaalsContact C-N 3.26Å; F294-R296 PolarHBondContact O-N 2.88Å; F294-A297 VanDerWaalsContact O-CB 3.3Å; F294-A297 WeakPolarHBondContact O-CB 3.27Å; F294-A297 PolarHBondContact O-N 3.36Å; F294-L336 HydrophobicContact CB-CD1 4.2Å
295	H	93.6	Very high	88.7	Confident	115 Å²	115	58.8 Å²	58.8	53%	0.532	29%	0.292	S	S	.	.	H	α-helix	trans	-63.7	-30.4	178.1	-72.3	-62	0	0	0	113.5	R291 S292	R291-H295 PolarHBondContact NE-NE2 3.43Å; R291-H295 PolarHBondContact NH2-CE1 2.98Å; R291-H295 VanDerWaalsContact NH2-CE1 3.32Å; R291-H295 PolarHBondContact NH2-NE2 3.42Å; R291-H295 PolarHBondContact O-CD2 3.48Å; R291-H295 PolarHBondContact O-N 3.29Å; S292-H295 PolarHBondContact O-N 3.28Å
296	R	92.9	Very high	86.8	Confident	95 Å²	95	62.7 Å²	62.7	36%	0.358	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.3	17.7	176.1	65.6	174.1	146.9	-87.2	-5.5	114	S292 R293 F294 D335	S292-R296 PolarHBondContact OG-NH1 3.44Å; S292-R296 PolarHBondContact OG-NH2 3.09Å; R293-R296 CarbonylContact O-C 3.4Å; R293-R296 PolarHBondContact O-N 3.13Å; F294-R296 VanDerWaalsContact C-N 3.26Å; F294-R296 PolarHBondContact O-N 2.88Å; R296-D335 WeakPolarHBondContact CD-OD1 3.28Å; R296-D335 IonicContact NE-OD1 3.64Å
297	A	93.7	Very high	84.7	Confident	12 Å²	12	65.6 Å²	65.6	10%	0.099	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-58.3	143.7	-178.7	0	0	0	0	0	111.2	R293 F294 L336 Y338	R293-A297 PolarHBondContact O-N 3.14Å; F294-A297 VanDerWaalsContact O-CB 3.3Å; F294-A297 WeakPolarHBondContact O-CB 3.27Å; F294-A297 PolarHBondContact O-N 3.36Å; A297-L336 CarbonylContact C-O 3.57Å; A297-L336 VanDerWaalsContact CA-O 3.28Å; A297-L336 WeakPolarHBondContact CA-O 3.35Å; A297-L336 HydrophobicContact CB-CB 4.01Å; A297-Y338 HydrophobicContact CB-CD1 3.91Å; A297-Y338 HydrophobicContact CB-CE1 4.08Å; A297-Y338 WeakPolarHBondContact O-CE1 3.43Å
298	T	91.2	Very high	82.6	Confident	20 Å²	20	68.1 Å²	68.1	12%	0.123	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	129.8	-175	-58.9	0	0	0	0	111.5	I300 P312 A331 L336 V337 Y338	T298-I300 PolarHBondContact O-N 3.26Å; T298-P312 HydrophobicContact CG2-CB 3.82Å; T298-P312 HydrophobicContact CG2-CG 4.43Å; T298-A331 HydrophobicContact CG2-CB 3.94Å; T298-L336 PolarHBondContact N-O 3.04Å; T298-V337 WeakPolarHBondContact O-CA 3.48Å; T298-Y338 VanDerWaalsContact O-CD1 3.26Å; T298-Y338 WeakPolarHBondContact O-CD1 3.29Å; T298-Y338 PolarHBondContact O-N 3.41Å; T298-Y338 VanDerWaalsContact O-N 3.1Å
299	L	90.4	Very high	80.6	Confident	36 Å²	36	72.6 Å²	72.6	19%	0.188	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	118.6	172.3	-175.3	70	0	0	0	108.7	G313 Y338	L299-G313 WeakPolarHBondContact O-CA 3.49Å; L299-G313 PolarHBondContact O-N 2.94Å; L299-Y338 CarbonylContact C-O 3.6Å; L299-Y338 VanDerWaalsContact CA-O 3.28Å; L299-Y338 WeakPolarHBondContact CA-O 3.37Å; L299-Y338 HydrophobicContact CB-CE1 4.04Å; L299-Y338 HydrophobicContact CB-CE2 4.14Å; L299-Y338 HydrophobicContact CD1-CD2 3.72Å; L299-Y338 HydrophobicContact CD1-CE2 3.34Å; L299-Y338 HydrophobicContact CD1-CG 4.49Å; L299-Y338 HydrophobicContact CG-CE2 4.3Å; L299-Y338 VanDerWaalsContact N-CE1 3.32Å
300	I	86.9	Confident	78.8	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.015	38%	0.379	C	S	.	.	B	Isolated β-bridge	trans	-98.3	149.8	173.3	51.5	158.7	0	0	0	109.4	I238 T298 L310 V337 Y338 F339	I238-I300 HydrophobicContact CD1-CD1 4.27Å; I238-I300 HydrophobicContact CG1-CD1 4.07Å; T298-I300 PolarHBondContact O-N 3.26Å; I300-L310 HydrophobicContact CB-CD2 4.43Å; I300-L310 HydrophobicContact CD1-CD2 3.49Å; I300-L310 VanDerWaalsContact CD1-CD2 3.49Å; I300-L310 HydrophobicContact CG2-CB 4.24Å; I300-L310 HydrophobicContact CG2-CD2 4.44Å; I300-V337 HydrophobicContact CD1-CB 4.35Å; I300-V337 HydrophobicContact CD1-CG2 4.2Å; I300-V337 HydrophobicContact CG1-CB 4.33Å; I300-V337 HydrophobicContact CG2-CB 3.97Å; I300-V337 HydrophobicContact CG2-CG1 4.09Å; I300-Y338 WeakPolarHBondContact CG1-O 3.46Å; I300-Y338 PolarHBondContact N-O 3.41Å; I300-F339 HydrophobicContact CD1-CB 4.25Å; I300-F339 HydrophobicContact CG1-CB 3.91Å; I300-F339 WeakPolarHBondContact O-CA 2.93Å; I300-F339 WeakPolarHBondContact O-CB 2.98Å
301	R	80	Confident	76.9	Confident	139 Å²	139	77.1 Å²	77.1	53%	0.525	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-101	149.9	174.4	-73.9	-170.8	173.5	140.3	0.2	111.6	H303	R301-H303 PolarHBondContact O-N 2.91Å
302	P	73.5	Confident	75	Confident	93 Å²	93	78.2 Å²	78.2	60%	0.604	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-61.8	123.8	166.5	26.9	-31.9	0	0	0	108.9	I238	I238-P302 HydrophobicContact CD1-CB 3.95Å
303	H	69.1	Low	72.9	Confident	94 Å²	94	76.5 Å²	76.5	44%	0.435	40%	0.4	S	S	.	.			trans	-124.1	121.9	176.1	-165.9	-79.7	0	0	0	108.6	R301 R305	R301-H303 PolarHBondContact O-N 2.91Å; H303-R305 VanDerWaalsContact C-N 3.29Å; H303-R305 VanDerWaalsContact CE1-CB 3.4Å; H303-R305 WeakPolarHBondContact CE1-CB 3.45Å; H303-R305 WeakPolarHBondContact CE1-CG 3.46Å; H303-R305 WeakPolarHBondContact ND1-CB 3.46Å; H303-R305 PolarHBondContact ND1-N 3.25Å; H303-R305 VanDerWaalsContact ND1-N 3.12Å; H303-R305 PolarHBondContact O-N 3.39Å
304	N	62.8	Low	70.5	Confident	162 Å²	162	79.6 Å²	79.6	87%	0.866	42%	0.422	S	S	*	.			trans	-79.4	-3.2	-174.3	-75.2	-9.6	0	0	0	114.3	N306	N304-N306 PolarHBondContact O-N 3.29Å
305	R	61.9	Low	68.2	Low	196 Å²	196	81.9 Å²	81.9	74%	0.74	44%	0.444	S	S	*	.	S	Bend	trans	-71.8	127.1	169.7	-73.9	178.9	-171.8	169.5	-6.5	109.8	H303 G307	H303-R305 VanDerWaalsContact C-N 3.29Å; H303-R305 VanDerWaalsContact CE1-CB 3.4Å; H303-R305 WeakPolarHBondContact CE1-CB 3.45Å; H303-R305 WeakPolarHBondContact CE1-CG 3.46Å; H303-R305 WeakPolarHBondContact ND1-CB 3.46Å; H303-R305 PolarHBondContact ND1-N 3.25Å; H303-R305 VanDerWaalsContact ND1-N 3.12Å; H303-R305 PolarHBondContact O-N 3.39Å; R305-G307 PolarHBondContact O-N 3.1Å
306	N	55.3	Low	65.8	Low	158 Å²	158	80.2 Å²	80.2	85%	0.845	46%	0.458	S	S	*	.	S	Bend	trans	-55.8	7.3	171.6	-72.1	-25.5	0	0	0	115.2	N304 G308	N304-N306 PolarHBondContact O-N 3.29Å; N306-G308 VanDerWaalsContact C-N 3.29Å; N306-G308 PolarHBondContact O-N 2.76Å
307	G	54	Low	63.4	Low	62 Å²	62	78.9 Å²	78.9	64%	0.639	47%	0.467	S	S	*	.	S	Bend	trans	-78.8	5.9	-173.4	0	0	0	0	0	116	R305 Q309	R305-G307 PolarHBondContact O-N 3.1Å; G307-Q309 PolarHBondContact O-N 2.92Å
308	G	53.4	Low	61	Low	53 Å²	53	84.2 Å²	84.2	55%	0.546	50%	0.501	S	S	.	.			trans	64.1	-10.2	172.1	0	0	0	0	0	116.9	R241 N306	R241-G308 PolarHBondContact NH2-O 3.16Å; N306-G308 VanDerWaalsContact C-N 3.29Å; N306-G308 PolarHBondContact O-N 2.76Å
309	Q	56.5	Low	58.5	Low	143 Å²	143	88.5 Å²	88.5	67%	0.668	53%	0.531	S	S	*	.			trans	-84.5	123.3	-173.5	-151.3	165.2	29.8	0	0	111.4	R241 G307 E311	R241-Q309 PolarHBondContact NH2-O 2.92Å; G307-Q309 PolarHBondContact O-N 2.92Å; Q309-E311 PolarHBondContact O-N 2.98Å
