A0A077YWI7_TRITR Loading...

BACK and BTB domain containing protein

AlphaFold DB , UniProt , Accession A0A077YWI7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 435 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.8	Very low	72.3	Confident	245 Å²	245	135.1 Å²	135.1	100%	1.207	80%	0.796	S	S	*	*				0	68.2	0	-71.6	-178.3	-87.6	0	0	108.4	S3	M1-S3 PolarHBondContact O-N 2.96Å
2	A	56.7	Low	73.4	Confident	99 Å²	99	131.8 Å²	131.8	82%	0.818	77%	0.772	S	S	*	*			trans	-91.5	90.7	161	0	0	0	0	0	103.7	E4	A2-E4 PolarHBondContact O-N 3.05Å; A2-E4 VanDerWaalsContact O-N 3.1Å
3	S	57.3	Low	74.1	Confident	100 Å²	100	131.1 Å²	131.1	70%	0.699	76%	0.763	S	S	*	*			trans	-54.3	118.1	163.2	49.3	0	0	0	0	105.6	M1 I5	M1-S3 PolarHBondContact O-N 2.96Å; S3-I5 PolarHBondContact O-N 3.35Å
4	E	60.4	Low	74.4	Confident	182 Å²	182	136.9 Å²	136.9	85%	0.85	77%	0.766	S	S	*	*			trans	-45.1	112.9	175.9	-71.2	169.4	147	0	0	108.2	A2 S6	A2-E4 PolarHBondContact O-N 3.05Å; A2-E4 VanDerWaalsContact O-N 3.1Å; E4-S6 PolarHBondContact O-N 3.43Å
5	I	75.4	Confident	74.8	Confident	171 Å²	171	136.1 Å²	136.1	88%	0.877	75%	0.754	S	S	*	*			trans	-76.8	75.5	175.9	-56.8	173.6	0	0	0	105.6	S3	S3-I5 PolarHBondContact O-N 3.35Å
6	S	73.3	Confident	75.1	Confident	109 Å²	109	130.8 Å²	130.8	76%	0.762	73%	0.733	S	S	*	*			trans	-90.3	125.8	168.3	59.6	0	0	0	0	108	E4	E4-S6 PolarHBondContact O-N 3.43Å
7	A	85.6	Confident	75.5	Confident	75 Å²	75	126.8 Å²	126.8	62%	0.62	71%	0.71	S	S	*	*			trans	-130.5	138.4	170.9	0	0	0	0	0	108.5	C9	A7-C9 PolarHBondContact O-N 3.21Å
8	D	81.5	Confident	75.7	Confident	134 Å²	134	122.9 Å²	122.9	72%	0.717	70%	0.696	S	S	*	*			trans	-73.1	114.6	167.2	-67.8	-32.4	0	0	0	108.2	Y10	D8-Y10 HydrophobicContact CB-CD2 4.48Å; D8-Y10 HydrophobicContact CB-CE2 3.57Å
9	C	87.9	Confident	76.2	Confident	119 Å²	119	121.4 Å²	121.4	80%	0.804	68%	0.682	S	S	*	*			trans	-105.1	125.1	176.5	-64.7	0	0	0	0	108.5	A7	A7-C9 PolarHBondContact O-N 3.21Å
10	Y	84.6	Confident	76.8	Confident	187 Å²	187	120.4 Å²	120.4	73%	0.733	67%	0.671	S	S	*	*			trans	-111.6	145.1	-179.4	-58.6	-85.7	0	0	0	110.7	D8	D8-Y10 HydrophobicContact CB-CD2 4.48Å; D8-Y10 HydrophobicContact CB-CE2 3.57Å
11	G	84.4	Confident	77.3	Confident	65 Å²	65	118 Å²	118	67%	0.67	65%	0.654	S	S	*	*			trans	-84.1	-176.4	167.4	0	0	0	0	0	111.9	D13	G11-D13 PolarHBondContact O-N 2.93Å
12	D	84.8	Confident	79.3	Confident	95 Å²	95	113.9 Å²	113.9	51%	0.508	63%	0.625	S	S	.	*			trans	-85.2	103.4	171.1	-171.2	-33.8	0	0	0	110	R14 E15 A16	D12-R14 PolarHBondContact O-N 3.23Å; D12-R14 WeakPolarHBondContact OD1-CA 3.48Å; D12-R14 WeakPolarHBondContact OD1-CB 3.21Å; D12-R14 PolarHBondContact OD1-N 2.97Å; D12-E15 HydrophobicContact CB-CB 3.96Å; D12-E15 PolarHBondContact O-N 3.1Å; D12-E15 PolarHBondContact OD1-N 3.47Å; D12-A16 WeakPolarHBondContact O-CB 3.38Å; D12-A16 PolarHBondContact O-N 3.4Å
13	D	82.5	Confident	81.1	Confident	123 Å²	123	111.1 Å²	111.1	66%	0.658	60%	0.595	S	S	*	*	H	α-helix	trans	-59.6	-32.3	179.9	-68.4	-25.5	0	0	0	112.8	G11 L17	G11-D13 PolarHBondContact O-N 2.93Å; D13-L17 WeakPolarHBondContact O-CB 3.45Å; D13-L17 VanDerWaalsContact O-CG 3.23Å; D13-L17 WeakPolarHBondContact O-CG 3.42Å; D13-L17 PolarHBondContact O-N 3.38Å
14	R	78.4	Confident	82.8	Confident	213 Å²	213	108.5 Å²	108.5	80%	0.804	57%	0.571	S	S	*	*	H	α-helix	trans	-75.3	-41.2	-177.6	-171.3	179	-177.3	178.8	0.9	110.8	D12 L17 A18	D12-R14 PolarHBondContact O-N 3.23Å; D12-R14 WeakPolarHBondContact OD1-CA 3.48Å; D12-R14 WeakPolarHBondContact OD1-CB 3.21Å; D12-R14 PolarHBondContact OD1-N 2.97Å; R14-L17 PolarHBondContact O-N 3.19Å; R14-A18 WeakPolarHBondContact O-CB 3.14Å; R14-A18 PolarHBondContact O-N 3.31Å
15	E	80.6	Confident	84.4	Confident	124 Å²	124	103 Å²	103	58%	0.579	55%	0.547	S	S	*	.	H	α-helix	trans	-63.9	-46.7	173.8	-171.3	172.8	-153.4	0	0	110.6	D12 L17 A18 E19	D12-E15 HydrophobicContact CB-CB 3.96Å; D12-E15 PolarHBondContact O-N 3.1Å; D12-E15 PolarHBondContact OD1-N 3.47Å; E15-L17 VanDerWaalsContact C-N 3.31Å; E15-L17 PolarHBondContact O-N 2.97Å; E15-A18 PolarHBondContact O-N 2.84Å; E15-A18 VanDerWaalsContact O-N 3.1Å; E15-E19 PolarHBondContact O-N 3.32Å
16	A	80	Confident	85.3	Confident	51 Å²	51	96.6 Å²	96.6	42%	0.421	52%	0.516	S	S	.	.	H	α-helix	trans	-57.2	-42.2	176.9	0	0	0	0	0	112.3	D12 F20	D12-A16 WeakPolarHBondContact O-CB 3.38Å; D12-A16 PolarHBondContact O-N 3.4Å; A16-F20 WeakPolarHBondContact O-CD2 3.45Å
17	L	80.9	Confident	86.2	Confident	64 Å²	64	95.5 Å²	95.5	34%	0.335	51%	0.507	S	S	.	.	H	α-helix	trans	-68.8	-38.2	175.1	-74	172.3	0	0	0	113.1	D13 R14 E15 E19 F20	D13-L17 WeakPolarHBondContact O-CB 3.45Å; D13-L17 VanDerWaalsContact O-CG 3.23Å; D13-L17 WeakPolarHBondContact O-CG 3.42Å; D13-L17 PolarHBondContact O-N 3.38Å; R14-L17 PolarHBondContact O-N 3.19Å; E15-L17 VanDerWaalsContact C-N 3.31Å; E15-L17 PolarHBondContact O-N 2.97Å; L17-E19 VanDerWaalsContact C-N 3.28Å; L17-E19 PolarHBondContact O-N 3.49Å; L17-F20 WeakPolarHBondContact O-CB 3.32Å; L17-F20 PolarHBondContact O-N 2.87Å
18	A	79.8	Confident	86.5	Confident	56 Å²	56	96.4 Å²	96.4	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-35.3	176.8	0	0	0	0	0	111.7	R14 E15 F20 E21	R14-A18 WeakPolarHBondContact O-CB 3.14Å; R14-A18 PolarHBondContact O-N 3.31Å; E15-A18 PolarHBondContact O-N 2.84Å; E15-A18 VanDerWaalsContact O-N 3.1Å; A18-F20 PolarHBondContact O-N 3.1Å; A18-E21 VanDerWaalsContact O-CB 3.25Å; A18-E21 WeakPolarHBondContact O-CB 3.44Å; A18-E21 PolarHBondContact O-N 2.99Å; A18-E21 VanDerWaalsContact O-N 3.14Å
19	E	85.5	Confident	86.8	Confident	94 Å²	94	94.5 Å²	94.5	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-63.2	-28.5	174.8	-73.7	-161.3	-166.6	0	0	113.5	E15 L17 E21 R22	E15-E19 PolarHBondContact O-N 3.32Å; L17-E19 VanDerWaalsContact C-N 3.28Å; L17-E19 PolarHBondContact O-N 3.49Å; E19-E21 PolarHBondContact O-N 3.45Å; E19-R22 WeakPolarHBondContact O-CD 3.43Å; E19-R22 WeakPolarHBondContact O-CG 3.23Å; E19-R22 PolarHBondContact O-N 3.27Å; E19-R22 IonicContact OE2-CZ 3.36Å; E19-R22 IonicContact OE2-NH1 3.59Å; E19-R22 IonicContact OE2-NH2 2.74Å; E19-R22 PolarHBondContact OE2-NH2 3.37Å
20	F	87	Confident	87	Confident	102 Å²	102	90.4 Å²	90.4	45%	0.447	47%	0.47	S	S	.	.	H	α-helix	trans	-65.8	-23.6	176.8	-80.6	-77.9	0	0	0	112.6	A16 L17 A18 R22 F23 Y91	A16-F20 WeakPolarHBondContact O-CD2 3.45Å; L17-F20 WeakPolarHBondContact O-CB 3.32Å; L17-F20 PolarHBondContact O-N 2.87Å; A18-F20 PolarHBondContact O-N 3.1Å; F20-R22 PolarHBondContact O-N 3.4Å; F20-F23 HydrophobicContact CD1-CD2 4.37Å; F20-F23 PolarHBondContact O-N 3.14Å; F20-F23 VanDerWaalsContact O-N 3.09Å; F20-Y91 WeakPolarHBondContact CB-O 3.43Å; F20-Y91 WeakPolarHBondContact O-CD1 3.4Å
21	E	89	Confident	87.4	Confident	70 Å²	70	84.9 Å²	84.9	33%	0.327	45%	0.453	S	S	.	.	G	3₁₀ helix	trans	-58	-33.3	178.5	-168.4	173.5	168.1	0	0	112.1	A18 E19 F23 F24 R88 C92	A18-E21 VanDerWaalsContact O-CB 3.25Å; A18-E21 WeakPolarHBondContact O-CB 3.44Å; A18-E21 PolarHBondContact O-N 2.99Å; A18-E21 VanDerWaalsContact O-N 3.14Å; E19-E21 PolarHBondContact O-N 3.45Å; E21-F23 PolarHBondContact O-N 2.85Å; E21-F24 VanDerWaalsContact O-CB 3.26Å; E21-F24 WeakPolarHBondContact O-CB 3.36Å; E21-F24 PolarHBondContact O-N 3.14Å; E21-R88 IonicContact OE1-CZ 3.09Å; E21-R88 IonicContact OE1-NE 3.35Å; E21-R88 PolarHBondContact OE1-NE 3.44Å; E21-R88 IonicContact OE1-NH2 2.75Å; E21-R88 PolarHBondContact OE1-NH2 2.5Å; E21-R88 IonicContact OE2-NH2 2.63Å; E21-R88 PolarHBondContact OE2-NH2 2.68Å; E21-C92 HydrophobicContact CB-CB 3.99Å; E21-C92 HydrophobicContact CG-CB 4.35Å
22	R	90.9	Very high	87.8	Confident	159 Å²	159	82 Å²	82	60%	0.6	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-62.6	-18.7	-179.9	82.3	-167.4	165.2	-166.6	-20.9	113.8	E19 F20 T26	E19-R22 WeakPolarHBondContact O-CD 3.43Å; E19-R22 WeakPolarHBondContact O-CG 3.23Å; E19-R22 PolarHBondContact O-N 3.27Å; E19-R22 IonicContact OE2-CZ 3.36Å; E19-R22 IonicContact OE2-NH1 3.59Å; E19-R22 IonicContact OE2-NH2 2.74Å; E19-R22 PolarHBondContact OE2-NH2 3.37Å; F20-R22 PolarHBondContact O-N 3.4Å; R22-T26 VanDerWaalsContact O-CG2 3.27Å; R22-T26 WeakPolarHBondContact O-CG2 3.44Å
23	F	93.1	Very high	88.2	Confident	40 Å²	40	78.5 Å²	78.5	18%	0.175	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-88.7	-15.2	178.3	-62.9	-81.5	0	0	0	112.7	F20 E21 N25 T26 N28 H44 Y91	F20-F23 HydrophobicContact CD1-CD2 4.37Å; F20-F23 PolarHBondContact O-N 3.14Å; F20-F23 VanDerWaalsContact O-N 3.09Å; E21-F23 PolarHBondContact O-N 2.85Å; F23-N25 PolarHBondContact O-N 2.78Å; F23-T26 PolarHBondContact O-N 3.43Å; F23-T26 PolarHBondContact O-OG1 3.2Å; F23-N28 WeakPolarHBondContact CE1-ND2 3.47Å; F23-H44 PolarHBondContact O-CE1 2.99Å; F23-Y91 HydrophobicContact CB-CD1 4.38Å; F23-Y91 HydrophobicContact CB-CE1 4.21Å
24	F	93.3	Very high	88.9	Confident	45 Å²	45	72.6 Å²	72.6	20%	0.197	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	123.4	-178.7	166.9	-109.7	0	0	0	111.4	E21 T26 A84 L87 R88 Y91	E21-F24 VanDerWaalsContact O-CB 3.26Å; E21-F24 WeakPolarHBondContact O-CB 3.36Å; E21-F24 PolarHBondContact O-N 3.14Å; F24-T26 WeakPolarHBondContact O-CG2 3.26Å; F24-T26 PolarHBondContact O-N 3.31Å; F24-T26 VanDerWaalsContact O-N 3.16Å; F24-A84 VanDerWaalsContact CZ-O 3.32Å; F24-A84 WeakPolarHBondContact CZ-O 3.25Å; F24-L87 HydrophobicContact CD2-CG 4.26Å; F24-L87 HydrophobicContact CE2-CB 4.03Å; F24-L87 HydrophobicContact CE2-CD2 4Å; F24-L87 HydrophobicContact CE2-CG 3.81Å; F24-R88 HydrophobicContact CD1-CB 4.23Å; F24-R88 HydrophobicContact CD1-CG 4.22Å; F24-R88 HydrophobicContact CD2-CB 4.01Å; F24-R88 HydrophobicContact CE1-CB 4.05Å; F24-R88 HydrophobicContact CE1-CG 4.39Å; F24-R88 HydrophobicContact CE2-CB 3.82Å; F24-R88 HydrophobicContact CG-CB 4.21Å; F24-R88 HydrophobicContact CG-CG 4.32Å; F24-R88 HydrophobicContact CZ-CB 3.84Å; F24-Y91 HydrophobicContact CB-CD2 4.19Å; F24-Y91 HydrophobicContact CB-CG 4.15Å; F24-Y91 AromaticContact CD2-CD2 4Å; F24-Y91 HydrophobicContact CD2-CD2 4Å; F24-Y91 HydrophobicContact CD2-CE2 4.13Å
25	N	94.2	Very high	89.7	Confident	66 Å²	66	63.6 Å²	63.6	35%	0.353	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	32.7	178.5	-158.2	24.1	0	0	0	114.7	F23 F41 R42	F23-N25 PolarHBondContact O-N 2.78Å; N25-F41 WeakPolarHBondContact OD1-CA 3.49Å; N25-R42 VanDerWaalsContact CA-O 3.26Å; N25-R42 WeakPolarHBondContact CA-O 3.46Å; N25-R42 PolarHBondContact N-O 3.21Å; N25-R42 PolarHBondContact OD1-N 3.02Å
26	T	94.3	Very high	90.5	Very high	37 Å²	37	57.7 Å²	57.7	23%	0.227	31%	0.314	C	S	.	.			trans	-109.1	154	174.7	73.2	0	0	0	0	110.8	R22 F23 F24 N28 S30 R42	R22-T26 VanDerWaalsContact O-CG2 3.27Å; R22-T26 WeakPolarHBondContact O-CG2 3.44Å; F23-T26 PolarHBondContact O-N 3.43Å; F23-T26 PolarHBondContact O-OG1 3.2Å; F24-T26 WeakPolarHBondContact O-CG2 3.26Å; F24-T26 PolarHBondContact O-N 3.31Å; F24-T26 VanDerWaalsContact O-N 3.16Å; T26-N28 PolarHBondContact O-N 3.29Å; T26-S30 WeakPolarHBondContact O-CB 3.4Å; T26-R42 WeakPolarHBondContact O-CB 3.27Å
27	P	91.4	Very high	91.2	Very high	87 Å²	87	60.6 Å²	60.6	57%	0.565	32%	0.322	S	S	*	.	S	Bend	trans	-73.5	-10.7	173	30.8	-35.1	0	0	0	113.4	C29 S30	P27-C29 PolarHBondContact O-N 3.17Å; P27-S30 WeakPolarHBondContact CA-OG 3.26Å; P27-S30 PolarHBondContact O-N 3.21Å; P27-S30 PolarHBondContact O-OG 3.37Å
28	N	92.3	Very high	91.9	Very high	94 Å²	94	64.7 Å²	64.7	50%	0.503	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	117.4	-175.4	-172	36.9	0	0	0	109.6	F23 T26 S30 H44	F23-N28 WeakPolarHBondContact CE1-ND2 3.47Å; T26-N28 PolarHBondContact O-N 3.29Å; N28-S30 PolarHBondContact O-N 3.22Å; N28-H44 PolarHBondContact O-NE2 3.09Å
29	C	88.9	Confident	92.7	Very high	93 Å²	93	65.6 Å²	65.6	63%	0.628	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.3	7.4	-176.3	-57.7	0	0	0	0	115.9	P27 D31 H44	P27-C29 PolarHBondContact O-N 3.17Å; C29-D31 PolarHBondContact O-N 3.01Å; C29-H44 VanDerWaalsContact C-CD2 3.47Å; C29-H44 VanDerWaalsContact C-NE2 3.31Å; C29-H44 PolarHBondContact O-CD2 2.87Å; C29-H44 PolarHBondContact O-NE2 3.02Å
30	S	91.8	Very high	93.2	Very high	34 Å²	34	67.2 Å²	67.2	24%	0.238	34%	0.344	C	S	.	.			trans	-67.3	128.6	177.1	66.9	0	0	0	0	110.5	T26 P27 N28 A43 H44	T26-S30 WeakPolarHBondContact O-CB 3.4Å; P27-S30 WeakPolarHBondContact CA-OG 3.26Å; P27-S30 PolarHBondContact O-N 3.21Å; P27-S30 PolarHBondContact O-OG 3.37Å; N28-S30 PolarHBondContact O-N 3.22Å; S30-A43 WeakPolarHBondContact CA-O 3.45Å; S30-A43 WeakPolarHBondContact CB-O 3.23Å; S30-H44 PolarHBondContact N-NE2 3.07Å
31	D	92	Very high	93.7	Very high	71 Å²	71	63 Å²	63	38%	0.38	33%	0.325	S	S	.	.			trans	-117.7	5.6	-177.4	59.8	-8.4	0	0	0	112.6	C29 A43 H44 K45	C29-D31 PolarHBondContact O-N 3.01Å; D31-A43 PolarHBondContact N-O 3.35Å; D31-H44 VanDerWaalsContact OD1-CA 3.23Å; D31-H44 WeakPolarHBondContact OD1-CA 3.35Å; D31-K45 VanDerWaalsContact O-CE 3.28Å; D31-K45 WeakPolarHBondContact O-CE 3.39Å; D31-K45 WeakPolarHBondContact OD1-CG 3.28Å; D31-K45 PolarHBondContact OD1-N 3.48Å; D31-K45 WeakPolarHBondContact OD2-CB 3.4Å; D31-K45 WeakPolarHBondContact OD2-CG 3.18Å
32	I	92.7	Very high	94	Very high	3 Å²	3	65.7 Å²	65.7	2%	0.015	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	149.4	177.6	-173.3	165.7	0	0	0	111.8	L34 A43 K45 L48 M59 Q69 I71	I32-L34 HydrophobicContact CD1-CD2 4.14Å; I32-L34 HydrophobicContact CG1-CD2 4.35Å; I32-A43 HydrophobicContact CG2-CB 4.04Å; I32-A43 WeakPolarHBondContact CG2-O 3.39Å; I32-A43 PolarHBondContact N-O 2.75Å; I32-A43 PolarHBondContact O-N 3.46Å; I32-K45 HydrophobicContact CB-CG 3.9Å; I32-K45 HydrophobicContact CD1-CG 4.34Å; I32-K45 HydrophobicContact CG2-CG 3.78Å; I32-L48 HydrophobicContact CG2-CD1 4.02Å; I32-M59 HydrophobicContact CD1-CG 3.8Å; I32-M59 HydrophobicContact CD1-SD 3.65Å; I32-Q69 CarbonylContact C-O 3.58Å; I32-Q69 WeakPolarHBondContact CA-O 3.15Å; I32-I71 HydrophobicContact CD1-CD1 3.42Å; I32-I71 VanDerWaalsContact CD1-CD1 3.42Å; I32-I71 HydrophobicContact CD1-CG1 3.79Å; I32-I71 HydrophobicContact CG1-CG1 4.45Å
33	T	94.7	Very high	94.3	Very high	22 Å²	22	58.1 Å²	58.1	14%	0.135	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.1	168.8	-58.1	0	0	0	0	109.7	V35 R40 F41 Q69 E70 I71	T33-V35 HydrophobicContact CG2-CG2 4.45Å; T33-R40 HydrophobicContact CG2-CB 4.12Å; T33-F41 CarbonylContact C-O 3.53Å; T33-F41 VanDerWaalsContact CA-O 3.31Å; T33-F41 WeakPolarHBondContact CA-O 3.35Å; T33-Q69 PolarHBondContact N-O 3.03Å; T33-E70 CarbonylContact O-C 3.55Å; T33-E70 VanDerWaalsContact O-CA 3.28Å; T33-E70 WeakPolarHBondContact O-CA 3.35Å; T33-I71 PolarHBondContact O-N 3.14Å
34	L	96	Very high	94.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	128.1	170.8	-54.1	179.7	0	0	0	108.6	I32 F41 A43 L48 F55 I71 L73 F83 L87	I32-L34 HydrophobicContact CD1-CD2 4.14Å; I32-L34 HydrophobicContact CG1-CD2 4.35Å; L34-F41 HydrophobicContact CB-CB 4.4Å; L34-F41 PolarHBondContact N-O 3.43Å; L34-F41 PolarHBondContact O-N 3.16Å; L34-A43 HydrophobicContact CD1-CB 4.46Å; L34-A43 HydrophobicContact CG-CB 4.44Å; L34-L48 HydrophobicContact CD1-CD1 3.98Å; L34-L48 HydrophobicContact CD1-CD2 4.15Å; L34-L48 HydrophobicContact CD2-CD1 4.14Å; L34-L48 HydrophobicContact CG-CD1 4.32Å; L34-F55 HydrophobicContact CD1-CE1 4.37Å; L34-F55 HydrophobicContact CD1-CZ 4.4Å; L34-I71 CarbonylContact C-O 3.56Å; L34-I71 WeakPolarHBondContact CA-O 3.26Å; L34-I71 HydrophobicContact CD2-CB 4.07Å; L34-L73 HydrophobicContact CB-CD1 4.13Å; L34-L73 HydrophobicContact CD1-CD1 4.17Å; L34-L73 HydrophobicContact CD2-CD1 4.28Å; L34-L73 HydrophobicContact CG-CD1 4.42Å; L34-F83 HydrophobicContact CD1-CE1 4.23Å; L34-F83 HydrophobicContact CD1-CZ 4.08Å; L34-L87 HydrophobicContact CD1-CD1 4.27Å
35	V	96.2	Very high	94.3	Very high	23 Å²	23	58.1 Å²	58.1	14%	0.139	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.9	177.2	-173	0	0	0	0	107.5	T33 N39 R40 I71 E72 L73	T33-V35 HydrophobicContact CG2-CG2 4.45Å; V35-N39 CarbonylContact C-O 3.59Å; V35-N39 WeakPolarHBondContact CA-O 3.41Å; V35-R40 HydrophobicContact CG1-CG 4.38Å; V35-R40 HydrophobicContact CG2-CG 4.32Å; V35-I71 PolarHBondContact N-O 3.5Å; V35-E72 CarbonylContact O-C 3.6Å; V35-E72 WeakPolarHBondContact O-CA 3.35Å; V35-L73 PolarHBondContact O-N 3.4Å
36	V	96.8	Very high	94.3	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	104.4	-179	-168.6	0	0	0	0	107.9	D38 N39 F41 L73 E75 V80 F83	V36-D38 PolarHBondContact O-N 2.95Å; V36-N39 PolarHBondContact N-O 2.76Å; V36-N39 WeakPolarHBondContact O-CB 3.28Å; V36-N39 PolarHBondContact O-N 3.09Å; V36-N39 PolarHBondContact O-ND2 2.63Å; V36-F41 HydrophobicContact CB-CE2 4.17Å; V36-F41 HydrophobicContact CG2-CD2 4.13Å; V36-F41 HydrophobicContact CG2-CE2 4.12Å; V36-L73 HydrophobicContact CG2-CB 4.08Å; V36-L73 HydrophobicContact CG2-CD1 4.04Å; V36-L73 HydrophobicContact CG2-CG 4.48Å; V36-E75 HydrophobicContact CG1-CB 4.05Å; V36-E75 HydrophobicContact CG1-CG 3.73Å; V36-V80 HydrophobicContact CG1-CG1 4.47Å; V36-V80 HydrophobicContact CG1-CG2 4.13Å; V36-F83 HydrophobicContact CB-CD1 4.42Å; V36-F83 HydrophobicContact CB-CG 4.43Å; V36-F83 HydrophobicContact CG1-CD2 4.29Å; V36-F83 HydrophobicContact CG1-CG 4.26Å; V36-F83 HydrophobicContact CG2-CD1 3.66Å; V36-F83 HydrophobicContact CG2-CD2 4.08Å; V36-F83 HydrophobicContact CG2-CE1 3.54Å; V36-F83 HydrophobicContact CG2-CE2 3.97Å; V36-F83 HydrophobicContact CG2-CG 3.93Å; V36-F83 HydrophobicContact CG2-CZ 3.71Å
37	D	95.4	Very high	94.3	Very high	112 Å²	112	60 Å²	60	60%	0.599	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	-132.5	-167.5	-159.1	33.1	0	0	0	109.6	N39 V80	D37-N39 PolarHBondContact O-N 2.75Å; D37-V80 HydrophobicContact CB-CG1 3.86Å; D37-V80 HydrophobicContact CB-CG2 4.16Å
38	D	94	Very high	94.5	Very high	151 Å²	151	55.9 Å²	55.9	81%	0.807	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.9	176.4	-67.5	-40.4	0	0	0	114.2	V36	V36-D38 PolarHBondContact O-N 2.95Å
39	N	96.7	Very high	94.6	Very high	74 Å²	74	52.5 Å²	52.5	40%	0.396	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	136.5	-173.6	-58.1	-74	0	0	0	111.9	V35 V36 D37 F41	V35-N39 CarbonylContact C-O 3.59Å; V35-N39 WeakPolarHBondContact CA-O 3.41Å; V36-N39 PolarHBondContact N-O 2.76Å; V36-N39 WeakPolarHBondContact O-CB 3.28Å; V36-N39 PolarHBondContact O-N 3.09Å; V36-N39 PolarHBondContact O-ND2 2.63Å; D37-N39 PolarHBondContact O-N 2.75Å; N39-F41 HydrophobicContact CB-CD2 4.36Å; N39-F41 HydrophobicContact CB-CE2 3.49Å; N39-F41 VanDerWaalsContact CB-CE2 3.49Å; N39-F41 HydrophobicContact CB-CZ 3.71Å
40	R	96.9	Very high	94.8	Very high	129 Å²	129	54.5 Å²	54.5	49%	0.487	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	117.5	178.5	-62.4	175.7	62.9	89.3	-2.8	110.2	T33 V35 E70	T33-R40 HydrophobicContact CG2-CB 4.12Å; V35-R40 HydrophobicContact CG1-CG 4.38Å; V35-R40 HydrophobicContact CG2-CG 4.32Å; R40-E70 IonicContact CZ-OE1 2.56Å; R40-E70 IonicContact CZ-OE2 3.51Å; R40-E70 IonicContact NH1-OE1 3.25Å; R40-E70 IonicContact NH1-OE2 2.9Å; R40-E70 PolarHBondContact NH1-OE2 3.21Å; R40-E70 IonicContact NH2-OE1 3.62Å; R40-E70 PolarHBondContact NH2-OE1 3.42Å; R40-E70 IonicContact NH2-OE2 3.73Å; R40-E70 PolarHBondContact NH2-OE2 3Å; R40-E70 VanDerWaalsContact NH2-OE2 3.09Å