310	L	59.1	Low	56.1	Low	43 Å²	43	91.6 Å²	91.6	23%	0.225	55%	0.553	C	S	.	*			trans	-85.6	100.4	179.2	-73.7	171.9	0	0	0	107.7	R241 H245 I300 V337	R241-L310 HydrophobicContact CB-CD2 4.25Å; H245-L310 HydrophobicContact CB-CD1 4.21Å; I300-L310 HydrophobicContact CB-CD2 4.43Å; I300-L310 HydrophobicContact CD1-CD2 3.49Å; I300-L310 VanDerWaalsContact CD1-CD2 3.49Å; I300-L310 HydrophobicContact CG2-CB 4.24Å; I300-L310 HydrophobicContact CG2-CD2 4.44Å; L310-V337 HydrophobicContact CD1-CG2 4.23Å
311	E	56.4	Low	54.1	Low	94 Å²	94	95.1 Å²	95.1	44%	0.439	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-83.8	130.7	175.8	-71.7	-63.2	123.2	0	0	110.2	Q309 G313	Q309-E311 PolarHBondContact O-N 2.98Å; E311-G313 PolarHBondContact O-N 3.28Å
312	P	56.5	Low	52.1	Low	44 Å²	44	95.3 Å²	95.3	29%	0.286	60%	0.603	S	S	.	*	B	Isolated β-bridge	trans	-57.9	127.2	174.5	-24.4	34.3	0	0	0	111.7	T298 A331	T298-P312 HydrophobicContact CG2-CB 3.82Å; T298-P312 HydrophobicContact CG2-CG 4.43Å; P312-A331 HydrophobicContact CG-CB 3.9Å
313	G	53	Low	51.1	Low	12 Å²	12	94.5 Å²	94.5	12%	0.124	61%	0.611	C	S	.	*	P	Polyproline II helix	trans	-76	152.5	166	0	0	0	0	0	111.1	L299 E311 A315	L299-G313 WeakPolarHBondContact O-CA 3.49Å; L299-G313 PolarHBondContact O-N 2.94Å; E311-G313 PolarHBondContact O-N 3.28Å; G313-A315 PolarHBondContact O-N 3.36Å; G313-A315 VanDerWaalsContact O-N 3.15Å
314	P	45.7	Very low	49.8	Very low	81 Å²	81	93.4 Å²	93.4	53%	0.526	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-53.8	119.2	161.4	-8.5	21.5	0	0	0	108.6	G316	P314-G316 PolarHBondContact O-N 2.9Å
315	A	47.1	Very low	48.6	Very low	65 Å²	65	92 Å²	92	54%	0.537	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-56.6	130.3	169.8	0	0	0	0	0	108.5	G313 A317	G313-A315 PolarHBondContact O-N 3.36Å; G313-A315 VanDerWaalsContact O-N 3.15Å; A315-A317 PolarHBondContact O-N 3.45Å
316	G	43.1	Very low	47.8	Very low	80 Å²	80	85.6 Å²	85.6	83%	0.825	61%	0.613	S	S	*	*			trans	-69.8	37.8	169.6	0	0	0	0	0	113.2	P314	P314-G316 PolarHBondContact O-N 2.9Å
317	A	42.4	Very low	47.4	Very low	67 Å²	67	83.9 Å²	83.9	55%	0.554	61%	0.61	S	S	*	*	S	Bend	trans	-71.7	141.9	161.2	0	0	0	0	0	107.6	A315 S319	A315-A317 PolarHBondContact O-N 3.45Å; A317-S319 PolarHBondContact O-N 2.91Å
318	P	42.8	Very low	47.3	Very low	124 Å²	124	92.8 Å²	92.8	81%	0.805	63%	0.625	S	S	*	*			trans	-51.6	133	171.2	22.4	-30.6	0	0	0	108.3
319	S	38.1	Very low	47.6	Very low	109 Å²	109	98.3 Å²	98.3	76%	0.762	63%	0.629	S	S	*	*			trans	-40	130.7	178.2	-57.7	0	0	0	0	109.9	A317 A321	A317-S319 PolarHBondContact O-N 2.91Å; S319-A321 PolarHBondContact O-N 1.99Å
320	P	40.4	Very low	47.9	Very low	101 Å²	101	101.1 Å²	101.1	66%	0.656	63%	0.633	S	S	*	*			trans	-55.3	141	163.9	-3.2	15.2	0	0	0	107
321	A	46	Very low	48.2	Very low	78 Å²	78	100.3 Å²	100.3	65%	0.645	63%	0.633	S	S	*	*			trans	-45.9	148.3	172.6	0	0	0	0	0	110.8	S319 G323	S319-A321 PolarHBondContact O-N 1.99Å; A321-G323 PolarHBondContact O-N 3.3Å
322	P	38.2	Very low	49.4	Very low	143 Å²	143	98.1 Å²	98.1	93%	0.929	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	106.1	-179.6	2.2	9.8	0	0	0	108
323	G	50.6	Low	50.8	Low	76 Å²	76	100.9 Å²	100.9	78%	0.784	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	149.8	-5.9	-178.7	0	0	0	0	0	118.3	A321	A321-G323 PolarHBondContact O-N 3.3Å
324	A	43.1	Very low	52.5	Low	70 Å²	70	101.3 Å²	101.3	58%	0.579	65%	0.649	S	S	*	*			trans	-112.5	109.5	177.5	0	0	0	0	0	112.5	G326	A324-G326 VanDerWaalsContact C-N 3.3Å; A324-G326 PolarHBondContact O-N 2.98Å
325	P	38.1	Very low	54.7	Low	133 Å²	133	97.8 Å²	97.8	86%	0.864	63%	0.625	S	S	*	*			trans	-79.8	79.6	171.4	32.5	-30.2	0	0	0	109.4
326	G	44.7	Very low	57.1	Low	62 Å²	62	94.7 Å²	94.7	64%	0.639	60%	0.6	S	S	*	*			trans	-84.9	125.3	166.4	0	0	0	0	0	109.9	A324 R328	A324-G326 VanDerWaalsContact C-N 3.3Å; A324-G326 PolarHBondContact O-N 2.98Å; G326-R328 PolarHBondContact O-N 2.96Å
327	P	47.2	Very low	59.5	Low	121 Å²	121	91 Å²	91	79%	0.786	56%	0.561	S	S	*	*			trans	-61.3	132.8	178.4	24.8	-31.1	0	0	0	109.4	R329	P327-R329 PolarHBondContact O-N 3.35Å
328	R	52	Low	61.9	Low	250 Å²	250	88.4 Å²	88.4	94%	0.943	54%	0.537	S	S	*	.			trans	-50.4	107.2	171.1	-66	-178.3	-172.2	173.9	3.6	107.6	G326 R330	G326-R328 PolarHBondContact O-N 2.96Å; R328-R330 PolarHBondContact O-N 3.37Å
329	R	58.7	Low	64.3	Low	169 Å²	169	84.1 Å²	84.1	64%	0.638	51%	0.506	S	S	*	.			trans	-68.9	98.8	-175.3	-157.2	176	-171.2	-95.5	-0.3	107.7	P327 A331 D335	P327-R329 PolarHBondContact O-N 3.35Å; R329-A331 PolarHBondContact O-N 2.79Å; R329-D335 IonicContact NH1-OD2 3.54Å; R329-D335 PolarHBondContact NH1-OD2 3.03Å
330	R	62.3	Low	66.8	Low	201 Å²	201	81.8 Å²	81.8	76%	0.758	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-57.9	131.2	172.6	-178.1	173.4	-97.3	-179.1	-6.9	107.3	R328 S332	R328-R330 PolarHBondContact O-N 3.37Å; R330-S332 PolarHBondContact O-N 3.13Å; R330-S332 VanDerWaalsContact O-N 3.13Å
331	A	66.2	Low	69.3	Low	26 Å²	26	86 Å²	86	22%	0.215	49%	0.491	C	S	.	.	P	Polyproline II helix	trans	-53.5	121.9	178.4	0	0	0	0	0	108.8	T298 P312 R329	T298-A331 HydrophobicContact CG2-CB 3.94Å; P312-A331 HydrophobicContact CG-CB 3.9Å; R329-A331 PolarHBondContact O-N 2.79Å
332	S	82.2	Confident	71.5	Confident	48 Å²	48	83.6 Å²	83.6	34%	0.336	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-63.5	143.2	169.8	176.6	0	0	0	0	108.2	R330 A334 D335	R330-S332 PolarHBondContact O-N 3.13Å; R330-S332 VanDerWaalsContact O-N 3.13Å; S332-A334 PolarHBondContact O-N 3.42Å; S332-A334 PolarHBondContact OG-N 3.31Å; S332-D335 WeakPolarHBondContact CB-OD2 3.18Å; S332-D335 PolarHBondContact N-OD2 3.19Å; S332-D335 PolarHBondContact O-N 3.1Å
333	P	84.4	Confident	74.1	Confident	103 Å²	103	78.7 Å²	78.7	67%	0.669	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-20.3	171.3	23.7	-34	0	0	0	112.7	H245	H245-P333 PolarHBondContact CE1-O 3.23Å
334	A	88.8	Confident	76	Confident	21 Å²	21	79.6 Å²	79.6	17%	0.174	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-8	176.2	0	0	0	0	0	114.6	V249 R293 S332	V249-A334 VanDerWaalsContact CG1-O 3.27Å; V249-A334 WeakPolarHBondContact CG1-O 3.06Å; R293-A334 VanDerWaalsContact CD-O 3.24Å; R293-A334 WeakPolarHBondContact CD-O 3.44Å; R293-A334 PolarHBondContact NE-O 3.23Å; R293-A334 PolarHBondContact NH1-O 3.45Å; S332-A334 PolarHBondContact O-N 3.42Å; S332-A334 PolarHBondContact OG-N 3.31Å
335	D	93.4	Very high	78.3	Confident	7 Å²	7	76.9 Å²	76.9	4%	0.037	40%	0.399	C	S	.	.	S	Bend	trans	-82.8	147.4	178.8	-71.9	-26.4	0	0	0	110.8	H245 R296 R329 S332	H245-D335 PolarHBondContact NE2-O 2.84Å; R296-D335 WeakPolarHBondContact CD-OD1 3.28Å; R296-D335 IonicContact NE-OD1 3.64Å; R329-D335 IonicContact NH1-OD2 3.54Å; R329-D335 PolarHBondContact NH1-OD2 3.03Å; S332-D335 WeakPolarHBondContact CB-OD2 3.18Å; S332-D335 PolarHBondContact N-OD2 3.19Å; S332-D335 PolarHBondContact O-N 3.1Å