41	F	97.6	Very high	95	Very high	14 Å²	14	53.7 Å²	53.7	6%	0.061	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.6	-177.7	-59.1	-82	0	0	0	110.7	N25 T33 L34 V36 N39 A43 F83 A84 L87	N25-F41 WeakPolarHBondContact OD1-CA 3.49Å; T33-F41 CarbonylContact C-O 3.53Å; T33-F41 VanDerWaalsContact CA-O 3.31Å; T33-F41 WeakPolarHBondContact CA-O 3.35Å; L34-F41 HydrophobicContact CB-CB 4.4Å; L34-F41 PolarHBondContact N-O 3.43Å; L34-F41 PolarHBondContact O-N 3.16Å; V36-F41 HydrophobicContact CB-CE2 4.17Å; V36-F41 HydrophobicContact CG2-CD2 4.13Å; V36-F41 HydrophobicContact CG2-CE2 4.12Å; N39-F41 HydrophobicContact CB-CD2 4.36Å; N39-F41 HydrophobicContact CB-CE2 3.49Å; N39-F41 VanDerWaalsContact CB-CE2 3.49Å; N39-F41 HydrophobicContact CB-CZ 3.71Å; F41-A43 PolarHBondContact O-N 2.86Å; F41-F83 AromaticContact CD2-CD1 3.75Å; F41-F83 HydrophobicContact CD2-CD1 3.75Å; F41-F83 AromaticContact CD2-CE1 3.91Å; F41-F83 HydrophobicContact CD2-CE1 3.91Å; F41-F83 AromaticContact CE2-CD1 3.56Å; F41-F83 HydrophobicContact CE2-CD1 3.56Å; F41-F83 HydrophobicContact CE2-CE1 4.19Å; F41-F83 HydrophobicContact CE2-CG 4.45Å; F41-F83 HydrophobicContact CG-CD1 4.41Å; F41-F83 HydrophobicContact CG-CE1 4.45Å; F41-F83 HydrophobicContact CZ-CD1 4.08Å; F41-A84 HydrophobicContact CE1-CB 3.69Å; F41-A84 HydrophobicContact CZ-CB 4.12Å; F41-L87 HydrophobicContact CB-CD2 3.56Å; F41-L87 HydrophobicContact CD1-CD2 4.12Å; F41-L87 HydrophobicContact CG-CD2 3.93Å
42	R	95.8	Very high	95.2	Very high	125 Å²	125	50.4 Å²	50.4	47%	0.472	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126.1	171.7	-66.2	-169.4	177.8	122.1	-4.6	109.1	N25 T26	N25-R42 VanDerWaalsContact CA-O 3.26Å; N25-R42 WeakPolarHBondContact CA-O 3.46Å; N25-R42 PolarHBondContact N-O 3.21Å; N25-R42 PolarHBondContact OD1-N 3.02Å; T26-R42 WeakPolarHBondContact O-CB 3.27Å
43	A	95.9	Very high	95.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	179.9	-174.1	0	0	0	0	0	111.7	S30 D31 I32 L34 F41 L48 Y91	S30-A43 WeakPolarHBondContact CA-O 3.45Å; S30-A43 WeakPolarHBondContact CB-O 3.23Å; D31-A43 PolarHBondContact N-O 3.35Å; I32-A43 HydrophobicContact CG2-CB 4.04Å; I32-A43 WeakPolarHBondContact CG2-O 3.39Å; I32-A43 PolarHBondContact N-O 2.75Å; I32-A43 PolarHBondContact O-N 3.46Å; L34-A43 HydrophobicContact CD1-CB 4.46Å; L34-A43 HydrophobicContact CG-CB 4.44Å; F41-A43 PolarHBondContact O-N 2.86Å; A43-L48 HydrophobicContact CB-CD1 4.03Å; A43-L48 HydrophobicContact CB-CG 4.39Å; A43-Y91 WeakPolarHBondContact CA-OH 3.36Å
44	H	94.5	Very high	95.4	Very high	14 Å²	14	55.5 Å²	55.5	7%	0.065	27%	0.272	C	S	.	.			trans	-124.2	119.5	-175.3	-59.2	78.9	0	0	0	109	F23 N28 C29 S30 D31 I46 V47 L48 Y91	F23-H44 PolarHBondContact O-CE1 2.99Å; N28-H44 PolarHBondContact O-NE2 3.09Å; C29-H44 VanDerWaalsContact C-CD2 3.47Å; C29-H44 VanDerWaalsContact C-NE2 3.31Å; C29-H44 PolarHBondContact O-CD2 2.87Å; C29-H44 PolarHBondContact O-NE2 3.02Å; S30-H44 PolarHBondContact N-NE2 3.07Å; D31-H44 VanDerWaalsContact OD1-CA 3.23Å; D31-H44 WeakPolarHBondContact OD1-CA 3.35Å; H44-I46 HydrophobicContact CB-CG2 4.46Å; H44-I46 PolarHBondContact O-N 2.94Å; H44-V47 HydrophobicContact CB-CB 4.12Å; H44-V47 HydrophobicContact CB-CG2 3.84Å; H44-V47 PolarHBondContact O-N 2.82Å; H44-L48 WeakPolarHBondContact O-CG 3.36Å; H44-L48 PolarHBondContact O-N 3.35Å; H44-Y91 PolarHBondContact N-OH 3.07Å; H44-Y91 VanDerWaalsContact N-OH 3.1Å; H44-Y91 AromaticContact ND1-CE1 3.44Å; H44-Y91 WeakPolarHBondContact ND1-CE1 3.48Å; H44-Y91 AromaticContact ND1-CZ 3.58Å; H44-Y91 PolarHBondContact ND1-OH 3.27Å
45	K	93	Very high	95.4	Very high	71 Å²	71	55.5 Å²	55.5	31%	0.309	27%	0.272	S	S	.	.	H	α-helix	trans	-54.7	-41.7	-177	-66	179.9	177.3	175.9	0	111.6	D31 I32 V47 L48 A49 M59	D31-K45 VanDerWaalsContact O-CE 3.28Å; D31-K45 WeakPolarHBondContact O-CE 3.39Å; D31-K45 WeakPolarHBondContact OD1-CG 3.28Å; D31-K45 PolarHBondContact OD1-N 3.48Å; D31-K45 WeakPolarHBondContact OD2-CB 3.4Å; D31-K45 WeakPolarHBondContact OD2-CG 3.18Å; I32-K45 HydrophobicContact CB-CG 3.9Å; I32-K45 HydrophobicContact CD1-CG 4.34Å; I32-K45 HydrophobicContact CG2-CG 3.78Å; K45-V47 PolarHBondContact O-N 2.77Å; K45-L48 PolarHBondContact O-N 3.03Å; K45-A49 VanDerWaalsContact O-CB 3.26Å; K45-A49 WeakPolarHBondContact O-CB 3.41Å; K45-A49 PolarHBondContact O-N 3.1Å; K45-M59 HydrophobicContact CB-CE 4.22Å; K45-M59 HydrophobicContact CB-SD 3.72Å; K45-M59 HydrophobicContact CD-SD 4.41Å; K45-M59 HydrophobicContact CG-SD 3.56Å; K45-M59 VanDerWaalsContact CG-SD 3.56Å; K45-M59 WeakPolarHBondContact O-CE 3.46Å
46	I	92.8	Very high	95.2	Very high	127 Å²	127	59.9 Å²	59.9	65%	0.651	29%	0.291	S	S	*	.	H	α-helix	trans	-62.7	-39.8	178.8	-170.3	61.4	0	0	0	112.6	H44 K50	H44-I46 HydrophobicContact CB-CG2 4.46Å; H44-I46 PolarHBondContact O-N 2.94Å; I46-K50 WeakPolarHBondContact O-CB 3.36Å; I46-K50 PolarHBondContact O-N 2.95Å
47	V	94.7	Very high	94.9	Very high	17 Å²	17	67.5 Å²	67.5	10%	0.103	32%	0.319	C	S	.	.	H	α-helix	trans	-69.5	-42.1	178.7	176.6	0	0	0	0	110.5	H44 K45 N51 L90 Y91	H44-V47 HydrophobicContact CB-CB 4.12Å; H44-V47 HydrophobicContact CB-CG2 3.84Å; H44-V47 PolarHBondContact O-N 2.82Å; K45-V47 PolarHBondContact O-N 2.77Å; V47-N51 PolarHBondContact O-N 2.78Å; V47-N51 PolarHBondContact O-ND2 3.15Å; V47-L90 HydrophobicContact CG1-CB 4.3Å; V47-L90 WeakPolarHBondContact CG1-O 3.33Å; V47-Y91 HydrophobicContact CB-CE1 4.18Å; V47-Y91 HydrophobicContact CG1-CD1 4.01Å; V47-Y91 HydrophobicContact CG1-CD2 4.07Å; V47-Y91 HydrophobicContact CG1-CE1 3.94Å; V47-Y91 HydrophobicContact CG1-CE2 3.99Å; V47-Y91 HydrophobicContact CG1-CG 4.07Å; V47-Y91 HydrophobicContact CG2-CD1 4.27Å; V47-Y91 HydrophobicContact CG2-CE1 3.89Å
48	L	95.4	Very high	94.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.9	-51.4	177.5	-64.7	177.5	0	0	0	111.1	I32 L34 A43 H44 K45 K50 N51 S52 F55 M59 L87 L90	I32-L48 HydrophobicContact CG2-CD1 4.02Å; L34-L48 HydrophobicContact CD1-CD1 3.98Å; L34-L48 HydrophobicContact CD1-CD2 4.15Å; L34-L48 HydrophobicContact CD2-CD1 4.14Å; L34-L48 HydrophobicContact CG-CD1 4.32Å; A43-L48 HydrophobicContact CB-CD1 4.03Å; A43-L48 HydrophobicContact CB-CG 4.39Å; H44-L48 WeakPolarHBondContact O-CG 3.36Å; H44-L48 PolarHBondContact O-N 3.35Å; K45-L48 PolarHBondContact O-N 3.03Å; L48-K50 PolarHBondContact O-N 2.67Å; L48-N51 PolarHBondContact O-N 2.86Å; L48-S52 WeakPolarHBondContact O-CB 3.31Å; L48-S52 PolarHBondContact O-N 2.79Å; L48-F55 HydrophobicContact CB-CB 3.9Å; L48-F55 HydrophobicContact CB-CD2 4.21Å; L48-F55 HydrophobicContact CB-CG 4.16Å; L48-F55 HydrophobicContact CD2-CD2 4.03Å; L48-F55 HydrophobicContact CD2-CE2 4.16Å; L48-M59 HydrophobicContact CB-CE 3.74Å; L48-M59 HydrophobicContact CB-SD 4.3Å; L48-M59 HydrophobicContact CD1-CE 4.49Å; L48-M59 HydrophobicContact CD1-SD 3.98Å; L48-L87 HydrophobicContact CD2-CD1 3.63Å; L48-L90 HydrophobicContact CD2-CD1 3.8Å
49	A	94.1	Very high	94.2	Very high	22 Å²	22	57.9 Å²	57.9	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-62.6	-41.9	-178.7	0	0	0	0	0	112.5	K45 N51 S52 E56 M59	K45-A49 VanDerWaalsContact O-CB 3.26Å; K45-A49 WeakPolarHBondContact O-CB 3.41Å; K45-A49 PolarHBondContact O-N 3.1Å; A49-N51 PolarHBondContact O-N 3.32Å; A49-S52 PolarHBondContact O-N 3.42Å; A49-E56 HydrophobicContact CB-CB 3.72Å; A49-E56 HydrophobicContact CB-CG 3.91Å; A49-M59 HydrophobicContact CB-CE 3.93Å
50	K	94.6	Very high	93.6	Very high	135 Å²	135	56 Å²	56	59%	0.587	26%	0.26	S	S	*	.	H	α-helix	trans	-61.1	-30	178.9	177.4	-94.4	163.8	-169.3	0	113.1	I46 L48	I46-K50 WeakPolarHBondContact O-CB 3.36Å; I46-K50 PolarHBondContact O-N 2.95Å; L48-K50 PolarHBondContact O-N 2.67Å
51	N	95.3	Very high	92.5	Very high	18 Å²	18	56.9 Å²	56.9	10%	0.096	27%	0.267	C	S	.	.	H	α-helix	trans	-104.5	-10.7	-176.2	-67.3	-69.5	0	0	0	113.8	V47 L48 A49 L90	V47-N51 PolarHBondContact O-N 2.78Å; V47-N51 PolarHBondContact O-ND2 3.15Å; L48-N51 PolarHBondContact O-N 2.86Å; A49-N51 PolarHBondContact O-N 3.32Å; N51-L90 HydrophobicContact CB-CB 4.39Å; N51-L90 HydrophobicContact CB-CD2 3.9Å; N51-L90 PolarHBondContact ND2-O 3.23Å
52	S	97.1	Very high	91.1	Very high	2 Å²	2	64.4 Å²	64.4	1%	0.014	30%	0.302	C	S	.	.			trans	-153	113.5	-174	172.3	0	0	0	0	110.5	L48 A49 V54 F55 E56 Y112	L48-S52 WeakPolarHBondContact O-CB 3.31Å; L48-S52 PolarHBondContact O-N 2.79Å; A49-S52 PolarHBondContact O-N 3.42Å; S52-V54 PolarHBondContact O-N 3.21Å; S52-V54 PolarHBondContact OG-N 2.98Å; S52-F55 VanDerWaalsContact CB-CD2 3.49Å; S52-F55 PolarHBondContact O-N 2.65Å; S52-F55 WeakPolarHBondContact OG-CD2 3.37Å; S52-F55 PolarHBondContact OG-N 3.14Å; S52-E56 PolarHBondContact O-N 3.23Å; S52-Y112 VanDerWaalsContact CB-O 3.24Å; S52-Y112 WeakPolarHBondContact CB-O 3.35Å; S52-Y112 PolarHBondContact OG-O 3.07Å
53	D	95.4	Very high	89.7	Confident	81 Å²	81	66.5 Å²	66.5	43%	0.433	31%	0.31	S	S	.	.	H	α-helix	trans	-64	-29.5	171.6	59.9	-18.2	0	0	0	112.1	E56 R57 N113	D53-E56 PolarHBondContact O-N 3.25Å; D53-R57 VanDerWaalsContact O-CB 3.31Å; D53-R57 WeakPolarHBondContact O-CB 3.27Å; D53-R57 PolarHBondContact O-N 2.99Å; D53-N113 VanDerWaalsContact OD1-CB 3.29Å; D53-N113 WeakPolarHBondContact OD1-CB 3.45Å; D53-N113 PolarHBondContact OD1-ND2 3.31Å; D53-N113 PolarHBondContact OD2-ND2 2.93Å
54	V	95.7	Very high	88.3	Confident	50 Å²	50	67.9 Å²	67.9	30%	0.303	32%	0.318	S	S	.	.	H	α-helix	trans	-63.5	-48.2	173.4	-179.1	0	0	0	0	110.3	S52 R57 M58 Y112 N113	S52-V54 PolarHBondContact O-N 3.21Å; S52-V54 PolarHBondContact OG-N 2.98Å; V54-R57 PolarHBondContact O-N 3.46Å; V54-M58 HydrophobicContact CG1-CE 4.48Å; V54-M58 VanDerWaalsContact O-CB 3.3Å; V54-M58 WeakPolarHBondContact O-CB 3.32Å; V54-M58 PolarHBondContact O-N 3.13Å; V54-Y112 HydrophobicContact CG1-CD1 4.16Å; V54-N113 HydrophobicContact CG2-CB 4Å
55	F	94.7	Very high	87.1	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-65.5	-43.5	175.5	-76.9	-49.7	0	0	0	111.6	L34 L48 S52 R57 M58 M59 L73 F86 L90 Y112	L34-F55 HydrophobicContact CD1-CE1 4.37Å; L34-F55 HydrophobicContact CD1-CZ 4.4Å; L48-F55 HydrophobicContact CB-CB 3.9Å; L48-F55 HydrophobicContact CB-CD2 4.21Å; L48-F55 HydrophobicContact CB-CG 4.16Å; L48-F55 HydrophobicContact CD2-CD2 4.03Å; L48-F55 HydrophobicContact CD2-CE2 4.16Å; S52-F55 VanDerWaalsContact CB-CD2 3.49Å; S52-F55 PolarHBondContact O-N 2.65Å; S52-F55 WeakPolarHBondContact OG-CD2 3.37Å; S52-F55 PolarHBondContact OG-N 3.14Å; F55-R57 VanDerWaalsContact C-N 3.29Å; F55-R57 PolarHBondContact O-N 3.04Å; F55-M58 PolarHBondContact O-N 3.45Å; F55-M59 HydrophobicContact CB-CE 4.08Å; F55-M59 WeakPolarHBondContact O-CE 3.04Å; F55-M59 WeakPolarHBondContact O-CG 3.32Å; F55-M59 PolarHBondContact O-N 3.42Å; F55-L73 HydrophobicContact CE1-CD1 3.95Å; F55-L73 HydrophobicContact CE1-CD2 4.4Å; F55-L73 HydrophobicContact CZ-CD1 4.34Å; F55-F86 AromaticContact CE2-CE1 3.97Å; F55-F86 HydrophobicContact CE2-CE1 3.97Å; F55-F86 HydrophobicContact CE2-CZ 4.15Å; F55-F86 HydrophobicContact CZ-CE1 4.22Å; F55-L90 HydrophobicContact CD2-CD1 4.43Å; F55-L90 HydrophobicContact CE2-CD1 4.12Å; F55-Y112 HydrophobicContact CD1-CD1 4.01Å; F55-Y112 HydrophobicContact CD1-CE1 4.07Å; F55-Y112 HydrophobicContact CD2-CD1 4.16Å; F55-Y112 AromaticContact CE1-CD1 3.49Å; F55-Y112 HydrophobicContact CE1-CD1 3.49Å; F55-Y112 VanDerWaalsContact CE1-CD1 3.49Å; F55-Y112 AromaticContact CE1-CE1 3.28Å; F55-Y112 HydrophobicContact CE1-CE1 3.28Å; F55-Y112 HydrophobicContact CE1-CG 4.36Å; F55-Y112 AromaticContact CE2-CD1 3.65Å; F55-Y112 HydrophobicContact CE2-CD1 3.65Å; F55-Y112 HydrophobicContact CE2-CD2 4.46Å; F55-Y112 HydrophobicContact CE2-CE1 4.21Å; F55-Y112 AromaticContact CE2-CG 3.8Å; F55-Y112 HydrophobicContact CE2-CG 3.8Å; F55-Y112 HydrophobicContact CG-CD1 4.31Å; F55-Y112 AromaticContact CZ-CD1 3.28Å; F55-Y112 HydrophobicContact CZ-CD1 3.28Å; F55-Y112 HydrophobicContact CZ-CD2 4.14Å; F55-Y112 AromaticContact CZ-CE1 3.35Å; F55-Y112 HydrophobicContact CZ-CE1 3.35Å; F55-Y112 HydrophobicContact CZ-CE2 4.22Å; F55-Y112 AromaticContact CZ-CG 3.7Å; F55-Y112 HydrophobicContact CZ-CG 3.7Å; F55-Y112 AromaticContact CZ-CZ 3.85Å
56	E	92.7	Very high	85.7	Confident	115 Å²	115	70.6 Å²	70.6	54%	0.537	35%	0.345	S	S	.	.	H	α-helix	trans	-51.9	-50	174.9	-175.4	175.8	-150	0	0	111.2	A49 S52 D53 M59 S60	A49-E56 HydrophobicContact CB-CB 3.72Å; A49-E56 HydrophobicContact CB-CG 3.91Å; S52-E56 PolarHBondContact O-N 3.23Å; D53-E56 PolarHBondContact O-N 3.25Å; E56-M59 PolarHBondContact O-N 3.46Å; E56-S60 PolarHBondContact O-N 3.41Å; E56-S60 VanDerWaalsContact O-N 3.15Å
57	R	91	Very high	84.1	Confident	160 Å²	160	75.2 Å²	75.2	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-64.8	-42.2	178.5	-170	173.1	-170.3	120.1	8.9	112.2	D53 V54 F55 M59 S60 W63	D53-R57 VanDerWaalsContact O-CB 3.31Å; D53-R57 WeakPolarHBondContact O-CB 3.27Å; D53-R57 PolarHBondContact O-N 2.99Å; V54-R57 PolarHBondContact O-N 3.46Å; F55-R57 VanDerWaalsContact C-N 3.29Å; F55-R57 PolarHBondContact O-N 3.04Å; R57-M59 PolarHBondContact O-N 2.96Å; R57-S60 VanDerWaalsContact O-CB 3.27Å; R57-S60 WeakPolarHBondContact O-CB 3.33Å; R57-S60 PolarHBondContact O-N 3.18Å; R57-S60 VanDerWaalsContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.42Å; R57-W63 WeakPolarHBondContact O-CB 3.49Å
58	M	89.6	Confident	82.8	Confident	30 Å²	30	80.7 Å²	80.7	15%	0.148	38%	0.377	C	S	.	.	H	α-helix	trans	-62.3	-33.8	179.1	-167	-176.4	-66.6	0	0	112.1	V54 F55 N64 I71 L73 Y112	V54-M58 HydrophobicContact CG1-CE 4.48Å; V54-M58 VanDerWaalsContact O-CB 3.3Å; V54-M58 WeakPolarHBondContact O-CB 3.32Å; V54-M58 PolarHBondContact O-N 3.13Å; F55-M58 PolarHBondContact O-N 3.45Å; M58-N64 WeakPolarHBondContact O-CB 3.22Å; M58-N64 PolarHBondContact O-ND2 2.83Å; M58-N64 PolarHBondContact O-OD1 3.35Å; M58-I71 HydrophobicContact CG-CD1 4.11Å; M58-I71 HydrophobicContact CG-CG2 4.32Å; M58-I71 HydrophobicContact SD-CD1 4.16Å; M58-I71 HydrophobicContact SD-CG2 3.44Å; M58-I71 WeakPolarHBondContact SD-CG2 3.36Å; M58-L73 HydrophobicContact CE-CD2 3.84Å; M58-L73 HydrophobicContact SD-CD2 3.55Å; M58-L73 VanDerWaalsContact SD-CD2 3.55Å; M58-Y112 HydrophobicContact CE-CE1 4.39Å
59	M	85.7	Confident	82.1	Confident	31 Å²	31	87.6 Å²	87.6	15%	0.153	41%	0.409	C	S	.	.	H	α-helix	trans	-86.5	-6.9	178.2	-63.7	179.1	-63.7	0	0	113.9	I32 K45 L48 A49 F55 E56 R57 I71	I32-M59 HydrophobicContact CD1-CG 3.8Å; I32-M59 HydrophobicContact CD1-SD 3.65Å; K45-M59 HydrophobicContact CB-CE 4.22Å; K45-M59 HydrophobicContact CB-SD 3.72Å; K45-M59 HydrophobicContact CD-SD 4.41Å; K45-M59 HydrophobicContact CG-SD 3.56Å; K45-M59 VanDerWaalsContact CG-SD 3.56Å; K45-M59 WeakPolarHBondContact O-CE 3.46Å; L48-M59 HydrophobicContact CB-CE 3.74Å; L48-M59 HydrophobicContact CB-SD 4.3Å; L48-M59 HydrophobicContact CD1-CE 4.49Å; L48-M59 HydrophobicContact CD1-SD 3.98Å; A49-M59 HydrophobicContact CB-CE 3.93Å; F55-M59 HydrophobicContact CB-CE 4.08Å; F55-M59 WeakPolarHBondContact O-CE 3.04Å; F55-M59 WeakPolarHBondContact O-CG 3.32Å; F55-M59 PolarHBondContact O-N 3.42Å; E56-M59 PolarHBondContact O-N 3.46Å; R57-M59 PolarHBondContact O-N 2.96Å; M59-I71 HydrophobicContact CG-CD1 3.86Å
60	S	82.7	Confident	81.9	Confident	36 Å²	36	91 Å²	91	25%	0.252	42%	0.421	S	S	.	.	S	Bend	trans	-65.5	154.7	176.5	76.7	0	0	0	0	111.7	E56 R57 E62 W63 N64	E56-S60 PolarHBondContact O-N 3.41Å; E56-S60 VanDerWaalsContact O-N 3.15Å; R57-S60 VanDerWaalsContact O-CB 3.27Å; R57-S60 WeakPolarHBondContact O-CB 3.33Å; R57-S60 PolarHBondContact O-N 3.18Å; R57-S60 VanDerWaalsContact O-N 3.14Å; R57-S60 PolarHBondContact O-OG 3.42Å; S60-E62 PolarHBondContact O-N 2.83Å; S60-W63 PolarHBondContact O-N 2.95Å; S60-W63 VanDerWaalsContact O-N 3.13Å; S60-N64 PolarHBondContact O-N 2.94Å
61	K	74	Confident	81.7	Confident	147 Å²	147	85 Å²	85	64%	0.639	40%	0.395	S	S	*	.	H	α-helix	trans	-58.7	-30.4	176.9	-70	-168.4	171.9	-136.9	0	113	W63 G65 D66	K61-W63 VanDerWaalsContact C-N 3.29Å; K61-W63 PolarHBondContact O-N 2.99Å; K61-G65 WeakPolarHBondContact O-CA 3.44Å; K61-G65 PolarHBondContact O-N 3.36Å; K61-D66 WeakPolarHBondContact CE-OD1 3.45Å; K61-D66 IonicContact NZ-OD1 2.96Å; K61-D66 PolarHBondContact NZ-OD1 2.88Å
62	E	68.3	Low	81.5	Confident	171 Å²	171	91.5 Å²	91.5	80%	0.799	43%	0.425	S	S	*	.	H	α-helix	trans	-65.5	-33.9	179.5	-62.2	-178.4	174.2	0	0	112.1	S60	S60-E62 PolarHBondContact O-N 2.83Å
63	W	66.7	Low	81.4	Confident	170 Å²	170	91.8 Å²	91.8	64%	0.644	43%	0.426	S	S	*	.	H	α-helix	trans	-96.1	-47.6	-176.3	-166	-82.2	0	0	0	112.7	R57 S60 K61	R57-W63 WeakPolarHBondContact O-CB 3.49Å; S60-W63 PolarHBondContact O-N 2.95Å; S60-W63 VanDerWaalsContact O-N 3.13Å; K61-W63 VanDerWaalsContact C-N 3.29Å; K61-W63 PolarHBondContact O-N 2.99Å
64	N	67.6	Low	81.4	Confident	29 Å²	29	94.8 Å²	94.8	16%	0.155	44%	0.441	C	S	.	.	H	α-helix	trans	-100.8	1.3	-173.5	-92.9	-5.2	0	0	0	114.5	M58 S60 I71	M58-N64 WeakPolarHBondContact O-CB 3.22Å; M58-N64 PolarHBondContact O-ND2 2.83Å; M58-N64 PolarHBondContact O-OD1 3.35Å; S60-N64 PolarHBondContact O-N 2.94Å; N64-I71 WeakPolarHBondContact ND2-CD1 3.43Å; N64-I71 VanDerWaalsContact ND2-CG1 3.33Å; N64-I71 WeakPolarHBondContact ND2-CG1 3.43Å
65	G	68.1	Low	81.5	Confident	38 Å²	38	93.7 Å²	93.7	39%	0.392	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	-163.7	-173.5	0	0	0	0	0	112.5	K61 W67	K61-G65 WeakPolarHBondContact O-CA 3.44Å; K61-G65 PolarHBondContact O-N 3.36Å; G65-W67 PolarHBondContact O-N 3.42Å
66	D	63.1	Low	81.6	Confident	103 Å²	103	99.3 Å²	99.3	55%	0.551	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	108.2	172.3	-88.1	-16.5	0	0	0	108.5	K61	K61-D66 WeakPolarHBondContact CE-OD1 3.45Å; K61-D66 IonicContact NZ-OD1 2.96Å; K61-D66 PolarHBondContact NZ-OD1 2.88Å
67	W	60	Low	81.7	Confident	224 Å²	224	102 Å²	102	85%	0.848	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.5	22.9	155.2	-44.2	106.7	0	0	0	122.1	G65 Q69	G65-W67 PolarHBondContact O-N 3.42Å; W67-Q69 PolarHBondContact O-N 3.16Å
68	K	67	Low	81.9	Confident	132 Å²	132	98 Å²	98	57%	0.574	46%	0.457	S	S	*	.			trans	-70.8	117.1	166.5	-70.9	-169.5	-179.5	-177.8	0	111.5	E70	K68-E70 VanDerWaalsContact C-N 3.31Å
69	Q	81.9	Confident	82.4	Confident	146 Å²	146	96.6 Å²	96.6	68%	0.682	45%	0.45	S	S	*	.	S	Bend	trans	-82.7	-11.4	169.8	-73.1	-175.3	-14.2	0	0	112.4	I32 T33 W67	I32-Q69 CarbonylContact C-O 3.58Å; I32-Q69 WeakPolarHBondContact CA-O 3.15Å; T33-Q69 PolarHBondContact N-O 3.03Å; W67-Q69 PolarHBondContact O-N 3.16Å
70	E	89.3	Confident	82.9	Confident	94 Å²	94	95.8 Å²	95.8	44%	0.439	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.3	179.8	-56.6	-169.1	-169.8	0	0	110.9	T33 R40 K68	T33-E70 CarbonylContact O-C 3.55Å; T33-E70 VanDerWaalsContact O-CA 3.28Å; T33-E70 WeakPolarHBondContact O-CA 3.35Å; R40-E70 IonicContact CZ-OE1 2.56Å; R40-E70 IonicContact CZ-OE2 3.51Å; R40-E70 IonicContact NH1-OE1 3.25Å; R40-E70 IonicContact NH1-OE2 2.9Å; R40-E70 PolarHBondContact NH1-OE2 3.21Å; R40-E70 IonicContact NH2-OE1 3.62Å; R40-E70 PolarHBondContact NH2-OE1 3.42Å; R40-E70 IonicContact NH2-OE2 3.73Å; R40-E70 PolarHBondContact NH2-OE2 3Å; R40-E70 VanDerWaalsContact NH2-OE2 3.09Å; K68-E70 VanDerWaalsContact C-N 3.31Å