336	L	95.8	Very high	81	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	36%	0.361	C	S	.	.			trans	-72	148.4	173.7	-65.6	175	0	0	0	110.5	F132 A135 N246 V249 R293 F294 A297 T298	F132-L336 HydrophobicContact CB-CD1 4.34Å; F132-L336 HydrophobicContact CD2-CD1 4.45Å; A135-L336 HydrophobicContact CB-CD2 3.53Å; N246-L336 HydrophobicContact CB-CD2 4.18Å; N246-L336 WeakPolarHBondContact OD1-CA 3.34Å; N246-L336 WeakPolarHBondContact OD1-CD2 3.22Å; V249-L336 HydrophobicContact CB-CD2 4.15Å; V249-L336 HydrophobicContact CG1-CD2 3.73Å; V249-L336 HydrophobicContact CG1-CG 4.42Å; R293-L336 HydrophobicContact CB-CD1 4.35Å; R293-L336 HydrophobicContact CB-CG 4.19Å; F294-L336 HydrophobicContact CB-CD1 4.2Å; A297-L336 CarbonylContact C-O 3.57Å; A297-L336 VanDerWaalsContact CA-O 3.28Å; A297-L336 WeakPolarHBondContact CA-O 3.35Å; A297-L336 HydrophobicContact CB-CB 4.01Å; T298-L336 PolarHBondContact N-O 3.04Å
337	V	93.8	Very high	83.2	Confident	3 Å²	3	73.2 Å²	73.2	2%	0.018	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.7	179	-57.7	0	0	0	0	111.2	A131 M242 H245 N246 T298 I300 L310	A131-V337 VanDerWaalsContact CB-O 3.24Å; A131-V337 WeakPolarHBondContact CB-O 3.48Å; M242-V337 HydrophobicContact CG-CG2 4.19Å; M242-V337 VanDerWaalsContact CG-O 3.3Å; M242-V337 WeakPolarHBondContact CG-O 3.32Å; H245-V337 HydrophobicContact CB-CG2 4.01Å; H245-V337 VanDerWaalsContact CD2-CG2 3.45Å; H245-V337 WeakPolarHBondContact CD2-CG2 3.46Å; N246-V337 PolarHBondContact ND2-O 2.87Å; N246-V337 PolarHBondContact OD1-N 3.35Å; N246-V337 PolarHBondContact OD1-O 2.56Å; T298-V337 WeakPolarHBondContact O-CA 3.48Å; I300-V337 HydrophobicContact CD1-CB 4.35Å; I300-V337 HydrophobicContact CD1-CG2 4.2Å; I300-V337 HydrophobicContact CG1-CB 4.33Å; I300-V337 HydrophobicContact CG2-CB 3.97Å; I300-V337 HydrophobicContact CG2-CG1 4.09Å; L310-V337 HydrophobicContact CD1-CG2 4.23Å
338	Y	94	Very high	85.3	Confident	11 Å²	11	76.6 Å²	76.6	4%	0.043	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	157.9	178.7	72.6	-76.7	0	0	0	109.2	G126 R128 A297 T298 L299 I300 E340	G126-Y338 WeakPolarHBondContact O-CB 3.15Å; R128-Y338 HydrophobicContact CB-CG 4.46Å; R128-Y338 HydrophobicContact CG-CD1 3.64Å; R128-Y338 HydrophobicContact CG-CD2 3.55Å; R128-Y338 HydrophobicContact CG-CE1 3.71Å; R128-Y338 HydrophobicContact CG-CE2 3.6Å; R128-Y338 HydrophobicContact CG-CG 3.58Å; R128-Y338 VanDerWaalsContact CZ-OH 3.28Å; R128-Y338 PolarHBondContact NE-OH 3.22Å; R128-Y338 PolarHBondContact NH2-OH 3.39Å; A297-Y338 HydrophobicContact CB-CD1 3.91Å; A297-Y338 HydrophobicContact CB-CE1 4.08Å; A297-Y338 WeakPolarHBondContact O-CE1 3.43Å; T298-Y338 VanDerWaalsContact O-CD1 3.26Å; T298-Y338 WeakPolarHBondContact O-CD1 3.29Å; T298-Y338 PolarHBondContact O-N 3.41Å; T298-Y338 VanDerWaalsContact O-N 3.1Å; L299-Y338 CarbonylContact C-O 3.6Å; L299-Y338 VanDerWaalsContact CA-O 3.28Å; L299-Y338 WeakPolarHBondContact CA-O 3.37Å; L299-Y338 HydrophobicContact CB-CE1 4.04Å; L299-Y338 HydrophobicContact CB-CE2 4.14Å; L299-Y338 HydrophobicContact CD1-CD2 3.72Å; L299-Y338 HydrophobicContact CD1-CE2 3.34Å; L299-Y338 HydrophobicContact CD1-CG 4.49Å; L299-Y338 HydrophobicContact CG-CE2 4.3Å; L299-Y338 VanDerWaalsContact N-CE1 3.32Å; I300-Y338 WeakPolarHBondContact CG1-O 3.46Å; I300-Y338 PolarHBondContact N-O 3.41Å; Y338-E340 VanDerWaalsContact CD2-O 3.26Å; Y338-E340 WeakPolarHBondContact CD2-O 3.46Å
339	F	91.8	Very high	87.1	Confident	35 Å²	35	68.9 Å²	68.9	15%	0.154	33%	0.327	C	S	.	.			trans	-126.4	-13.4	-174.5	62.7	-91.8	0	0	0	115.1	G126 I238 H239 M242 I300	G126-F339 PolarHBondContact O-N 3.23Å; I238-F339 HydrophobicContact CD1-CB 3.35Å; I238-F339 HydrophobicContact CD1-CD1 4.05Å; I238-F339 HydrophobicContact CD1-CD2 3.99Å; I238-F339 HydrophobicContact CD1-CG 3.55Å; I238-F339 HydrophobicContact CG1-CB 4.13Å; I238-F339 HydrophobicContact CG1-CD1 3.93Å; I238-F339 HydrophobicContact CG1-CE1 4.5Å; I238-F339 HydrophobicContact CG1-CG 3.96Å; I238-F339 HydrophobicContact CG2-CD1 4.38Å; I238-F339 HydrophobicContact CG2-CD2 4.1Å; I238-F339 HydrophobicContact CG2-CE1 4.26Å; I238-F339 HydrophobicContact CG2-CE2 3.98Å; I238-F339 HydrophobicContact CG2-CG 4.32Å; I238-F339 HydrophobicContact CG2-CZ 4.07Å; H239-F339 HydrophobicContact CB-CE1 4.16Å; H239-F339 HydrophobicContact CB-CZ 4.05Å; H239-F339 AromaticContact CD2-CE1 3.9Å; H239-F339 AromaticContact CD2-CZ 3.86Å; M242-F339 HydrophobicContact CB-CD1 4.14Å; M242-F339 HydrophobicContact CB-CE1 4.2Å; M242-F339 HydrophobicContact CE-CE1 4.16Å; M242-F339 HydrophobicContact CG-CD1 4.32Å; M242-F339 HydrophobicContact CG-CE1 4.5Å; M242-F339 HydrophobicContact SD-CD1 3.52Å; M242-F339 VanDerWaalsContact SD-CD1 3.52Å; M242-F339 HydrophobicContact SD-CE1 3.54Å; M242-F339 VanDerWaalsContact SD-CE1 3.54Å; I300-F339 HydrophobicContact CD1-CB 4.25Å; I300-F339 HydrophobicContact CG1-CB 3.91Å; I300-F339 WeakPolarHBondContact O-CA 2.93Å; I300-F339 WeakPolarHBondContact O-CB 2.98Å
340	E	91.9	Very high	88.2	Confident	60 Å²	60	65.3 Å²	65.3	28%	0.28	33%	0.325	S	S	.	.	S	Bend	trans	-114	141.4	176.3	-74.3	170.9	-178.7	0	0	110.4	G126 F127 Y338 S342	G126-E340 PolarHBondContact N-OE2 3.47Å; G126-E340 PolarHBondContact O-N 2.97Å; F127-E340 HydrophobicContact CD1-CB 3.67Å; F127-E340 HydrophobicContact CE1-CB 3.79Å; Y338-E340 VanDerWaalsContact CD2-O 3.26Å; Y338-E340 WeakPolarHBondContact CD2-O 3.46Å; E340-S342 PolarHBondContact O-N 3.18Å
341	K	92.1	Very high	89.1	Confident	190 Å²	190	65.4 Å²	65.4	83%	0.826	33%	0.326	S	S	*	.			trans	-70.2	129.4	173.1	-173.1	178.8	177.7	-176.6	0	109.2	F127	F127-K341 WeakPolarHBondContact CE1-O 3.28Å
342	S	92.6	Very high	89.8	Confident	27 Å²	27	64.9 Å²	64.9	19%	0.189	32%	0.319	C	S	.	.			trans	-62.2	142.7	177.3	-51.5	0	0	0	0	111.6	R128 E129 E340	R128-S342 PolarHBondContact N-OG 2.95Å; E129-S342 VanDerWaalsContact OE2-CB 3.24Å; E129-S342 WeakPolarHBondContact OE2-CB 3.26Å; E129-S342 PolarHBondContact OE2-OG 3.45Å; E340-S342 PolarHBondContact O-N 3.18Å
343	P	92.1	Very high	89.5	Confident	40 Å²	40	63.7 Å²	63.7	26%	0.26	31%	0.309	S	S	.	.			trans	-67.4	176.3	170.8	32.6	-37.3	0	0	0	110.7	F127 F345 L352	F127-P343 HydrophobicContact CE2-CG 4.18Å; F127-P343 HydrophobicContact CZ-CG 4.36Å; P343-F345 VanDerWaalsContact C-N 3.32Å; P343-F345 HydrophobicContact CG-CD1 4.05Å; P343-F345 HydrophobicContact CG-CD2 4.44Å; P343-F345 HydrophobicContact CG-CE1 3.71Å; P343-F345 HydrophobicContact CG-CE2 4.14Å; P343-F345 HydrophobicContact CG-CG 4.42Å; P343-F345 HydrophobicContact CG-CZ 3.76Å; P343-F345 VanDerWaalsContact O-CD2 3.28Å; P343-F345 WeakPolarHBondContact O-CD2 3.34Å; P343-F345 WeakPolarHBondContact O-CE2 3.26Å; P343-F345 PolarHBondContact O-N 3.32Å; P343-L352 HydrophobicContact CB-CD1 4.15Å; P343-L352 HydrophobicContact CG-CD1 3.97Å
344	D	90.4	Very high	89.5	Confident	95 Å²	95	59.1 Å²	59.1	51%	0.508	28%	0.28	S	S	.	.			trans	-77.4	-15.3	-178.6	65.6	8.6	0	0	0	114.5	R104 C346	R104-D344 WeakPolarHBondContact CD-O 3.37Å; R104-D344 PolarHBondContact NH1-O 3.28Å; R104-D344 VanDerWaalsContact NH1-O 3.12Å; D344-C346 PolarHBondContact O-N 2.9Å; D344-C346 VanDerWaalsContact O-N 3.16Å; D344-C346 PolarHBondContact OD1-N 3.37Å