71	I	89.9	Confident	83.6	Confident	8 Å²	8	99.9 Å²	99.9	4%	0.041	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.9	173.9	-61.7	-173.1	0	0	0	108.2	I32 T33 L34 V35 M58 M59 N64 L73	I32-I71 HydrophobicContact CD1-CD1 3.42Å; I32-I71 VanDerWaalsContact CD1-CD1 3.42Å; I32-I71 HydrophobicContact CD1-CG1 3.79Å; I32-I71 HydrophobicContact CG1-CG1 4.45Å; T33-I71 PolarHBondContact O-N 3.14Å; L34-I71 CarbonylContact C-O 3.56Å; L34-I71 WeakPolarHBondContact CA-O 3.26Å; L34-I71 HydrophobicContact CD2-CB 4.07Å; V35-I71 PolarHBondContact N-O 3.5Å; M58-I71 HydrophobicContact CG-CD1 4.11Å; M58-I71 HydrophobicContact CG-CG2 4.32Å; M58-I71 HydrophobicContact SD-CD1 4.16Å; M58-I71 HydrophobicContact SD-CG2 3.44Å; M58-I71 WeakPolarHBondContact SD-CG2 3.36Å; M59-I71 HydrophobicContact CG-CD1 3.86Å; N64-I71 WeakPolarHBondContact ND2-CD1 3.43Å; N64-I71 VanDerWaalsContact ND2-CG1 3.33Å; N64-I71 WeakPolarHBondContact ND2-CG1 3.43Å; I71-L73 HydrophobicContact CG2-CD2 3.68Å; I71-L73 HydrophobicContact CG2-CG 4.28Å
72	E	92	Very high	84.7	Confident	155 Å²	155	93.2 Å²	93.2	72%	0.724	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.9	172.1	-169	178.1	176.7	0	0	110.1	V35	V35-E72 CarbonylContact O-C 3.6Å; V35-E72 WeakPolarHBondContact O-CA 3.35Å
73	L	95.1	Very high	86.2	Confident	7 Å²	7	85 Å²	85	4%	0.037	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	122	178.7	-53.4	172.8	0	0	0	108.7	L34 V35 V36 F55 M58 I71 F83 Y112	L34-L73 HydrophobicContact CB-CD1 4.13Å; L34-L73 HydrophobicContact CD1-CD1 4.17Å; L34-L73 HydrophobicContact CD2-CD1 4.28Å; L34-L73 HydrophobicContact CG-CD1 4.42Å; V35-L73 PolarHBondContact O-N 3.4Å; V36-L73 HydrophobicContact CG2-CB 4.08Å; V36-L73 HydrophobicContact CG2-CD1 4.04Å; V36-L73 HydrophobicContact CG2-CG 4.48Å; F55-L73 HydrophobicContact CE1-CD1 3.95Å; F55-L73 HydrophobicContact CE1-CD2 4.4Å; F55-L73 HydrophobicContact CZ-CD1 4.34Å; M58-L73 HydrophobicContact CE-CD2 3.84Å; M58-L73 HydrophobicContact SD-CD2 3.55Å; M58-L73 VanDerWaalsContact SD-CD2 3.55Å; I71-L73 HydrophobicContact CG2-CD2 3.68Å; I71-L73 HydrophobicContact CG2-CG 4.28Å; L73-F83 HydrophobicContact CD1-CE2 3.9Å; L73-F83 HydrophobicContact CD1-CZ 3.53Å; L73-Y112 HydrophobicContact CD2-CE1 4.43Å
74	I	95.4	Very high	87.6	Confident	145 Å²	145	78.7 Å²	78.7	74%	0.744	38%	0.383	S	S	*	.			trans	-90.1	116	177.3	-58.4	173.1	0	0	0	108.2	K111	I74-K111 PolarHBondContact O-NZ 3.21Å
75	E	97	Very high	89	Confident	26 Å²	26	79.8 Å²	79.8	12%	0.121	39%	0.391	C	S	.	.			trans	-125.1	151.4	178.9	-62.5	-54.1	156.1	0	0	112.2	V36 C79 V80 F83 L108 K111 Y112	V36-E75 HydrophobicContact CG1-CB 4.05Å; V36-E75 HydrophobicContact CG1-CG 3.73Å; E75-C79 HydrophobicContact CB-CB 4.05Å; E75-V80 HydrophobicContact CB-CG2 3.83Å; E75-F83 HydrophobicContact CG-CD2 4.43Å; E75-L108 HydrophobicContact CG-CD2 4.29Å; E75-K111 IonicContact OE1-NZ 3.37Å; E75-K111 PolarHBondContact OE1-NZ 3.07Å; E75-K111 IonicContact OE2-NZ 3.76Å; E75-K111 PolarHBondContact OE2-NZ 2.86Å; E75-Y112 WeakPolarHBondContact OE1-CE2 3.36Å; E75-Y112 VanDerWaalsContact OE1-CZ 3.28Å; E75-Y112 PolarHBondContact OE1-OH 2.96Å
76	E	95.8	Very high	90.4	Very high	118 Å²	118	78 Å²	78	55%	0.551	37%	0.372	S	S	*	.			trans	-63.2	149.1	167.9	-65.9	-175.2	-179.7	0	0	110.5	Q78 C79 V80	E76-Q78 HydrophobicContact CB-CG 4.29Å; E76-Q78 PolarHBondContact O-N 3.4Å; E76-Q78 VanDerWaalsContact O-N 3.07Å; E76-Q78 PolarHBondContact OE2-NE2 2.94Å; E76-C79 WeakPolarHBondContact O-CA 3.32Å; E76-C79 WeakPolarHBondContact O-CB 3.41Å; E76-C79 PolarHBondContact O-N 2.82Å; E76-V80 WeakPolarHBondContact O-CG2 3.48Å; E76-V80 PolarHBondContact O-N 3.23Å
77	K	96.4	Very high	92.1	Very high	172 Å²	172	73.1 Å²	73.1	75%	0.748	35%	0.346	S	S	*	.	H	α-helix	trans	-51.2	-39.8	-176	-173.1	174.4	-177.1	175.8	0	113.8	C79 V80 N81	K77-C79 VanDerWaalsContact C-N 3.33Å; K77-C79 PolarHBondContact O-N 3.46Å; K77-V80 PolarHBondContact O-N 3.36Å; K77-N81 VanDerWaalsContact O-CG 3.3Å; K77-N81 PolarHBondContact O-N 3.31Å; K77-N81 PolarHBondContact O-ND2 2.78Å
78	Q	95.6	Very high	93.8	Very high	77 Å²	77	65.2 Å²	65.2	36%	0.36	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-37.2	176.9	63.9	-178.5	-16.7	0	0	112.6	E76 P104	E76-Q78 HydrophobicContact CB-CG 4.29Å; E76-Q78 PolarHBondContact O-N 3.4Å; E76-Q78 VanDerWaalsContact O-N 3.07Å; E76-Q78 PolarHBondContact OE2-NE2 2.94Å; Q78-P104 HydrophobicContact CB-CB 4.35Å; Q78-P104 HydrophobicContact CB-CG 3.85Å; Q78-P104 HydrophobicContact CG-CB 4.32Å; Q78-P104 HydrophobicContact CG-CG 4.01Å
79	C	98.1	Very high	95.2	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-74.5	-37.1	177.7	-63.9	0	0	0	0	111.7	E75 E76 K77 N81 V82 F83 L108	E75-C79 HydrophobicContact CB-CB 4.05Å; E76-C79 WeakPolarHBondContact O-CA 3.32Å; E76-C79 WeakPolarHBondContact O-CB 3.41Å; E76-C79 PolarHBondContact O-N 2.82Å; K77-C79 VanDerWaalsContact C-N 3.33Å; K77-C79 PolarHBondContact O-N 3.46Å; C79-N81 VanDerWaalsContact C-N 3.26Å; C79-N81 PolarHBondContact O-N 3.39Å; C79-V82 WeakPolarHBondContact O-CG2 3.35Å; C79-V82 PolarHBondContact O-N 3Å; C79-F83 PolarHBondContact O-N 3.03Å; C79-L108 HydrophobicContact CB-CD1 4.4Å; C79-L108 HydrophobicContact CB-CD2 3.98Å; C79-L108 HydrophobicContact CB-CG 4.08Å
80	V	98.2	Very high	95.8	Very high	14 Å²	14	52.5 Å²	52.5	9%	0.085	26%	0.259	C	S	.	.	H	α-helix	trans	-54	-46.4	172.7	178.8	0	0	0	0	110.3	V36 D37 E75 E76 K77 V82 F83	V36-V80 HydrophobicContact CG1-CG1 4.47Å; V36-V80 HydrophobicContact CG1-CG2 4.13Å; D37-V80 HydrophobicContact CB-CG1 3.86Å; D37-V80 HydrophobicContact CB-CG2 4.16Å; E75-V80 HydrophobicContact CB-CG2 3.83Å; E76-V80 WeakPolarHBondContact O-CG2 3.48Å; E76-V80 PolarHBondContact O-N 3.23Å; K77-V80 PolarHBondContact O-N 3.36Å; V80-V82 VanDerWaalsContact C-N 3.26Å; V80-V82 PolarHBondContact O-N 3.45Å; V80-F83 WeakPolarHBondContact O-CB 3.38Å; V80-F83 PolarHBondContact O-N 3.45Å
81	N	96.5	Very high	96.1	Very high	122 Å²	122	48.2 Å²	48.2	65%	0.652	24%	0.239	S	C	*	.	H	α-helix	trans	-61.7	-30.1	-177.7	-66.6	-22.5	0	0	0	113.9	K77 C79	K77-N81 VanDerWaalsContact O-CG 3.3Å; K77-N81 PolarHBondContact O-N 3.31Å; K77-N81 PolarHBondContact O-ND2 2.78Å; C79-N81 VanDerWaalsContact C-N 3.26Å; C79-N81 PolarHBondContact O-N 3.39Å
82	V	97.5	Very high	96.1	Very high	6 Å²	6	48.6 Å²	48.6	4%	0.036	24%	0.241	C	C	.	.	H	α-helix	trans	-103.5	-2.3	-178.7	-59.5	0	0	0	0	113.2	C79 V80 A84 V85 F86 D101 P104 V105 L108	C79-V82 WeakPolarHBondContact O-CG2 3.35Å; C79-V82 PolarHBondContact O-N 3Å; V80-V82 VanDerWaalsContact C-N 3.26Å; V80-V82 PolarHBondContact O-N 3.45Å; V82-A84 VanDerWaalsContact C-N 3.27Å; V82-A84 PolarHBondContact O-N 3.27Å; V82-V85 PolarHBondContact O-N 3.41Å; V82-F86 PolarHBondContact O-N 2.89Å; V82-D101 HydrophobicContact CG1-CB 4.02Å; V82-P104 HydrophobicContact CB-CB 4.47Å; V82-P104 HydrophobicContact CG1-CB 4.17Å; V82-P104 HydrophobicContact CG2-CB 3.48Å; V82-P104 VanDerWaalsContact CG2-CB 3.48Å; V82-V105 HydrophobicContact CB-CG2 3.81Å; V82-V105 HydrophobicContact CG1-CG2 4.3Å; V82-V105 HydrophobicContact CG2-CG2 3.86Å; V82-L108 HydrophobicContact CG2-CD1 3.76Å
83	F	98.4	Very high	96.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-38.3	-173.4	-169.2	-89.4	0	0	0	112.4	L34 V36 F41 L73 E75 C79 V80 V85 F86 L87 L108 Y112	L34-F83 HydrophobicContact CD1-CE1 4.23Å; L34-F83 HydrophobicContact CD1-CZ 4.08Å; V36-F83 HydrophobicContact CB-CD1 4.42Å; V36-F83 HydrophobicContact CB-CG 4.43Å; V36-F83 HydrophobicContact CG1-CD2 4.29Å; V36-F83 HydrophobicContact CG1-CG 4.26Å; V36-F83 HydrophobicContact CG2-CD1 3.66Å; V36-F83 HydrophobicContact CG2-CD2 4.08Å; V36-F83 HydrophobicContact CG2-CE1 3.54Å; V36-F83 HydrophobicContact CG2-CE2 3.97Å; V36-F83 HydrophobicContact CG2-CG 3.93Å; V36-F83 HydrophobicContact CG2-CZ 3.71Å; F41-F83 AromaticContact CD2-CD1 3.75Å; F41-F83 HydrophobicContact CD2-CD1 3.75Å; F41-F83 AromaticContact CD2-CE1 3.91Å; F41-F83 HydrophobicContact CD2-CE1 3.91Å; F41-F83 AromaticContact CE2-CD1 3.56Å; F41-F83 HydrophobicContact CE2-CD1 3.56Å; F41-F83 HydrophobicContact CE2-CE1 4.19Å; F41-F83 HydrophobicContact CE2-CG 4.45Å; F41-F83 HydrophobicContact CG-CD1 4.41Å; F41-F83 HydrophobicContact CG-CE1 4.45Å; F41-F83 HydrophobicContact CZ-CD1 4.08Å; L73-F83 HydrophobicContact CD1-CE2 3.9Å; L73-F83 HydrophobicContact CD1-CZ 3.53Å; E75-F83 HydrophobicContact CG-CD2 4.43Å; C79-F83 PolarHBondContact O-N 3.03Å; V80-F83 WeakPolarHBondContact O-CB 3.38Å; V80-F83 PolarHBondContact O-N 3.45Å; F83-V85 VanDerWaalsContact C-N 3.3Å; F83-V85 PolarHBondContact O-N 3.42Å; F83-F86 HydrophobicContact CD2-CD1 4.3Å; F83-F86 HydrophobicContact CE2-CD1 4.15Å; F83-F86 HydrophobicContact CE2-CE1 4.31Å; F83-F86 HydrophobicContact CZ-CD1 4.5Å; F83-F86 PolarHBondContact O-N 3.34Å; F83-L87 HydrophobicContact CD1-CB 4.47Å; F83-L87 HydrophobicContact CE1-CB 4.27Å; F83-L87 HydrophobicContact CE1-CD2 4.26Å; F83-L87 VanDerWaalsContact O-CB 3.32Å; F83-L87 WeakPolarHBondContact O-CB 3.35Å; F83-L87 PolarHBondContact O-N 2.9Å; F83-L108 HydrophobicContact CD2-CD1 4.2Å; F83-L108 HydrophobicContact CD2-CD2 4.02Å; F83-L108 HydrophobicContact CE2-CD2 4.45Å; F83-Y112 HydrophobicContact CE2-CE2 4.1Å
84	A	97	Very high	95.9	Very high	37 Å²	37	49 Å²	49	31%	0.306	25%	0.245	S	C	.	.	H	α-helix	trans	-60.3	-40.4	176.4	0	0	0	0	0	112.3	F24 F41 V82 R88	F24-A84 VanDerWaalsContact CZ-O 3.32Å; F24-A84 WeakPolarHBondContact CZ-O 3.25Å; F41-A84 HydrophobicContact CE1-CB 3.69Å; F41-A84 HydrophobicContact CZ-CB 4.12Å; V82-A84 VanDerWaalsContact C-N 3.27Å; V82-A84 PolarHBondContact O-N 3.27Å; A84-R88 WeakPolarHBondContact O-CB 3.3Å; A84-R88 PolarHBondContact O-N 3.45Å
85	V	96.3	Very high	95.9	Very high	52 Å²	52	43.3 Å²	43.3	32%	0.315	22%	0.216	S	C	.	.	H	α-helix	trans	-73.4	-41.1	-180	-177	0	0	0	0	110.6	V82 F83 R88 F89 I95	V82-V85 PolarHBondContact O-N 3.41Å; F83-V85 VanDerWaalsContact C-N 3.3Å; F83-V85 PolarHBondContact O-N 3.42Å; V85-R88 PolarHBondContact O-N 2.57Å; V85-F89 PolarHBondContact O-N 2.79Å; V85-I95 HydrophobicContact CG1-CD1 3.62Å; V85-I95 HydrophobicContact CG1-CG1 3.56Å
86	F	98.3	Very high	95.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.7	-49.8	170.5	163.1	-95.3	0	0	0	111.5	F55 V82 F83 R88 F89 L90 L108 Y112 V114 L117	F55-F86 AromaticContact CE2-CE1 3.97Å; F55-F86 HydrophobicContact CE2-CE1 3.97Å; F55-F86 HydrophobicContact CE2-CZ 4.15Å; F55-F86 HydrophobicContact CZ-CE1 4.22Å; V82-F86 PolarHBondContact O-N 2.89Å; F83-F86 HydrophobicContact CD2-CD1 4.3Å; F83-F86 HydrophobicContact CE2-CD1 4.15Å; F83-F86 HydrophobicContact CE2-CE1 4.31Å; F83-F86 HydrophobicContact CZ-CD1 4.5Å; F83-F86 PolarHBondContact O-N 3.34Å; F86-R88 PolarHBondContact O-N 3.06Å; F86-F89 WeakPolarHBondContact O-CB 3.31Å; F86-F89 PolarHBondContact O-N 2.98Å; F86-L90 HydrophobicContact CE1-CD1 4.27Å; F86-L90 HydrophobicContact CZ-CD1 4.35Å; F86-L90 HydrophobicContact CZ-CD2 4.43Å; F86-L108 HydrophobicContact CB-CB 4.41Å; F86-L108 HydrophobicContact CB-CD1 3.63Å; F86-L108 HydrophobicContact CD1-CB 4.42Å; F86-L108 HydrophobicContact CD1-CD1 4.27Å; F86-L108 HydrophobicContact CD2-CB 3.58Å; F86-L108 HydrophobicContact CD2-CD1 4.36Å; F86-L108 HydrophobicContact CE2-CB 3.94Å; F86-L108 HydrophobicContact CG-CB 3.88Å; F86-L108 HydrophobicContact CG-CD1 3.83Å; F86-L108 HydrophobicContact CG-CG 4.46Å; F86-L108 HydrophobicContact CZ-CB 4.5Å; F86-Y112 AromaticContact CE1-CD2 3.87Å; F86-Y112 HydrophobicContact CE1-CD2 3.87Å; F86-Y112 HydrophobicContact CE1-CE2 4.47Å; F86-Y112 HydrophobicContact CE1-CG 4.37Å; F86-Y112 HydrophobicContact CE2-CD2 4.44Å; F86-Y112 AromaticContact CZ-CD2 3.68Å; F86-Y112 HydrophobicContact CZ-CD2 3.68Å; F86-Y112 AromaticContact CZ-CG 3.96Å; F86-Y112 HydrophobicContact CZ-CG 3.96Å; F86-V114 HydrophobicContact CE2-CG2 3.84Å; F86-V114 HydrophobicContact CZ-CG2 3.95Å; F86-L117 HydrophobicContact CD2-CD2 3.47Å; F86-L117 VanDerWaalsContact CD2-CD2 3.47Å; F86-L117 HydrophobicContact CE2-CD2 3.94Å
87	L	97.7	Very high	95.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-40.4	-179.5	-180	61.2	0	0	0	111.3	F24 L34 F41 L48 F83 F89 L90 Y91	F24-L87 HydrophobicContact CD2-CG 4.26Å; F24-L87 HydrophobicContact CE2-CB 4.03Å; F24-L87 HydrophobicContact CE2-CD2 4Å; F24-L87 HydrophobicContact CE2-CG 3.81Å; L34-L87 HydrophobicContact CD1-CD1 4.27Å; F41-L87 HydrophobicContact CB-CD2 3.56Å; F41-L87 HydrophobicContact CD1-CD2 4.12Å; F41-L87 HydrophobicContact CG-CD2 3.93Å; L48-L87 HydrophobicContact CD2-CD1 3.63Å; F83-L87 HydrophobicContact CD1-CB 4.47Å; F83-L87 HydrophobicContact CE1-CB 4.27Å; F83-L87 HydrophobicContact CE1-CD2 4.26Å; F83-L87 VanDerWaalsContact O-CB 3.32Å; F83-L87 WeakPolarHBondContact O-CB 3.35Å; F83-L87 PolarHBondContact O-N 2.9Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 3.23Å; L87-L90 HydrophobicContact CD1-CD1 4.12Å; L87-L90 WeakPolarHBondContact O-CB 3.24Å; L87-L90 PolarHBondContact O-N 3.35Å; L87-L90 VanDerWaalsContact O-N 3.14Å; L87-Y91 HydrophobicContact CD1-CE2 4.22Å; L87-Y91 HydrophobicContact CG-CE2 4.41Å; L87-Y91 WeakPolarHBondContact O-CD2 3.27Å
88	R	96	Very high	95.5	Very high	59 Å²	59	43.3 Å²	43.3	22%	0.223	21%	0.211	C	C	.	.	H	α-helix	trans	-58.8	-40.1	175	-179.6	175.1	167	-96.8	-0.2	111.8	E21 F24 A84 V85 F86 L90 Y91 C92	E21-R88 IonicContact OE1-CZ 3.09Å; E21-R88 IonicContact OE1-NE 3.35Å; E21-R88 PolarHBondContact OE1-NE 3.44Å; E21-R88 IonicContact OE1-NH2 2.75Å; E21-R88 PolarHBondContact OE1-NH2 2.5Å; E21-R88 IonicContact OE2-NH2 2.63Å; E21-R88 PolarHBondContact OE2-NH2 2.68Å; F24-R88 HydrophobicContact CD1-CB 4.23Å; F24-R88 HydrophobicContact CD1-CG 4.22Å; F24-R88 HydrophobicContact CD2-CB 4.01Å; F24-R88 HydrophobicContact CE1-CB 4.05Å; F24-R88 HydrophobicContact CE1-CG 4.39Å; F24-R88 HydrophobicContact CE2-CB 3.82Å; F24-R88 HydrophobicContact CG-CB 4.21Å; F24-R88 HydrophobicContact CG-CG 4.32Å; F24-R88 HydrophobicContact CZ-CB 3.84Å; A84-R88 WeakPolarHBondContact O-CB 3.3Å; A84-R88 PolarHBondContact O-N 3.45Å; V85-R88 PolarHBondContact O-N 2.57Å; F86-R88 PolarHBondContact O-N 3.06Å; R88-L90 PolarHBondContact O-N 3.19Å; R88-Y91 PolarHBondContact O-N 2.73Å; R88-C92 PolarHBondContact O-N 3.3Å
89	F	96	Very high	95.3	Very high	6 Å²	6	43.1 Å²	43.1	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-35.4	177	179.2	-88.6	0	0	0	112.3	V85 F86 L87 Y91 C92 N93 I95 V114 H116 L117	V85-F89 PolarHBondContact O-N 2.79Å; F86-F89 WeakPolarHBondContact O-CB 3.31Å; F86-F89 PolarHBondContact O-N 2.98Å; L87-F89 VanDerWaalsContact C-N 3.29Å; L87-F89 PolarHBondContact O-N 3.23Å; F89-Y91 PolarHBondContact O-N 2.96Å; F89-Y91 VanDerWaalsContact O-N 3.16Å; F89-C92 PolarHBondContact O-N 3.24Å; F89-N93 VanDerWaalsContact CE2-C 3.4Å; F89-N93 HydrophobicContact CE2-CB 4.47Å; F89-N93 VanDerWaalsContact CE2-O 3.27Å; F89-N93 WeakPolarHBondContact CE2-O 3.18Å; F89-N93 HydrophobicContact CZ-CB 4.42Å; F89-N93 WeakPolarHBondContact O-CA 3.33Å; F89-N93 PolarHBondContact O-N 3.29Å; F89-I95 HydrophobicContact CD2-CB 3.8Å; F89-I95 HydrophobicContact CD2-CG2 3.83Å; F89-I95 HydrophobicContact CE2-CG2 4.13Å; F89-V114 HydrophobicContact CE1-CG1 4.38Å; F89-H116 HydrophobicContact CZ-CB 4.45Å; F89-L117 HydrophobicContact CB-CD2 4.39Å; F89-L117 HydrophobicContact CD1-CB 3.83Å; F89-L117 HydrophobicContact CD1-CD1 4.06Å; F89-L117 HydrophobicContact CD1-CD2 3.95Å; F89-L117 HydrophobicContact CD1-CG 4.17Å; F89-L117 HydrophobicContact CD2-CD1 3.86Å; F89-L117 HydrophobicContact CE1-CB 3.55Å; F89-L117 HydrophobicContact CE1-CD1 4.2Å; F89-L117 HydrophobicContact CE1-CG 4.3Å; F89-L117 HydrophobicContact CE2-CD1 3.95Å; F89-L117 HydrophobicContact CG-CD1 3.9Å; F89-L117 HydrophobicContact CG-CD2 4.18Å; F89-L117 HydrophobicContact CG-CG 4.43Å; F89-L117 HydrophobicContact CZ-CB 4Å; F89-L117 HydrophobicContact CZ-CD1 4.12Å
90	L	96.1	Very high	95	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-63.8	-21.5	179.6	-51.2	-173.8	0	0	0	113.4	V47 L48 N51 F55 F86 L87 R88 V114	V47-L90 HydrophobicContact CG1-CB 4.3Å; V47-L90 WeakPolarHBondContact CG1-O 3.33Å; L48-L90 HydrophobicContact CD2-CD1 3.8Å; N51-L90 HydrophobicContact CB-CB 4.39Å; N51-L90 HydrophobicContact CB-CD2 3.9Å; N51-L90 PolarHBondContact ND2-O 3.23Å; F55-L90 HydrophobicContact CD2-CD1 4.43Å; F55-L90 HydrophobicContact CE2-CD1 4.12Å; F86-L90 HydrophobicContact CE1-CD1 4.27Å; F86-L90 HydrophobicContact CZ-CD1 4.35Å; F86-L90 HydrophobicContact CZ-CD2 4.43Å; L87-L90 HydrophobicContact CD1-CD1 4.12Å; L87-L90 WeakPolarHBondContact O-CB 3.24Å; L87-L90 PolarHBondContact O-N 3.35Å; L87-L90 VanDerWaalsContact O-N 3.14Å; R88-L90 PolarHBondContact O-N 3.19Å; L90-V114 HydrophobicContact CD2-CG1 3.86Å; L90-V114 HydrophobicContact CD2-CG2 4.04Å
91	Y	94.2	Very high	94.8	Very high	5 Å²	5	50 Å²	50	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-88.7	-39.3	178.7	-73.1	-98.4	0	0	0	112.7	F20 F23 F24 A43 H44 V47 L87 R88 F89	F20-Y91 WeakPolarHBondContact CB-O 3.43Å; F20-Y91 WeakPolarHBondContact O-CD1 3.4Å; F23-Y91 HydrophobicContact CB-CD1 4.38Å; F23-Y91 HydrophobicContact CB-CE1 4.21Å; F24-Y91 HydrophobicContact CB-CD2 4.19Å; F24-Y91 HydrophobicContact CB-CG 4.15Å; F24-Y91 AromaticContact CD2-CD2 4Å; F24-Y91 HydrophobicContact CD2-CD2 4Å; F24-Y91 HydrophobicContact CD2-CE2 4.13Å; A43-Y91 WeakPolarHBondContact CA-OH 3.36Å; H44-Y91 PolarHBondContact N-OH 3.07Å; H44-Y91 VanDerWaalsContact N-OH 3.1Å; H44-Y91 AromaticContact ND1-CE1 3.44Å; H44-Y91 WeakPolarHBondContact ND1-CE1 3.48Å; H44-Y91 AromaticContact ND1-CZ 3.58Å; H44-Y91 PolarHBondContact ND1-OH 3.27Å; V47-Y91 HydrophobicContact CB-CE1 4.18Å; V47-Y91 HydrophobicContact CG1-CD1 4.01Å; V47-Y91 HydrophobicContact CG1-CD2 4.07Å; V47-Y91 HydrophobicContact CG1-CE1 3.94Å; V47-Y91 HydrophobicContact CG1-CE2 3.99Å; V47-Y91 HydrophobicContact CG1-CG 4.07Å; V47-Y91 HydrophobicContact CG2-CD1 4.27Å; V47-Y91 HydrophobicContact CG2-CE1 3.89Å; L87-Y91 HydrophobicContact CD1-CE2 4.22Å; L87-Y91 HydrophobicContact CG-CE2 4.41Å; L87-Y91 WeakPolarHBondContact O-CD2 3.27Å; R88-Y91 PolarHBondContact O-N 2.73Å; F89-Y91 PolarHBondContact O-N 2.96Å; F89-Y91 VanDerWaalsContact O-N 3.16Å
92	C	91.7	Very high	94.7	Very high	15 Å²	15	44.2 Å²	44.2	10%	0.101	22%	0.216	C	C	.	.	H	α-helix	trans	-127.4	2	-168.1	64.7	0	0	0	0	115.6	E21 R88 F89 H94	E21-C92 HydrophobicContact CB-CB 3.99Å; E21-C92 HydrophobicContact CG-CB 4.35Å; R88-C92 PolarHBondContact O-N 3.3Å; F89-C92 PolarHBondContact O-N 3.24Å; C92-H94 PolarHBondContact O-N 3.45Å
93	N	90.9	Very high	94.7	Very high	67 Å²	67	45.1 Å²	45.1	36%	0.358	22%	0.221	S	C	.	.	S	Bend	trans	53	19.7	-175.6	-74.2	-15.9	0	0	0	114.4	F89	F89-N93 VanDerWaalsContact CE2-C 3.4Å; F89-N93 HydrophobicContact CE2-CB 4.47Å; F89-N93 VanDerWaalsContact CE2-O 3.27Å; F89-N93 WeakPolarHBondContact CE2-O 3.18Å; F89-N93 HydrophobicContact CZ-CB 4.42Å; F89-N93 WeakPolarHBondContact O-CA 3.33Å; F89-N93 PolarHBondContact O-N 3.29Å
94	H	91.9	Very high	94.7	Very high	103 Å²	103	45.4 Å²	45.4	48%	0.477	22%	0.222	S	C	.	.			trans	-110.1	131.6	177	179.3	127.4	0	0	0	109.5	C92	C92-H94 PolarHBondContact O-N 3.45Å
95	I	94.5	Very high	94.8	Very high	26 Å²	26	43.6 Å²	43.6	13%	0.133	21%	0.208	C	C	.	.			trans	-139.4	138.7	168.5	-171.1	159.6	0	0	0	111.1	V85 F89 L97 V105 L117 V120	V85-I95 HydrophobicContact CG1-CD1 3.62Å; V85-I95 HydrophobicContact CG1-CG1 3.56Å; F89-I95 HydrophobicContact CD2-CB 3.8Å; F89-I95 HydrophobicContact CD2-CG2 3.83Å; F89-I95 HydrophobicContact CE2-CG2 4.13Å; I95-L97 HydrophobicContact CD1-CD2 3.55Å; I95-L97 HydrophobicContact CD1-CG 4.26Å; I95-L97 HydrophobicContact CG1-CD2 3.77Å; I95-L97 HydrophobicContact CG1-CG 4.03Å; I95-L97 HydrophobicContact CG2-CD1 4.39Å; I95-L97 HydrophobicContact CG2-CG 4.13Å; I95-V105 HydrophobicContact CD1-CG1 3.67Å; I95-V105 HydrophobicContact CD1-CG2 4.19Å; I95-L117 HydrophobicContact CD1-CD1 3.99Å; I95-L117 HydrophobicContact CG2-CD1 3.93Å; I95-V120 HydrophobicContact CG2-CG1 4.15Å