345	F	92.8	Very high	89.5	Confident	12 Å²	12	61 Å²	61	5%	0.053	30%	0.296	C	S	.	.			trans	53.5	22.1	-174.6	-55.8	-78.7	0	0	0	114.5	R104 W105 E129 P343	R104-F345 HydrophobicContact CB-CB 3.91Å; W105-F345 HydrophobicContact CB-CB 4.48Å; W105-F345 HydrophobicContact CB-CD1 4.01Å; W105-F345 HydrophobicContact CB-CD2 3.98Å; W105-F345 HydrophobicContact CB-CE1 4.17Å; W105-F345 HydrophobicContact CB-CE2 4.12Å; W105-F345 HydrophobicContact CB-CG 3.91Å; W105-F345 HydrophobicContact CB-CZ 4.21Å; W105-F345 AromaticContact CD1-CE1 3.99Å; W105-F345 HydrophobicContact CG-CD1 4.41Å; W105-F345 HydrophobicContact CG-CE1 4.23Å; W105-F345 HydrophobicContact CG-CZ 4.41Å; E129-F345 HydrophobicContact CG-CE2 4.08Å; E129-F345 HydrophobicContact CG-CZ 3.94Å; P343-F345 VanDerWaalsContact C-N 3.32Å; P343-F345 HydrophobicContact CG-CD1 4.05Å; P343-F345 HydrophobicContact CG-CD2 4.44Å; P343-F345 HydrophobicContact CG-CE1 3.71Å; P343-F345 HydrophobicContact CG-CE2 4.14Å; P343-F345 HydrophobicContact CG-CG 4.42Å; P343-F345 HydrophobicContact CG-CZ 3.76Å; P343-F345 VanDerWaalsContact O-CD2 3.28Å; P343-F345 WeakPolarHBondContact O-CD2 3.34Å; P343-F345 WeakPolarHBondContact O-CE2 3.26Å; P343-F345 PolarHBondContact O-N 3.32Å
346	C	92.9	Very high	89.3	Confident	7 Å²	7	61.2 Å²	61.2	5%	0.047	30%	0.299	C	S	.	.			trans	-79.7	-47.3	-176.5	-71.6	0	0	0	0	112.2	R104 D344 G356 T357 C377 R379	R104-C346 PolarHBondContact NH1-SG 2.77Å; D344-C346 PolarHBondContact O-N 2.9Å; D344-C346 VanDerWaalsContact O-N 3.16Å; D344-C346 PolarHBondContact OD1-N 3.37Å; C346-G356 WeakPolarHBondContact O-CA 3.04Å; C346-T357 PolarHBondContact O-N 3.04Å; C346-T357 PolarHBondContact O-OG1 3.4Å; C346-C377 VanDerWaalsContact CA-SG 3.56Å; C346-C377 HydrophobicContact CB-CB 3.7Å; C346-C377 WeakPolarHBondContact CB-SG 3.36Å; C346-C377 WeakPolarHBondContact SG-CB 3.46Å; C346-C377 CovalentContact SG-SG 2.02Å; C346-C377 PolarHBondContact SG-SG 3.45Å; C346-R379 PolarHBondContact O-NH1 2.82Å
347	E	92	Very high	89.2	Confident	111 Å²	111	61.2 Å²	61.2	52%	0.519	30%	0.299	S	S	.	.	S	Bend	trans	-94.6	152.2	179.9	-64.4	-54.4	141.7	0	0	110.8	E349 S354 R379	E347-E349 PolarHBondContact O-N 2.65Å; E347-S354 PolarHBondContact O-OG 2.83Å; E347-R379 IonicContact OE1-CZ 3.8Å; E347-R379 IonicContact OE1-NH1 2.71Å; E347-R379 PolarHBondContact OE1-NH1 2.87Å; E347-R379 IonicContact OE2-NH1 3.82Å
348	R	90.8	Very high	89.2	Confident	193 Å²	193	65.3 Å²	65.3	73%	0.728	32%	0.323	S	S	*	.			trans	-72.5	117.2	177	-177.7	174.5	177	155.9	-0.4	109.2	S354	R348-S354 WeakPolarHBondContact CA-O 3.38Å
349	E	89.2	Confident	89.2	Confident	88 Å²	88	67.1 Å²	67.1	41%	0.411	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-133.3	95.6	176.4	-171.6	166.2	-150.6	0	0	109.9	E347 R351 L352 D353 S354	E347-E349 PolarHBondContact O-N 2.65Å; E349-R351 HydrophobicContact CG-CB 4.39Å; E349-R351 PolarHBondContact O-N 2.9Å; E349-R351 VanDerWaalsContact O-N 3.13Å; E349-L352 HydrophobicContact CG-CB 4.38Å; E349-L352 HydrophobicContact CG-CG 4.2Å; E349-L352 PolarHBondContact O-N 3.45Å; E349-L352 VanDerWaalsContact O-N 3.09Å; E349-L352 WeakPolarHBondContact OE2-CD1 3.34Å; E349-L352 WeakPolarHBondContact OE2-CG 3.28Å; E349-D353 PolarHBondContact O-N 3.04Å; E349-S354 CarbonylContact C-O 3.59Å; E349-S354 PolarHBondContact N-O 2.99Å; E349-S354 PolarHBondContact O-N 3.05Å; E349-S354 VanDerWaalsContact O-N 3.08Å
350	P	82.1	Confident	89.2	Confident	94 Å²	94	67.1 Å²	67.1	61%	0.61	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-58.2	-28.6	-178	-26.5	35.3	0	0	0	113.8	L352 D353	P350-L352 VanDerWaalsContact C-N 3.29Å; P350-L352 PolarHBondContact O-N 3.4Å; P350-D353 PolarHBondContact O-N 2.86Å
351	R	82.2	Confident	89.3	Confident	203 Å²	203	69.2 Å²	69.2	77%	0.766	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-70.1	-23.2	179.8	-66.9	-177.1	177.7	170.1	-0.7	113.9	P121 E349	P121-R351 WeakPolarHBondContact CB-O 3.3Å; E349-R351 HydrophobicContact CG-CB 4.39Å; E349-R351 PolarHBondContact O-N 2.9Å; E349-R351 VanDerWaalsContact O-N 3.13Å
352	L	81.1	Confident	89.4	Confident	15 Å²	15	60.9 Å²	60.9	8%	0.079	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-108.8	8.8	177.5	-62.3	-171.1	0	0	0	112.3	R125 F127 P343 E349 P350 S354	R125-L352 HydrophobicContact CG-CD2 4.2Å; F127-L352 HydrophobicContact CE2-CD2 4.27Å; F127-L352 HydrophobicContact CZ-CD1 4.47Å; F127-L352 HydrophobicContact CZ-CD2 4.25Å; P343-L352 HydrophobicContact CB-CD1 4.15Å; P343-L352 HydrophobicContact CG-CD1 3.97Å; E349-L352 HydrophobicContact CG-CB 4.38Å; E349-L352 HydrophobicContact CG-CG 4.2Å; E349-L352 PolarHBondContact O-N 3.45Å; E349-L352 VanDerWaalsContact O-N 3.09Å; E349-L352 WeakPolarHBondContact OE2-CD1 3.34Å; E349-L352 WeakPolarHBondContact OE2-CG 3.28Å; P350-L352 VanDerWaalsContact C-N 3.29Å; P350-L352 PolarHBondContact O-N 3.4Å; L352-S354 PolarHBondContact O-N 3.23Å
353	D	75.3	Confident	89.5	Confident	22 Å²	22	62.9 Å²	62.9	12%	0.118	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	21.4	-176.7	-147	30.8	0	0	0	113.8	S109 P121 I122 E349 P350	S109-D353 WeakPolarHBondContact CB-OD1 3.44Å; S109-D353 WeakPolarHBondContact CB-OD2 3.24Å; S109-D353 PolarHBondContact OG-O 3.03Å; P121-D353 HydrophobicContact CB-CB 4.39Å; P121-D353 HydrophobicContact CG-CB 4.49Å; I122-D353 HydrophobicContact CB-CB 3.94Å; I122-D353 HydrophobicContact CG2-CB 4.47Å; E349-D353 PolarHBondContact O-N 3.04Å; P350-D353 PolarHBondContact O-N 2.86Å
354	S	85.4	Confident	89.4	Confident	8 Å²	8	67.6 Å²	67.6	6%	0.056	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-86.1	113.3	177.9	-177.6	0	0	0	0	110.3	E347 R348 E349 L352 G356	E347-S354 PolarHBondContact O-OG 2.83Å; R348-S354 WeakPolarHBondContact CA-O 3.38Å; E349-S354 CarbonylContact C-O 3.59Å; E349-S354 PolarHBondContact N-O 2.99Å; E349-S354 PolarHBondContact O-N 3.05Å; E349-S354 VanDerWaalsContact O-N 3.08Å; L352-S354 PolarHBondContact O-N 3.23Å; S354-G356 PolarHBondContact O-N 2.77Å
355	A	86.8	Confident	89.4	Confident	61 Å²	61	68.1 Å²	68.1	50%	0.504	36%	0.359	S	S	.	.			trans	-73.4	-15	173.9	0	0	0	0	0	113.3
356	G	91.1	Very high	89.4	Confident	10 Å²	10	69.3 Å²	69.3	10%	0.103	37%	0.369	C	S	.	.			trans	76.5	175.8	-169.1	0	0	0	0	0	112.8	C346 S354	C346-G356 WeakPolarHBondContact O-CA 3.04Å; S354-G356 PolarHBondContact O-N 2.77Å
357	T	93.7	Very high	89.3	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	41%	0.41	C	S	.	.	S	Bend	trans	-108.8	0.7	-178	57.8	0	0	0	0	115	R104 C346 G359 R360 M375 R379 C416	R104-T357 HydrophobicContact CB-CG2 3.93Å; R104-T357 HydrophobicContact CG-CG2 4.01Å; C346-T357 PolarHBondContact O-N 3.04Å; C346-T357 PolarHBondContact O-OG1 3.4Å; T357-G359 PolarHBondContact O-N 2.98Å; T357-R360 WeakPolarHBondContact O-CB 3.49Å; T357-R360 WeakPolarHBondContact O-CG 3.49Å; T357-R360 PolarHBondContact O-N 2.87Å; T357-M375 WeakPolarHBondContact CB-O 3.11Å; T357-M375 VanDerWaalsContact CG2-O 3.28Å; T357-M375 WeakPolarHBondContact CG2-O 3.06Å; T357-M375 PolarHBondContact OG1-O 2.88Å; T357-M375 VanDerWaalsContact OG1-O 3.05Å; T357-R379 PolarHBondContact OG1-NH2 2.87Å; T357-C416 WeakPolarHBondContact O-CB 3.45Å