96	F	94	Very high	94.9	Very high	149 Å²	149	41.1 Å²	41.1	65%	0.654	19%	0.193	S	C	*	.			trans	-101.8	109.6	168.5	-178.3	-93.1	0	0	0	107.8	R98	F96-R98 HydrophobicContact CD1-CG 4.35Å; F96-R98 HydrophobicContact CE1-CG 3.87Å
97	L	94.3	Very high	94.9	Very high	19 Å²	19	42.6 Å²	42.6	10%	0.099	20%	0.2	C	C	.	.			trans	-98.7	126.3	-177.7	-68.1	174.4	0	0	0	110.7	I95 V105 V120 F124	I95-L97 HydrophobicContact CD1-CD2 3.55Å; I95-L97 HydrophobicContact CD1-CG 4.26Å; I95-L97 HydrophobicContact CG1-CD2 3.77Å; I95-L97 HydrophobicContact CG1-CG 4.03Å; I95-L97 HydrophobicContact CG2-CD1 4.39Å; I95-L97 HydrophobicContact CG2-CG 4.13Å; L97-V105 HydrophobicContact CD2-CB 4.06Å; L97-V105 HydrophobicContact CD2-CG1 4.11Å; L97-V105 HydrophobicContact CD2-CG2 3.97Å; L97-V120 HydrophobicContact CD1-CG1 4.38Å; L97-F124 HydrophobicContact CB-CD1 3.84Å; L97-F124 HydrophobicContact CB-CE1 3.69Å; L97-F124 HydrophobicContact CB-CG 4.44Å; L97-F124 HydrophobicContact CB-CZ 4.19Å; L97-F124 HydrophobicContact CD1-CB 4.24Å; L97-F124 HydrophobicContact CD1-CD1 3.95Å; L97-F124 HydrophobicContact CD1-CG 4.22Å; L97-F124 WeakPolarHBondContact O-CZ 3.27Å
98	R	92.2	Very high	94.9	Very high	149 Å²	149	42.6 Å²	42.6	56%	0.562	20%	0.2	S	C	*	.			trans	-93.4	165.3	162.2	-56.9	171.6	-65.7	171.1	7.6	109.4	F96 D100 D101 A102	F96-R98 HydrophobicContact CD1-CG 4.35Å; F96-R98 HydrophobicContact CE1-CG 3.87Å; R98-D100 VanDerWaalsContact C-N 3.28Å; R98-D100 PolarHBondContact O-N 2.94Å; R98-D101 VanDerWaalsContact CB-OD2 3.29Å; R98-D101 WeakPolarHBondContact CB-OD2 3.38Å; R98-D101 WeakPolarHBondContact CG-OD2 3.29Å; R98-D101 IonicContact CZ-OD1 2.62Å; R98-D101 IonicContact CZ-OD2 3.68Å; R98-D101 PolarHBondContact N-OD2 2.95Å; R98-D101 IonicContact NE-OD1 2.67Å; R98-D101 IonicContact NE-OD2 3.66Å; R98-D101 PolarHBondContact NE-OD2 2.88Å; R98-D101 IonicContact NH2-OD1 3.76Å; R98-D101 PolarHBondContact NH2-OD1 3.43Å; R98-D101 IonicContact NH2-OD2 3.03Å; R98-D101 PolarHBondContact NH2-OD2 3.25Å; R98-D101 PolarHBondContact O-N 3.5Å; R98-D101 VanDerWaalsContact O-N 3.1Å; R98-A102 PolarHBondContact O-N 2.94Å
99	M	91.1	Very high	95.1	Very high	72 Å²	72	39.8 Å²	39.8	36%	0.355	19%	0.19	S	C	.	.	H	α-helix	trans	-52.7	-47.5	178.4	-67.3	-111.2	-74.2	0	0	111.7	D101 A102 I129 Q132 L133	M99-D101 VanDerWaalsContact C-N 3.29Å; M99-D101 PolarHBondContact O-N 3.35Å; M99-A102 PolarHBondContact O-N 2.99Å; M99-I129 HydrophobicContact SD-CB 4.12Å; M99-I129 HydrophobicContact SD-CG1 3.9Å; M99-I129 HydrophobicContact SD-CG2 3.94Å; M99-Q132 HydrophobicContact CE-CB 4.03Å; M99-Q132 HydrophobicContact SD-CB 4.49Å; M99-L133 HydrophobicContact CE-CD2 4.38Å
100	D	91.4	Very high	95.2	Very high	141 Å²	141	41.2 Å²	41.2	75%	0.754	20%	0.197	S	C	*	.	H	α-helix	trans	-71	-21.9	-177.9	-57.1	-23.6	0	0	0	113.7	R98 P104	R98-D100 VanDerWaalsContact C-N 3.28Å; R98-D100 PolarHBondContact O-N 2.94Å; D100-P104 WeakPolarHBondContact O-CD 3.48Å
101	D	93.9	Very high	95.3	Very high	18 Å²	18	45.5 Å²	45.5	10%	0.096	22%	0.216	C	C	.	.	H	α-helix	trans	-84.9	-22.9	179.9	-55.4	-39.8	0	0	0	111.9	V82 R98 M99 L103 P104 V105	V82-D101 HydrophobicContact CG1-CB 4.02Å; R98-D101 VanDerWaalsContact CB-OD2 3.29Å; R98-D101 WeakPolarHBondContact CB-OD2 3.38Å; R98-D101 WeakPolarHBondContact CG-OD2 3.29Å; R98-D101 IonicContact CZ-OD1 2.62Å; R98-D101 IonicContact CZ-OD2 3.68Å; R98-D101 PolarHBondContact N-OD2 2.95Å; R98-D101 IonicContact NE-OD1 2.67Å; R98-D101 IonicContact NE-OD2 3.66Å; R98-D101 PolarHBondContact NE-OD2 2.88Å; R98-D101 IonicContact NH2-OD1 3.76Å; R98-D101 PolarHBondContact NH2-OD1 3.43Å; R98-D101 IonicContact NH2-OD2 3.03Å; R98-D101 PolarHBondContact NH2-OD2 3.25Å; R98-D101 PolarHBondContact O-N 3.5Å; R98-D101 VanDerWaalsContact O-N 3.1Å; M99-D101 VanDerWaalsContact C-N 3.29Å; M99-D101 PolarHBondContact O-N 3.35Å; D101-L103 PolarHBondContact O-N 2.78Å; D101-P104 WeakPolarHBondContact O-CD 3.44Å; D101-V105 HydrophobicContact CB-CG2 4.39Å; D101-V105 WeakPolarHBondContact O-CB 3.29Å; D101-V105 WeakPolarHBondContact O-CG2 3.41Å; D101-V105 PolarHBondContact O-N 3.07Å
102	A	95.5	Very high	95.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.9	-46.8	-165.7	0	0	0	0	0	113.6	R98 M99 L106 F124 I129 W142	R98-A102 PolarHBondContact O-N 2.94Å; M99-A102 PolarHBondContact O-N 2.99Å; A102-L106 VanDerWaalsContact O-CB 3.28Å; A102-L106 WeakPolarHBondContact O-CB 3.49Å; A102-L106 PolarHBondContact O-N 3.21Å; A102-F124 HydrophobicContact CB-CD1 4.21Å; A102-F124 HydrophobicContact CB-CE1 4.32Å; A102-I129 HydrophobicContact CB-CD1 3.14Å; A102-W142 HydrophobicContact CB-CH2 4.09Å; A102-W142 HydrophobicContact CB-CZ2 4.45Å
103	L	97.3	Very high	95.8	Very high	25 Å²	25	47.2 Å²	47.2	13%	0.131	22%	0.224	C	C	.	.	H	α-helix	trans	-67.6	-50.3	177.9	175.1	70.8	0	0	0	111.6	D101 V105 L106 I107 V141 W142 Y145	D101-L103 PolarHBondContact O-N 2.78Å; L103-V105 VanDerWaalsContact C-N 3.3Å; L103-V105 PolarHBondContact O-N 3.13Å; L103-L106 WeakPolarHBondContact O-CB 3.3Å; L103-L106 PolarHBondContact O-N 3.37Å; L103-L106 VanDerWaalsContact O-N 3.12Å; L103-I107 HydrophobicContact CD1-CD1 4.2Å; L103-I107 HydrophobicContact CD1-CG1 4.26Å; L103-I107 HydrophobicContact CG-CD1 3.9Å; L103-I107 HydrophobicContact CG-CG1 4.4Å; L103-I107 WeakPolarHBondContact O-CG1 3.36Å; L103-I107 PolarHBondContact O-N 2.93Å; L103-V141 HydrophobicContact CD2-CG1 3.43Å; L103-V141 VanDerWaalsContact CD2-CG1 3.43Å; L103-W142 HydrophobicContact CB-CH2 3.68Å; L103-W142 HydrophobicContact CB-CZ2 3.89Å; L103-W142 HydrophobicContact CB-CZ3 4.23Å; L103-W142 HydrophobicContact CD1-CE3 4.35Å; L103-W142 HydrophobicContact CD1-CH2 4.36Å; L103-W142 HydrophobicContact CD1-CZ3 4.04Å; L103-Y145 HydrophobicContact CD1-CD1 3.98Å; L103-Y145 HydrophobicContact CD1-CD2 4Å; L103-Y145 HydrophobicContact CD1-CE1 4.35Å; L103-Y145 HydrophobicContact CD1-CE2 4.36Å; L103-Y145 HydrophobicContact CD1-CG 3.8Å
104	P	98.3	Very high	96.1	Very high	6 Å²	6	44.1 Å²	44.1	4%	0.039	21%	0.208	C	C	.	.	H	α-helix	trans	-56.5	-40.1	176.2	-29.3	37.3	0	0	0	113.9	Q78 V82 D100 D101 I107 L108	Q78-P104 HydrophobicContact CB-CB 4.35Å; Q78-P104 HydrophobicContact CB-CG 3.85Å; Q78-P104 HydrophobicContact CG-CB 4.32Å; Q78-P104 HydrophobicContact CG-CG 4.01Å; V82-P104 HydrophobicContact CB-CB 4.47Å; V82-P104 HydrophobicContact CG1-CB 4.17Å; V82-P104 HydrophobicContact CG2-CB 3.48Å; V82-P104 VanDerWaalsContact CG2-CB 3.48Å; D100-P104 WeakPolarHBondContact O-CD 3.48Å; D101-P104 WeakPolarHBondContact O-CD 3.44Å; P104-I107 PolarHBondContact O-N 2.8Å; P104-L108 WeakPolarHBondContact O-CG 3.39Å; P104-L108 PolarHBondContact O-N 3.17Å
105	V	98.6	Very high	96.3	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69	-39.3	176.5	176.9	0	0	0	0	111.2	V82 I95 L97 D101 L103 I107 L108 A109 L117 C121	V82-V105 HydrophobicContact CB-CG2 3.81Å; V82-V105 HydrophobicContact CG1-CG2 4.3Å; V82-V105 HydrophobicContact CG2-CG2 3.86Å; I95-V105 HydrophobicContact CD1-CG1 3.67Å; I95-V105 HydrophobicContact CD1-CG2 4.19Å; L97-V105 HydrophobicContact CD2-CB 4.06Å; L97-V105 HydrophobicContact CD2-CG1 4.11Å; L97-V105 HydrophobicContact CD2-CG2 3.97Å; D101-V105 HydrophobicContact CB-CG2 4.39Å; D101-V105 WeakPolarHBondContact O-CB 3.29Å; D101-V105 WeakPolarHBondContact O-CG2 3.41Å; D101-V105 PolarHBondContact O-N 3.07Å; L103-V105 VanDerWaalsContact C-N 3.3Å; L103-V105 PolarHBondContact O-N 3.13Å; V105-I107 VanDerWaalsContact C-N 3.34Å; V105-L108 PolarHBondContact O-N 3.1Å; V105-A109 WeakPolarHBondContact O-CB 3.25Å; V105-A109 PolarHBondContact O-N 3.38Å; V105-L117 HydrophobicContact CG1-CD1 3.97Å; V105-L117 HydrophobicContact CG1-CD2 3.82Å; V105-L117 HydrophobicContact CG1-CG 4.01Å; V105-C121 VanDerWaalsContact CG1-SG 3.58Å
106	L	98.6	Very high	96.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-42.4	173.9	180	59.6	0	0	0	111.4	A102 L103 L108 A109 D110 R118 C121 L122 W142 Y145	A102-L106 VanDerWaalsContact O-CB 3.28Å; A102-L106 WeakPolarHBondContact O-CB 3.49Å; A102-L106 PolarHBondContact O-N 3.21Å; L103-L106 WeakPolarHBondContact O-CB 3.3Å; L103-L106 PolarHBondContact O-N 3.37Å; L103-L106 VanDerWaalsContact O-N 3.12Å; L106-L108 VanDerWaalsContact C-N 3.34Å; L106-L108 PolarHBondContact O-N 3.46Å; L106-A109 PolarHBondContact O-N 2.88Å; L106-D110 PolarHBondContact O-N 3.38Å; L106-R118 HydrophobicContact CD1-CB 4.41Å; L106-R118 HydrophobicContact CD1-CG 3.91Å; L106-C121 HydrophobicContact CB-CB 3.94Å; L106-C121 HydrophobicContact CD1-CB 3.9Å; L106-C121 HydrophobicContact CG-CB 4.42Å; L106-L122 HydrophobicContact CD1-CD2 4.11Å; L106-L122 HydrophobicContact CD1-CG 4.07Å; L106-L122 HydrophobicContact CD2-CD2 3.83Å; L106-W142 HydrophobicContact CD2-CZ3 3.97Å; L106-Y145 HydrophobicContact CD2-CD1 4.02Å; L106-Y145 HydrophobicContact CD2-CE1 3.55Å; L106-Y145 HydrophobicContact CG-CE1 3.77Å
107	I	98.6	Very high	96.5	Very high	31 Å²	31	39.8 Å²	39.8	16%	0.159	19%	0.194	C	C	.	.	H	α-helix	trans	-57.6	-47.1	174.9	-68.8	165.5	0	0	0	110.7	L103 P104 V105 D110 K111 Y145	L103-I107 HydrophobicContact CD1-CD1 4.2Å; L103-I107 HydrophobicContact CD1-CG1 4.26Å; L103-I107 HydrophobicContact CG-CD1 3.9Å; L103-I107 HydrophobicContact CG-CG1 4.4Å; L103-I107 WeakPolarHBondContact O-CG1 3.36Å; L103-I107 PolarHBondContact O-N 2.93Å; P104-I107 PolarHBondContact O-N 2.8Å; V105-I107 VanDerWaalsContact C-N 3.34Å; I107-D110 PolarHBondContact O-N 3.43Å; I107-K111 VanDerWaalsContact O-CB 3.25Å; I107-K111 WeakPolarHBondContact O-CB 3.32Å; I107-K111 PolarHBondContact O-N 2.85Å; I107-Y145 WeakPolarHBondContact CA-OH 3.37Å; I107-Y145 HydrophobicContact CD1-CE2 4.34Å; I107-Y145 HydrophobicContact CG1-CD2 4.39Å; I107-Y145 HydrophobicContact CG1-CE2 3.53Å