358	V	93.3	Very high	89.2	Confident	89 Å²	89	70.5 Å²	70.5	54%	0.539	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	132.9	175.4	176.8	0	0	0	0	109.8	R360 K417	V358-R360 VanDerWaalsContact C-N 3.28Å; V358-R360 PolarHBondContact O-N 2.89Å; V358-K417 WeakPolarHBondContact CG1-OXT 3.45Å
359	G	92.5	Very high	89.1	Confident	50 Å²	50	63 Å²	63	52%	0.515	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.1	5.3	179.3	0	0	0	0	0	115.3	T357 V415 C416	T357-G359 PolarHBondContact O-N 2.98Å; G359-V415 VanDerWaalsContact C-CG1 3.46Å; G359-V415 WeakPolarHBondContact O-CG1 3.28Å; G359-C416 PolarHBondContact N-O 2.78Å
360	R	93.1	Very high	89.3	Confident	35 Å²	35	60.6 Å²	60.6	13%	0.132	37%	0.368	C	S	.	.			trans	-83.9	142.6	178.7	-67.6	-164.7	61.9	-173.5	-6.6	113.2	R101 Q103 R104 T357 V358 M375 V415 C416	R101-R360 PolarHBondContact O-NH2 3.15Å; Q103-R360 PolarHBondContact O-NH1 3.31Å; Q103-R360 PolarHBondContact O-NH2 2.91Å; R104-R360 VanDerWaalsContact C-NH1 3.26Å; R104-R360 VanDerWaalsContact CA-NH1 3.33Å; R104-R360 PolarHBondContact O-NH1 3.18Å; T357-R360 WeakPolarHBondContact O-CB 3.49Å; T357-R360 WeakPolarHBondContact O-CG 3.49Å; T357-R360 PolarHBondContact O-N 2.87Å; V358-R360 VanDerWaalsContact C-N 3.28Å; V358-R360 PolarHBondContact O-N 2.89Å; R360-M375 HydrophobicContact CB-CG 4.49Å; R360-M375 HydrophobicContact CB-SD 3.92Å; R360-V415 CarbonylContact O-C 3.6Å; R360-V415 WeakPolarHBondContact O-CA 3.49Å; R360-C416 PolarHBondContact O-N 3.19Å
361	L	93.4	Very high	89.8	Confident	103 Å²	103	56.2 Å²	56.2	54%	0.539	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	126.6	173.2	-69.6	167	0	0	0	110.6	V413 S414 V415	L361-V413 HydrophobicContact CD2-CB 3.61Å; L361-V413 HydrophobicContact CD2-CG1 4Å; L361-V413 HydrophobicContact CD2-CG2 4.04Å; L361-S414 CarbonylContact C-O 3.48Å; L361-S414 WeakPolarHBondContact CA-O 3.39Å; L361-V415 HydrophobicContact CD2-CG2 4Å
362	C	94.2	Very high	90.4	Very high	15 Å²	15	47 Å²	47	10%	0.101	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	157.1	176.3	68.1	0	0	0	0	111.4	C372 M375 S414	C362-C372 VanDerWaalsContact C-SG 3.51Å; C362-C372 HydrophobicContact CB-CB 3.82Å; C362-C372 WeakPolarHBondContact CB-SG 3.47Å; C362-C372 WeakPolarHBondContact SG-CA 3Å; C362-C372 WeakPolarHBondContact SG-CB 2.99Å; C362-C372 CovalentContact SG-SG 2.04Å; C362-C372 PolarHBondContact SG-SG 2.95Å; C362-M375 HydrophobicContact CB-CB 4.16Å; C362-M375 HydrophobicContact CB-SD 4.18Å; C362-S414 PolarHBondContact N-O 3.34Å; C362-S414 WeakPolarHBondContact O-CB 3.42Å
363	N	94.1	Very high	90.9	Very high	69 Å²	69	49.3 Å²	49.3	37%	0.369	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-98.6	117.1	177.2	-172.4	-7.3	0	0	0	110.1	S365 D370 G371 C372	N363-S365 VanDerWaalsContact C-N 3.27Å; N363-S365 PolarHBondContact O-N 3.03Å; N363-S365 PolarHBondContact OD1-N 2.78Å; N363-D370 HydrophobicContact CB-CB 4.49Å; N363-D370 WeakPolarHBondContact CB-OD2 3.48Å; N363-D370 PolarHBondContact N-O 3.22Å; N363-D370 PolarHBondContact ND2-OD2 3.16Å; N363-G371 VanDerWaalsContact O-CA 3.27Å; N363-G371 WeakPolarHBondContact O-CA 3.31Å; N363-C372 VanDerWaalsContact C-SG 3.57Å; N363-C372 PolarHBondContact O-N 2.84Å
364	K	91.4	Very high	91.7	Very high	140 Å²	140	50.4 Å²	50.4	61%	0.609	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-25.4	179.1	67.9	179.8	-178.5	-179.9	0	113.4
365	S	90.7	Very high	92.1	Very high	106 Å²	106	50.1 Å²	50.1	74%	0.741	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-13.5	-175.4	-55.8	0	0	0	0	113.2	N363	N363-S365 VanDerWaalsContact C-N 3.27Å; N363-S365 PolarHBondContact O-N 3.03Å; N363-S365 PolarHBondContact OD1-N 2.78Å
366	S	92.6	Very high	92.5	Very high	37 Å²	37	47.2 Å²	47.2	26%	0.259	32%	0.317	S	S	.	.			trans	-92.3	137.4	-178.9	-176.2	0	0	0	0	111.5	G368 D370 G371	S366-G368 VanDerWaalsContact C-N 3.34Å; S366-G368 PolarHBondContact OG-N 3.31Å; S366-D370 VanDerWaalsContact CB-CG 3.46Å; S366-D370 VanDerWaalsContact CB-OD1 3.31Å; S366-D370 WeakPolarHBondContact CB-OD1 3.33Å; S366-D370 WeakPolarHBondContact CB-OD2 2.97Å; S366-D370 PolarHBondContact OG-OD1 3.01Å; S366-D370 PolarHBondContact OG-OD2 3.12Å; S366-G371 WeakPolarHBondContact O-CA 3.37Å
367	A	89.7	Confident	92.6	Very high	110 Å²	110	48.5 Å²	48.5	91%	0.909	32%	0.324	S	S	*	.			trans	-90.3	-0.5	167.7	0	0	0	0	0	112.8
368	G	89.5	Confident	92.6	Very high	33 Å²	33	51.8 Å²	51.8	34%	0.34	36%	0.358	S	S	.	.	S	Bend	trans	-78.2	-164.8	-178.5	0	0	0	0	0	114.1	S366 D370 G371 S374	S366-G368 VanDerWaalsContact C-N 3.34Å; S366-G368 PolarHBondContact OG-N 3.31Å; G368-D370 PolarHBondContact O-N 3.19Å; G368-G371 PolarHBondContact O-N 3.49Å; G368-G371 VanDerWaalsContact O-N 3.07Å; G368-S374 WeakPolarHBondContact O-CB 3.28Å
369	S	90.1	Very high	92.5	Very high	35 Å²	35	50.9 Å²	50.9	25%	0.245	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-25	175.3	58	0	0	0	0	113.5	D102 Q103 G371	D102-S369 CarbonylContact O-C 3.58Å; D102-S369 WeakPolarHBondContact O-CB 3.43Å; D102-S369 PolarHBondContact O-OG 3.18Å; Q103-S369 PolarHBondContact NE2-OG 2.02Å; S369-G371 VanDerWaalsContact C-N 3.25Å
370	D	92	Very high	92.6	Very high	38 Å²	38	49.9 Å²	49.9	20%	0.203	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-16.8	171.9	65	-45.8	0	0	0	112.6	D102 N363 S366 G368	D102-D370 HydrophobicContact CB-CB 4.06Å; D102-D370 PolarHBondContact O-N 2.91Å; N363-D370 HydrophobicContact CB-CB 4.49Å; N363-D370 WeakPolarHBondContact CB-OD2 3.48Å; N363-D370 PolarHBondContact N-O 3.22Å; N363-D370 PolarHBondContact ND2-OD2 3.16Å; S366-D370 VanDerWaalsContact CB-CG 3.46Å; S366-D370 VanDerWaalsContact CB-OD1 3.31Å; S366-D370 WeakPolarHBondContact CB-OD1 3.33Å; S366-D370 WeakPolarHBondContact CB-OD2 2.97Å; S366-D370 PolarHBondContact OG-OD1 3.01Å; S366-D370 PolarHBondContact OG-OD2 3.12Å; G368-D370 PolarHBondContact O-N 3.19Å
371	G	94	Very high	92.6	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.01	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-60.1	138.8	-179.9	0	0	0	0	0	112.7	N363 S366 G368 S369 G373 S374 M375	N363-G371 VanDerWaalsContact O-CA 3.27Å; N363-G371 WeakPolarHBondContact O-CA 3.31Å; S366-G371 WeakPolarHBondContact O-CA 3.37Å; G368-G371 PolarHBondContact O-N 3.49Å; G368-G371 VanDerWaalsContact O-N 3.07Å; S369-G371 VanDerWaalsContact C-N 3.25Å; G371-G373 PolarHBondContact O-N 2.77Å; G371-G373 VanDerWaalsContact O-N 3.13Å; G371-S374 PolarHBondContact O-N 2.71Å; G371-M375 PolarHBondContact O-N 2.99Å
372	C	94	Very high	92.7	Very high	11 Å²	11	49.9 Å²	49.9	7%	0.074	34%	0.336	C	S	.	.	H	α-helix	trans	-57.5	-29.7	178.7	-65.8	0	0	0	0	113.7	C362 N363 C376	C362-C372 VanDerWaalsContact C-SG 3.51Å; C362-C372 HydrophobicContact CB-CB 3.82Å; C362-C372 WeakPolarHBondContact CB-SG 3.47Å; C362-C372 WeakPolarHBondContact SG-CA 3Å; C362-C372 WeakPolarHBondContact SG-CB 2.99Å; C362-C372 CovalentContact SG-SG 2.04Å; C362-C372 PolarHBondContact SG-SG 2.95Å; N363-C372 VanDerWaalsContact C-SG 3.57Å; N363-C372 PolarHBondContact O-N 2.84Å; C372-C376 WeakPolarHBondContact O-CB 3.02Å; C372-C376 PolarHBondContact O-N 3.4Å; C372-C376 PolarHBondContact O-SG 3.49Å
373	G	92.2	Very high	92.7	Very high	63 Å²	63	53.3 Å²	53.3	65%	0.649	35%	0.352	S	S	*	.	H	α-helix	trans	-64.8	-41.2	173.6	0	0	0	0	0	113	G371	G371-G373 PolarHBondContact O-N 2.77Å; G371-G373 VanDerWaalsContact O-N 3.13Å
374	S	92.2	Very high	92.7	Very high	45 Å²	45	54.3 Å²	54.3	32%	0.315	36%	0.357	S	S	.	.	H	α-helix	trans	-83.3	-47.3	-178.8	-170.9	0	0	0	0	112.1	R104 G368 G371 C377	R104-S374 VanDerWaalsContact CZ-O 3.22Å; R104-S374 PolarHBondContact NE-O 3.41Å; R104-S374 PolarHBondContact NH2-O 2.83Å; G368-S374 WeakPolarHBondContact O-CB 3.28Å; G371-S374 PolarHBondContact O-N 2.71Å; S374-C377 PolarHBondContact O-N 3.43Å
375	M	93.9	Very high	92.8	Very high	2 Å²	2	56 Å²	56	1%	0.01	36%	0.36	C	S	.	.	H	α-helix	trans	-68.2	-39.9	-176.2	-168.1	173.5	-68.5	0	0	112.5	T357 R360 C362 G371 C377	T357-M375 WeakPolarHBondContact CB-O 3.11Å; T357-M375 VanDerWaalsContact CG2-O 3.28Å; T357-M375 WeakPolarHBondContact CG2-O 3.06Å; T357-M375 PolarHBondContact OG1-O 2.88Å; T357-M375 VanDerWaalsContact OG1-O 3.05Å; R360-M375 HydrophobicContact CB-CG 4.49Å; R360-M375 HydrophobicContact CB-SD 3.92Å; C362-M375 HydrophobicContact CB-CB 4.16Å; C362-M375 HydrophobicContact CB-SD 4.18Å; G371-M375 PolarHBondContact O-N 2.99Å; M375-C377 VanDerWaalsContact C-N 3.29Å; M375-C377 PolarHBondContact O-N 3.03Å
376	C	95	Very high	92.9	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	5.6	-177.6	-46.6	0	0	0	0	113.6	C372 G378 R379 G380 C416	C372-C376 WeakPolarHBondContact O-CB 3.02Å; C372-C376 PolarHBondContact O-N 3.4Å; C372-C376 PolarHBondContact O-SG 3.49Å; C376-G378 PolarHBondContact O-N 3.25Å; C376-R379 WeakPolarHBondContact O-CB 3.04Å; C376-R379 PolarHBondContact O-N 2.84Å; C376-G380 WeakPolarHBondContact CB-O 3.34Å; C376-C416 WeakPolarHBondContact CA-SG 3.2Å; C376-C416 HydrophobicContact CB-CB 3.61Å; C376-C416 WeakPolarHBondContact CB-SG 3.44Å; C376-C416 PolarHBondContact N-SG 3.05Å; C376-C416 WeakPolarHBondContact SG-CA 3.49Å; C376-C416 WeakPolarHBondContact SG-CB 2.98Å; C376-C416 CovalentContact SG-SG 2.04Å; C376-C416 PolarHBondContact SG-SG 3.39Å
377	C	94.1	Very high	93	Very high	36 Å²	36	57.1 Å²	57.1	24%	0.243	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	33.7	175.5	-53.4	0	0	0	0	114.5	R104 C346 S374 M375 R379	R104-C377 VanDerWaalsContact CZ-SG 3.55Å; C346-C377 VanDerWaalsContact CA-SG 3.56Å; C346-C377 HydrophobicContact CB-CB 3.7Å; C346-C377 WeakPolarHBondContact CB-SG 3.36Å; C346-C377 WeakPolarHBondContact SG-CB 3.46Å; C346-C377 CovalentContact SG-SG 2.02Å; C346-C377 PolarHBondContact SG-SG 3.45Å; S374-C377 PolarHBondContact O-N 3.43Å; M375-C377 VanDerWaalsContact C-N 3.29Å; M375-C377 PolarHBondContact O-N 3.03Å; C377-R379 VanDerWaalsContact C-N 3.3Å; C377-R379 PolarHBondContact O-N 2.84Å
378	G	91.9	Very high	93.1	Very high	70 Å²	70	57.1 Å²	57.1	72%	0.722	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-1.5	-178.4	0	0	0	0	0	116.1	C376 G380	C376-G378 PolarHBondContact O-N 3.25Å; G378-G380 PolarHBondContact O-N 2.04Å
379	R	92.9	Very high	93.3	Very high	69 Å²	69	59 Å²	59	26%	0.26	34%	0.339	S	S	.	.	S	Bend	trans	-68.8	-11.9	177.3	-60.1	-165.7	-62.3	-105.9	-10.8	113.9	C346 E347 T357 C376 C377 K417	C346-R379 PolarHBondContact O-NH1 2.82Å; E347-R379 IonicContact OE1-CZ 3.8Å; E347-R379 IonicContact OE1-NH1 2.71Å; E347-R379 PolarHBondContact OE1-NH1 2.87Å; E347-R379 IonicContact OE2-NH1 3.82Å; T357-R379 PolarHBondContact OG1-NH2 2.87Å; C376-R379 WeakPolarHBondContact O-CB 3.04Å; C376-R379 PolarHBondContact O-N 2.84Å; C377-R379 VanDerWaalsContact C-N 3.3Å; C377-R379 PolarHBondContact O-N 2.84Å; R379-K417 PolarHBondContact NE-O 2.77Å; R379-K417 PolarHBondContact NH2-O 2.88Å
380	G	92.9	Very high	93.6	Very high	29 Å²	29	60.5 Å²	60.5	30%	0.299	34%	0.342	S	S	.	.			trans	84.2	178.9	-170.7	0	0	0	0	0	112.7	C376 G378 K417	C376-G380 WeakPolarHBondContact CB-O 3.34Å; G378-G380 PolarHBondContact O-N 2.04Å; G380-K417 PolarHBondContact O-N 2.89Å
381	H	95.1	Very high	93.7	Very high	65 Å²	65	68.8 Å²	68.8	30%	0.301	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	151.2	-179.6	59.9	-82.6	0	0	0	110.4	V415	H381-V415 CarbonylContact C-O 3.59Å; H381-V415 VanDerWaalsContact CA-O 3.25Å; H381-V415 WeakPolarHBondContact CA-O 3.04Å; H381-V415 WeakPolarHBondContact CB-O 3.4Å
382	N	95.1	Very high	93.8	Very high	73 Å²	73	69.5 Å²	69.5	39%	0.39	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.2	168.6	-66.5	-31.8	0	0	0	108.8	L384 S414 V415 K417	N382-L384 HydrophobicContact CB-CD2 4.32Å; N382-L384 HydrophobicContact CB-CG 4.32Å; N382-S414 CarbonylContact O-C 3.59Å; N382-S414 WeakPolarHBondContact O-CA 3.25Å; N382-V415 PolarHBondContact N-O 3.26Å; N382-V415 PolarHBondContact O-N 3Å; N382-K417 WeakPolarHBondContact OD1-CE 3.44Å
383	I	94	Very high	93.8	Very high	88 Å²	88	75.2 Å²	75.2	45%	0.451	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	110	172.2	-58.6	177.1	0	0	0	106.8	W412 V413	I383-W412 HydrophobicContact CG2-CB 4.34Å; I383-W412 HydrophobicContact CG2-CD2 4.44Å; I383-W412 HydrophobicContact CG2-CE3 3.71Å; I383-W412 HydrophobicContact CG2-CZ3 4.37Å; I383-V413 WeakPolarHBondContact CA-O 3.41Å
384	L	93.2	Very high	94	Very high	89 Å²	89	75.4 Å²	75.4	47%	0.466	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	145.4	-178.1	-58.8	178.6	0	0	0	109.4	N382 V413 V415	N382-L384 HydrophobicContact CB-CD2 4.32Å; N382-L384 HydrophobicContact CB-CG 4.32Å; L384-V413 HydrophobicContact CB-CG2 4.26Å; L384-V413 PolarHBondContact N-O 2.88Å; L384-V413 WeakPolarHBondContact O-CG2 3.07Å; L384-V413 PolarHBondContact O-N 3.06Å; L384-V415 HydrophobicContact CD1-CB 4.35Å; L384-V415 HydrophobicContact CD1-CG2 4.13Å
385	R	94.4	Very high	94.1	Very high	176 Å²	176	81.5 Å²	81.5	66%	0.664	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	107.7	172.4	-169.1	175.7	73	176.8	-1.3	108.3	T410 W412	R385-T410 VanDerWaalsContact CD-CG2 3.41Å; R385-T410 HydrophobicContact CG-CG2 3.21Å; R385-W412 HydrophobicContact CB-CD2 4.45Å; R385-W412 HydrophobicContact CB-CE3 3.93Å; R385-W412 HydrophobicContact CB-CH2 4.27Å; R385-W412 HydrophobicContact CB-CZ3 3.86Å
386	Q	92	Very high	94.2	Very high	92 Å²	92	87.7 Å²	87.7	43%	0.43	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	125.8	-179.9	-173.2	171.5	16.8	0	0	109.5	T410 E411 V413	Q386-T410 WeakPolarHBondContact O-CA 3.44Å; Q386-E411 PolarHBondContact N-O 2.92Å; Q386-E411 PolarHBondContact O-N 2.04Å; Q386-V413 HydrophobicContact CB-CG1 4.33Å; Q386-V413 HydrophobicContact CB-CG2 3.79Å
387	T	94.1	Very high	94.1	Very high	75 Å²	75	91.6 Å²	91.6	46%	0.46	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	121	171.8	-56.9	0	0	0	0	108.6	R408 I409 T410	T387-R408 HydrophobicContact CG2-CB 3.84Å; T387-R408 HydrophobicContact CG2-CG 4.36Å; T387-I409 CarbonylContact C-O 3.5Å; T387-I409 VanDerWaalsContact CA-O 3.31Å; T387-I409 WeakPolarHBondContact CA-O 3.31Å; T387-T410 PolarHBondContact OG1-OG1 2.86Å
388	R	92.6	Very high	94	Very high	110 Å²	110	101.2 Å²	101.2	42%	0.415	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.5	172.6	72.2	-177.2	-165.3	-148.9	5.3	109.5	E390 I409 E411	R388-E390 IonicContact CZ-OE2 2.83Å; R388-E390 IonicContact NE-OE2 3.4Å; R388-E390 PolarHBondContact NE-OE2 3.07Å; R388-E390 IonicContact NH2-OE2 3.04Å; R388-E390 PolarHBondContact NH2-OE2 3.4Å; R388-I409 HydrophobicContact CG-CB 4.37Å; R388-I409 PolarHBondContact N-O 2.59Å; R388-I409 PolarHBondContact O-N 3.35Å; R388-E411 IonicContact CZ-OE1 2.77Å; R388-E411 IonicContact NE-OE1 3.39Å; R388-E411 IonicContact NH1-OE1 3.95Å; R388-E411 PolarHBondContact NH1-OE1 3.41Å; R388-E411 IonicContact NH1-OE2 3.72Å; R388-E411 PolarHBondContact NH1-OE2 2.82Å
389	S	95	Very high	93.7	Very high	73 Å²	73	101.9 Å²	101.9	51%	0.51	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	132.5	167.9	60.8	0	0	0	0	110.3	E406 C407	S389-E406 WeakPolarHBondContact CB-OE1 3.43Å; S389-E406 PolarHBondContact OG-OE1 3.18Å; S389-C407 WeakPolarHBondContact CA-O 3.42Å
390	E	94.9	Very high	93.3	Very high	66 Å²	66	103.5 Å²	103.5	31%	0.308	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	153.7	173	60.3	177.9	-126.4	0	0	110.5	R388 C392 C407 I409	R388-E390 IonicContact CZ-OE2 2.83Å; R388-E390 IonicContact NE-OE2 3.4Å; R388-E390 PolarHBondContact NE-OE2 3.07Å; R388-E390 IonicContact NH2-OE2 3.04Å; R388-E390 PolarHBondContact NH2-OE2 3.4Å; E390-C392 PolarHBondContact O-N 2.81Å; E390-C407 PolarHBondContact N-O 3.23Å; E390-C407 PolarHBondContact O-N 3.43Å; E390-I409 HydrophobicContact CG-CD1 3.84Å; E390-I409 HydrophobicContact CG-CG1 3.9Å; E390-I409 WeakPolarHBondContact OE1-CD1 3.48Å
391	R	95.2	Very high	93.3	Very high	211 Å²	211	107.7 Å²	107.7	80%	0.796	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	117.3	175.4	-69.7	-176.4	175.8	-179.2	-1.6	108.6	C404 E405	R391-C404 HydrophobicContact CB-CB 3.85Å; R391-C404 HydrophobicContact CG-CB 4.28Å; R391-E405 WeakPolarHBondContact CA-O 3.07Å
392	C	95	Very high	93.3	Very high	17 Å²	17	108.7 Å²	108.7	12%	0.115	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	171.6	-178.3	65.5	0	0	0	0	110.3	E390 C394 E405 C407	E390-C392 PolarHBondContact O-N 2.81Å; C392-C394 PolarHBondContact O-N 3.01Å; C392-E405 PolarHBondContact N-O 3.06Å; C392-E405 PolarHBondContact O-N 3.37Å; C392-E405 PolarHBondContact SG-O 2.84Å; C392-C407 HydrophobicContact CB-CB 3.53Å; C392-C407 WeakPolarHBondContact CB-SG 3.41Å; C392-C407 VanDerWaalsContact SG-CA 3.59Å; C392-C407 WeakPolarHBondContact SG-CB 3.41Å; C392-C407 PolarHBondContact SG-N 2.96Å; C392-C407 CovalentContact SG-SG 1.99Å; C392-C407 PolarHBondContact SG-SG 3.07Å
393	H	94.8	Very high	93.3	Very high	130 Å²	130	108.6 Å²	108.6	60%	0.602	52%	0.519	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48	35.9	176	-59.1	-57.7	0	0	0	113.8	R395 E405	H393-R395 PolarHBondContact O-N 3.18Å; H393-E405 IonicContact CD2-OE2 3.23Å
394	C	96.1	Very high	93.5	Very high	67 Å²	67	106.3 Å²	106.3	45%	0.453	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	119.3	-178.7	-65.5	0	0	0	0	110.9	C392 V402 V403 C404	C392-C394 PolarHBondContact O-N 3.01Å; C394-V402 HydrophobicContact CB-CG1 3.81Å; C394-V403 CarbonylContact C-O 3.6Å; C394-V403 WeakPolarHBondContact CA-O 3.18Å; C394-C404 HydrophobicContact CB-CB 4.07Å; C394-C404 WeakPolarHBondContact CB-SG 3.13Å; C394-C404 WeakPolarHBondContact SG-CB 3.27Å; C394-C404 CovalentContact SG-SG 2.04Å; C394-C404 PolarHBondContact SG-SG 3.31Å
395	R	94.8	Very high	93.6	Very high	174 Å²	174	107.3 Å²	107.3	66%	0.657	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.4	174.2	-63.4	-176.8	-175.1	-177.3	2.5	109.2	H393 V402 V403	H393-R395 PolarHBondContact O-N 3.18Å; R395-V402 WeakPolarHBondContact O-CA 3.31Å; R395-V403 PolarHBondContact N-O 3.13Å; R395-V403 PolarHBondContact O-N 2.97Å
396	F	95.8	Very high	93.7	Very high	131 Å²	131	105.8 Å²	105.8	58%	0.575	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	122.9	169.8	178.8	-102.8	0	0	0	108.9	W398 V402	F396-W398 AromaticContact CE1-CE3 3.93Å; F396-W398 HydrophobicContact CE1-CE3 3.93Å; F396-V402 HydrophobicContact CD2-CG2 3.91Å
397	H	92.7	Very high	93.9	Very high	82 Å²	82	103 Å²	103	38%	0.38	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.7	169.9	-70.7	-93.9	0	0	0	108.2	C399 F401	H397-C399 CarbonylContact O-C 3.44Å; H397-C399 PolarHBondContact O-N 3.45Å; H397-F401 HydrophobicContact CB-CD2 4.36Å; H397-F401 HydrophobicContact CB-CE1 4.24Å; H397-F401 HydrophobicContact CB-CE2 4.01Å; H397-F401 HydrophobicContact CB-CZ 3.94Å; H397-F401 AromaticContact CD2-CE2 3.83Å; H397-F401 AromaticContact CG-CE2 3.87Å; H397-F401 PolarHBondContact N-O 2.83Å
398	W	91.3	Very high	94	Very high	239 Å²	239	109.1 Å²	109.1	91%	0.905	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	110	178.9	-177.2	-99.2	0	0	0	109.6	F396	F396-W398 AromaticContact CE1-CE3 3.93Å; F396-W398 HydrophobicContact CE1-CE3 3.93Å
399	C	86.1	Confident	94	Very high	84 Å²	84	106.7 Å²	106.7	57%	0.568	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	110.5	-165.1	-162.2	0	0	0	0	117.9	H397	H397-C399 CarbonylContact O-C 3.44Å; H397-C399 PolarHBondContact O-N 3.45Å
400	C	84.6	Confident	94	Very high	102 Å²	102	106.7 Å²	106.7	69%	0.689	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	cis	-147.8	37.5	-5.2	-75.6	0	0	0	0	110.3
401	F	93.4	Very high	93.9	Very high	118 Å²	118	106.8 Å²	106.8	52%	0.518	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.8	-176.4	60.8	-85.2	0	0	0	111.5	H397 V403	H397-F401 HydrophobicContact CB-CD2 4.36Å; H397-F401 HydrophobicContact CB-CE1 4.24Å; H397-F401 HydrophobicContact CB-CE2 4.01Å; H397-F401 HydrophobicContact CB-CZ 3.94Å; H397-F401 AromaticContact CD2-CE2 3.83Å; H397-F401 AromaticContact CG-CE2 3.87Å; H397-F401 PolarHBondContact N-O 2.83Å; F401-V403 HydrophobicContact CD2-CG2 3.43Å; F401-V403 VanDerWaalsContact CD2-CG2 3.43Å; F401-V403 HydrophobicContact CE2-CG2 3.34Å
402	V	95	Very high	93.8	Very high	86 Å²	86	105.5 Å²	105.5	52%	0.521	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	122.5	171.7	179.5	0	0	0	0	107	C394 R395 F396	C394-V402 HydrophobicContact CB-CG1 3.81Å; R395-V402 WeakPolarHBondContact O-CA 3.31Å; F396-V402 HydrophobicContact CD2-CG2 3.91Å
403	V	95.5	Very high	93.8	Very high	70 Å²	70	105.5 Å²	105.5	42%	0.424	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	124.3	170.1	-176.6	0	0	0	0	107.4	C394 R395 F401	C394-V403 CarbonylContact C-O 3.6Å; C394-V403 WeakPolarHBondContact CA-O 3.18Å; R395-V403 PolarHBondContact N-O 3.13Å; R395-V403 PolarHBondContact O-N 2.97Å; F401-V403 HydrophobicContact CD2-CG2 3.43Å; F401-V403 VanDerWaalsContact CD2-CG2 3.43Å; F401-V403 HydrophobicContact CE2-CG2 3.34Å
404	C	96.8	Very high	93.8	Very high	41 Å²	41	99.8 Å²	99.8	28%	0.277	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	149.5	173.3	-55	0	0	0	0	109.2	R391 C394	R391-C404 HydrophobicContact CB-CB 3.85Å; R391-C404 HydrophobicContact CG-CB 4.28Å; C394-C404 HydrophobicContact CB-CB 4.07Å; C394-C404 WeakPolarHBondContact CB-SG 3.13Å; C394-C404 WeakPolarHBondContact SG-CB 3.27Å; C394-C404 CovalentContact SG-SG 2.04Å; C394-C404 PolarHBondContact SG-SG 3.31Å
405	E	96.1	Very high	93.7	Very high	110 Å²	110	97.6 Å²	97.6	51%	0.514	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	156.7	167.4	-65.7	171.6	-167.6	0	0	109.3	R391 C392 H393	R391-E405 WeakPolarHBondContact CA-O 3.07Å; C392-E405 PolarHBondContact N-O 3.06Å; C392-E405 PolarHBondContact O-N 3.37Å; C392-E405 PolarHBondContact SG-O 2.84Å; H393-E405 IonicContact CD2-OE2 3.23Å
406	E	96.2	Very high	93.7	Very high	144 Å²	144	89.4 Å²	89.4	67%	0.673	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	103.4	173.1	-170.7	174.7	-174.4	0	0	109.2	S389	S389-E406 WeakPolarHBondContact CB-OE1 3.43Å; S389-E406 PolarHBondContact OG-OE1 3.18Å
407	C	95.8	Very high	93.6	Very high	34 Å²	34	89.2 Å²	89.2	23%	0.23	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	140	174.1	-74.2	0	0	0	0	110.1	S389 E390 C392	S389-C407 WeakPolarHBondContact CA-O 3.42Å; E390-C407 PolarHBondContact N-O 3.23Å; E390-C407 PolarHBondContact O-N 3.43Å; C392-C407 HydrophobicContact CB-CB 3.53Å; C392-C407 WeakPolarHBondContact CB-SG 3.41Å; C392-C407 VanDerWaalsContact SG-CA 3.59Å; C392-C407 WeakPolarHBondContact SG-CB 3.41Å; C392-C407 PolarHBondContact SG-N 2.96Å; C392-C407 CovalentContact SG-SG 1.99Å; C392-C407 PolarHBondContact SG-SG 3.07Å
408	R	95.8	Very high	93.7	Very high	202 Å²	202	89.6 Å²	89.6	76%	0.762	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	106.8	168.4	-69.6	-177.2	177.9	159.8	0.6	109	T387	T387-R408 HydrophobicContact CG2-CB 3.84Å; T387-R408 HydrophobicContact CG2-CG 4.36Å
409	I	94	Very high	93.8	Very high	60 Å²	60	81.7 Å²	81.7	31%	0.308	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	125.9	173.3	-60.8	-160.1	0	0	0	108.6	T387 R388 E390	T387-I409 CarbonylContact C-O 3.5Å; T387-I409 VanDerWaalsContact CA-O 3.31Å; T387-I409 WeakPolarHBondContact CA-O 3.31Å; R388-I409 HydrophobicContact CG-CB 4.37Å; R388-I409 PolarHBondContact N-O 2.59Å; R388-I409 PolarHBondContact O-N 3.35Å; E390-I409 HydrophobicContact CG-CD1 3.84Å; E390-I409 HydrophobicContact CG-CG1 3.9Å; E390-I409 WeakPolarHBondContact OE1-CD1 3.48Å
410	T	93.7	Very high	94.2	Very high	72 Å²	72	81.6 Å²	81.6	44%	0.442	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	112.9	176.6	-59.4	0	0	0	0	108.7	R385 Q386 T387	R385-T410 VanDerWaalsContact CD-CG2 3.41Å; R385-T410 HydrophobicContact CG-CG2 3.21Å; Q386-T410 WeakPolarHBondContact O-CA 3.44Å; T387-T410 PolarHBondContact OG1-OG1 2.86Å
411	E	93	Very high	94.8	Very high	69 Å²	69	80.4 Å²	80.4	32%	0.322	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	150.9	-178.7	61.2	-176.7	164.9	0	0	111.5	Q386 R388 V413	Q386-E411 PolarHBondContact N-O 2.92Å; Q386-E411 PolarHBondContact O-N 2.04Å; R388-E411 IonicContact CZ-OE1 2.77Å; R388-E411 IonicContact NE-OE1 3.39Å; R388-E411 IonicContact NH1-OE1 3.95Å; R388-E411 PolarHBondContact NH1-OE1 3.41Å; R388-E411 IonicContact NH1-OE2 3.72Å; R388-E411 PolarHBondContact NH1-OE2 2.82Å; E411-V413 HydrophobicContact CG-CG1 4.01Å
412	W	93.1	Very high	94.9	Very high	183 Å²	183	78.1 Å²	78.1	69%	0.693	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.3	113.4	173.3	-68.5	102.2	0	0	0	109.1	I383 R385	I383-W412 HydrophobicContact CG2-CB 4.34Å; I383-W412 HydrophobicContact CG2-CD2 4.44Å; I383-W412 HydrophobicContact CG2-CE3 3.71Å; I383-W412 HydrophobicContact CG2-CZ3 4.37Å; R385-W412 HydrophobicContact CB-CD2 4.45Å; R385-W412 HydrophobicContact CB-CE3 3.93Å; R385-W412 HydrophobicContact CB-CH2 4.27Å; R385-W412 HydrophobicContact CB-CZ3 3.86Å
413	V	94.4	Very high	94.9	Very high	18 Å²	18	77.5 Å²	77.5	11%	0.109	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.7	178.8	-65.2	0	0	0	0	110.7	L361 I383 L384 Q386 E411 V415	L361-V413 HydrophobicContact CD2-CB 3.61Å; L361-V413 HydrophobicContact CD2-CG1 4Å; L361-V413 HydrophobicContact CD2-CG2 4.04Å; I383-V413 WeakPolarHBondContact CA-O 3.41Å; L384-V413 HydrophobicContact CB-CG2 4.26Å; L384-V413 PolarHBondContact N-O 2.88Å; L384-V413 WeakPolarHBondContact O-CG2 3.07Å; L384-V413 PolarHBondContact O-N 3.06Å; Q386-V413 HydrophobicContact CB-CG1 4.33Å; Q386-V413 HydrophobicContact CB-CG2 3.79Å; E411-V413 HydrophobicContact CG-CG1 4.01Å; V413-V415 HydrophobicContact CG2-CG2 4.08Å
414	S	95.1	Very high	94.8	Very high	9 Å²	9	78.1 Å²	78.1	6%	0.063	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.4	174.1	-56.7	0	0	0	0	108.7	L361 C362 N382	L361-S414 CarbonylContact C-O 3.48Å; L361-S414 WeakPolarHBondContact CA-O 3.39Å; C362-S414 PolarHBondContact N-O 3.34Å; C362-S414 WeakPolarHBondContact O-CB 3.42Å; N382-S414 CarbonylContact O-C 3.59Å; N382-S414 WeakPolarHBondContact O-CA 3.25Å
415	V	95.1	Very high	94.7	Very high	21 Å²	21	80.9 Å²	80.9	13%	0.127	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.8	-174	-178.8	0	0	0	0	109.3	G359 R360 L361 H381 N382 L384 V413	G359-V415 VanDerWaalsContact C-CG1 3.46Å; G359-V415 WeakPolarHBondContact O-CG1 3.28Å; R360-V415 CarbonylContact O-C 3.6Å; R360-V415 WeakPolarHBondContact O-CA 3.49Å; L361-V415 HydrophobicContact CD2-CG2 4Å; H381-V415 CarbonylContact C-O 3.59Å; H381-V415 VanDerWaalsContact CA-O 3.25Å; H381-V415 WeakPolarHBondContact CA-O 3.04Å; H381-V415 WeakPolarHBondContact CB-O 3.4Å; N382-V415 PolarHBondContact N-O 3.26Å; N382-V415 PolarHBondContact O-N 3Å; L384-V415 HydrophobicContact CD1-CB 4.35Å; L384-V415 HydrophobicContact CD1-CG2 4.13Å; V413-V415 HydrophobicContact CG2-CG2 4.08Å
416	C	94.8	Very high	94.6	Very high	3 Å²	3	78.5 Å²	78.5	2%	0.02	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	137.4	179	-63.5	0	0	0	0	112	T357 G359 R360 C376	T357-C416 WeakPolarHBondContact O-CB 3.45Å; G359-C416 PolarHBondContact N-O 2.78Å; R360-C416 PolarHBondContact O-N 3.19Å; C376-C416 WeakPolarHBondContact CA-SG 3.2Å; C376-C416 HydrophobicContact CB-CB 3.61Å; C376-C416 WeakPolarHBondContact CB-SG 3.44Å; C376-C416 PolarHBondContact N-SG 3.05Å; C376-C416 WeakPolarHBondContact SG-CA 3.49Å; C376-C416 WeakPolarHBondContact SG-CB 2.98Å; C376-C416 CovalentContact SG-SG 2.04Å; C376-C416 PolarHBondContact SG-SG 3.39Å
417	K	93.7	Very high	94.4	Very high	127 Å²	127	72.5 Å²	72.5	55%	0.552	33%	0.33	S	S	*	.			trans	-68.8	0	175.1	-70.6	-178.7	178.2	179	0	112.6	V358 R379 G380 N382	V358-K417 WeakPolarHBondContact CG1-OXT 3.45Å; R379-K417 PolarHBondContact NE-O 2.77Å; R379-K417 PolarHBondContact NH2-O 2.88Å; G380-K417 PolarHBondContact O-N 2.89Å; N382-K417 WeakPolarHBondContact OD1-CE 3.44Å

Retrieved 417 of 417 residues in 98.6 ms (Link to these results)

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