108	L	98.7	Very high	96.7	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-42.2	176.1	-69.7	173.7	0	0	0	111.8	E75 C79 V82 F83 F86 P104 V105 L106 D110 K111 Y112	E75-L108 HydrophobicContact CG-CD2 4.29Å; C79-L108 HydrophobicContact CB-CD1 4.4Å; C79-L108 HydrophobicContact CB-CD2 3.98Å; C79-L108 HydrophobicContact CB-CG 4.08Å; V82-L108 HydrophobicContact CG2-CD1 3.76Å; F83-L108 HydrophobicContact CD2-CD1 4.2Å; F83-L108 HydrophobicContact CD2-CD2 4.02Å; F83-L108 HydrophobicContact CE2-CD2 4.45Å; F86-L108 HydrophobicContact CB-CB 4.41Å; F86-L108 HydrophobicContact CB-CD1 3.63Å; F86-L108 HydrophobicContact CD1-CB 4.42Å; F86-L108 HydrophobicContact CD1-CD1 4.27Å; F86-L108 HydrophobicContact CD2-CB 3.58Å; F86-L108 HydrophobicContact CD2-CD1 4.36Å; F86-L108 HydrophobicContact CE2-CB 3.94Å; F86-L108 HydrophobicContact CG-CB 3.88Å; F86-L108 HydrophobicContact CG-CD1 3.83Å; F86-L108 HydrophobicContact CG-CG 4.46Å; F86-L108 HydrophobicContact CZ-CB 4.5Å; P104-L108 WeakPolarHBondContact O-CG 3.39Å; P104-L108 PolarHBondContact O-N 3.17Å; V105-L108 PolarHBondContact O-N 3.1Å; L106-L108 VanDerWaalsContact C-N 3.34Å; L106-L108 PolarHBondContact O-N 3.46Å; L108-D110 VanDerWaalsContact C-N 3.31Å; L108-D110 PolarHBondContact O-N 3.38Å; L108-K111 PolarHBondContact O-N 3.18Å; L108-Y112 HydrophobicContact CB-CD2 4.44Å; L108-Y112 HydrophobicContact CD2-CD2 4.16Å; L108-Y112 HydrophobicContact CD2-CE2 3.73Å; L108-Y112 WeakPolarHBondContact O-CB 3.28Å; L108-Y112 WeakPolarHBondContact O-CD2 3.28Å; L108-Y112 PolarHBondContact O-N 3.45Å
109	A	98.6	Very high	96.9	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-36.4	177.8	0	0	0	0	0	112.5	V105 L106 N113 V114 L117 R118	V105-A109 WeakPolarHBondContact O-CB 3.25Å; V105-A109 PolarHBondContact O-N 3.38Å; L106-A109 PolarHBondContact O-N 2.88Å; A109-N113 CarbonylContact O-C 3.56Å; A109-N113 VanDerWaalsContact O-CA 3.32Å; A109-N113 WeakPolarHBondContact O-CA 3.39Å; A109-N113 PolarHBondContact O-N 2.94Å; A109-N113 VanDerWaalsContact O-N 3.13Å; A109-V114 PolarHBondContact O-N 3.23Å; A109-L117 HydrophobicContact CB-CB 3.99Å; A109-L117 HydrophobicContact CB-CD2 4.1Å; A109-L117 HydrophobicContact CB-CG 3.89Å; A109-R118 HydrophobicContact CB-CB 4.06Å
110	D	98.5	Very high	97.2	Very high	35 Å²	35	40 Å²	40	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-71.5	-49.8	172.8	-77.2	-38.8	0	0	0	111.8	L106 I107 L108 Y112 N113 R118 Y145 H151	L106-D110 PolarHBondContact O-N 3.38Å; I107-D110 PolarHBondContact O-N 3.43Å; L108-D110 VanDerWaalsContact C-N 3.31Å; L108-D110 PolarHBondContact O-N 3.38Å; D110-Y112 VanDerWaalsContact C-N 3.33Å; D110-Y112 PolarHBondContact O-N 3.29Å; D110-N113 PolarHBondContact O-N 3.12Å; D110-R118 WeakPolarHBondContact OD1-CD 2.78Å; D110-R118 IonicContact OD1-NH1 2.76Å; D110-Y145 PolarHBondContact OD2-OH 3.42Å; D110-H151 VanDerWaalsContact CG-NE2 3.29Å; D110-H151 IonicContact OD1-CE1 3.39Å; D110-H151 PolarHBondContact OD1-CE1 2.86Å; D110-H151 IonicContact OD1-NE2 3.22Å; D110-H151 PolarHBondContact OD1-NE2 3.43Å; D110-H151 VanDerWaalsContact OD1-NE2 3.17Å; D110-H151 IonicContact OD2-CD2 3.33Å; D110-H151 IonicContact OD2-CE1 2.82Å; D110-H151 IonicContact OD2-NE2 3.72Å; D110-H151 PolarHBondContact OD2-NE2 3.38Å
111	K	98.1	Very high	97.5	Very high	95 Å²	95	33.2 Å²	33.2	41%	0.413	16%	0.163	S	C	.	.	H	α-helix	trans	-59.2	-42.8	-177.1	-175	-177.9	-172.4	-174.8	0	112.5	I74 E75 I107 L108	I74-K111 PolarHBondContact O-NZ 3.21Å; E75-K111 IonicContact OE1-NZ 3.37Å; E75-K111 PolarHBondContact OE1-NZ 3.07Å; E75-K111 IonicContact OE2-NZ 3.76Å; E75-K111 PolarHBondContact OE2-NZ 2.86Å; I107-K111 VanDerWaalsContact O-CB 3.25Å; I107-K111 WeakPolarHBondContact O-CB 3.32Å; I107-K111 PolarHBondContact O-N 2.85Å; L108-K111 PolarHBondContact O-N 3.18Å
112	Y	98.1	Very high	97.7	Very high	4 Å²	4	33.2 Å²	33.2	2%	0.016	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	8.7	178.8	-65.2	-69.2	0	0	0	112.9	S52 V54 F55 M58 L73 E75 F83 F86 L108 D110 V114	S52-Y112 VanDerWaalsContact CB-O 3.24Å; S52-Y112 WeakPolarHBondContact CB-O 3.35Å; S52-Y112 PolarHBondContact OG-O 3.07Å; V54-Y112 HydrophobicContact CG1-CD1 4.16Å; F55-Y112 HydrophobicContact CD1-CD1 4.01Å; F55-Y112 HydrophobicContact CD1-CE1 4.07Å; F55-Y112 HydrophobicContact CD2-CD1 4.16Å; F55-Y112 AromaticContact CE1-CD1 3.49Å; F55-Y112 HydrophobicContact CE1-CD1 3.49Å; F55-Y112 VanDerWaalsContact CE1-CD1 3.49Å; F55-Y112 AromaticContact CE1-CE1 3.28Å; F55-Y112 HydrophobicContact CE1-CE1 3.28Å; F55-Y112 HydrophobicContact CE1-CG 4.36Å; F55-Y112 AromaticContact CE2-CD1 3.65Å; F55-Y112 HydrophobicContact CE2-CD1 3.65Å; F55-Y112 HydrophobicContact CE2-CD2 4.46Å; F55-Y112 HydrophobicContact CE2-CE1 4.21Å; F55-Y112 AromaticContact CE2-CG 3.8Å; F55-Y112 HydrophobicContact CE2-CG 3.8Å; F55-Y112 HydrophobicContact CG-CD1 4.31Å; F55-Y112 AromaticContact CZ-CD1 3.28Å; F55-Y112 HydrophobicContact CZ-CD1 3.28Å; F55-Y112 HydrophobicContact CZ-CD2 4.14Å; F55-Y112 AromaticContact CZ-CE1 3.35Å; F55-Y112 HydrophobicContact CZ-CE1 3.35Å; F55-Y112 HydrophobicContact CZ-CE2 4.22Å; F55-Y112 AromaticContact CZ-CG 3.7Å; F55-Y112 HydrophobicContact CZ-CG 3.7Å; F55-Y112 AromaticContact CZ-CZ 3.85Å; M58-Y112 HydrophobicContact CE-CE1 4.39Å; L73-Y112 HydrophobicContact CD2-CE1 4.43Å; E75-Y112 WeakPolarHBondContact OE1-CE2 3.36Å; E75-Y112 VanDerWaalsContact OE1-CZ 3.28Å; E75-Y112 PolarHBondContact OE1-OH 2.96Å; F83-Y112 HydrophobicContact CE2-CE2 4.1Å; F86-Y112 AromaticContact CE1-CD2 3.87Å; F86-Y112 HydrophobicContact CE1-CD2 3.87Å; F86-Y112 HydrophobicContact CE1-CE2 4.47Å; F86-Y112 HydrophobicContact CE1-CG 4.37Å; F86-Y112 HydrophobicContact CE2-CD2 4.44Å; F86-Y112 AromaticContact CZ-CD2 3.68Å; F86-Y112 HydrophobicContact CZ-CD2 3.68Å; F86-Y112 AromaticContact CZ-CG 3.96Å; F86-Y112 HydrophobicContact CZ-CG 3.96Å; L108-Y112 HydrophobicContact CB-CD2 4.44Å; L108-Y112 HydrophobicContact CD2-CD2 4.16Å; L108-Y112 HydrophobicContact CD2-CE2 3.73Å; L108-Y112 WeakPolarHBondContact O-CB 3.28Å; L108-Y112 WeakPolarHBondContact O-CD2 3.28Å; L108-Y112 PolarHBondContact O-N 3.45Å; D110-Y112 VanDerWaalsContact C-N 3.33Å; D110-Y112 PolarHBondContact O-N 3.29Å; Y112-V114 PolarHBondContact O-N 2.74Å
113	N	97.9	Very high	97.8	Very high	51 Å²	51	38 Å²	38	27%	0.273	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	44.6	65.1	179.2	-171.5	31.9	0	0	0	112.9	D53 V54 A109 D110 P115 R118	D53-N113 VanDerWaalsContact OD1-CB 3.29Å; D53-N113 WeakPolarHBondContact OD1-CB 3.45Å; D53-N113 PolarHBondContact OD1-ND2 3.31Å; D53-N113 PolarHBondContact OD2-ND2 2.93Å; V54-N113 HydrophobicContact CG2-CB 4Å; A109-N113 CarbonylContact O-C 3.56Å; A109-N113 VanDerWaalsContact O-CA 3.32Å; A109-N113 WeakPolarHBondContact O-CA 3.39Å; A109-N113 PolarHBondContact O-N 2.94Å; A109-N113 VanDerWaalsContact O-N 3.13Å; D110-N113 PolarHBondContact O-N 3.12Å; N113-P115 VanDerWaalsContact O-CD 3.3Å; N113-P115 WeakPolarHBondContact O-CD 3.39Å; N113-R118 PolarHBondContact OD1-NH1 3.41Å
114	V	98.1	Very high	97.7	Very high	3 Å²	3	39.7 Å²	39.7	2%	0.018	19%	0.191	C	C	.	.			trans	-108.7	86.5	177.1	-172.2	0	0	0	0	108.3	F86 F89 L90 A109 Y112 H116 L117 R118	F86-V114 HydrophobicContact CE2-CG2 3.84Å; F86-V114 HydrophobicContact CZ-CG2 3.95Å; F89-V114 HydrophobicContact CE1-CG1 4.38Å; L90-V114 HydrophobicContact CD2-CG1 3.86Å; L90-V114 HydrophobicContact CD2-CG2 4.04Å; A109-V114 PolarHBondContact O-N 3.23Å; Y112-V114 PolarHBondContact O-N 2.74Å; V114-H116 VanDerWaalsContact C-N 3.32Å; V114-H116 PolarHBondContact O-N 3.35Å; V114-L117 HydrophobicContact CB-CB 4.22Å; V114-L117 HydrophobicContact CG1-CB 3.76Å; V114-L117 PolarHBondContact O-N 3.36Å; V114-R118 PolarHBondContact O-N 3.46Å
115	P	96.3	Very high	97.7	Very high	58 Å²	58	39.4 Å²	39.4	38%	0.377	19%	0.19	S	C	.	.	H	α-helix	trans	-64.3	-34.4	-165.6	-24.9	37.3	0	0	0	113.7	N113 K119	N113-P115 VanDerWaalsContact O-CD 3.3Å; N113-P115 WeakPolarHBondContact O-CD 3.39Å; P115-K119 WeakPolarHBondContact O-CB 3.34Å; P115-K119 PolarHBondContact O-N 3.1Å
116	H	94.6	Very high	97.6	Very high	128 Å²	128	42.1 Å²	42.1	59%	0.593	20%	0.202	S	C	*	.	H	α-helix	trans	-65.4	-44.9	178.2	-68.5	-63.3	0	0	0	111.7	F89 V114 K119 V120	F89-H116 HydrophobicContact CZ-CB 4.45Å; V114-H116 VanDerWaalsContact C-N 3.32Å; V114-H116 PolarHBondContact O-N 3.35Å; H116-K119 PolarHBondContact O-N 3.31Å; H116-V120 WeakPolarHBondContact O-CG2 3.5Å; H116-V120 PolarHBondContact O-N 2.72Å; H116-V120 VanDerWaalsContact O-N 3.1Å
117	L	97.8	Very high	97.4	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-67.4	-43.2	177.3	-175.4	53.1	0	0	0	111.2	F86 F89 I95 V105 A109 V114 K119 V120 C121	F86-L117 HydrophobicContact CD2-CD2 3.47Å; F86-L117 VanDerWaalsContact CD2-CD2 3.47Å; F86-L117 HydrophobicContact CE2-CD2 3.94Å; F89-L117 HydrophobicContact CB-CD2 4.39Å; F89-L117 HydrophobicContact CD1-CB 3.83Å; F89-L117 HydrophobicContact CD1-CD1 4.06Å; F89-L117 HydrophobicContact CD1-CD2 3.95Å; F89-L117 HydrophobicContact CD1-CG 4.17Å; F89-L117 HydrophobicContact CD2-CD1 3.86Å; F89-L117 HydrophobicContact CE1-CB 3.55Å; F89-L117 HydrophobicContact CE1-CD1 4.2Å; F89-L117 HydrophobicContact CE1-CG 4.3Å; F89-L117 HydrophobicContact CE2-CD1 3.95Å; F89-L117 HydrophobicContact CG-CD1 3.9Å; F89-L117 HydrophobicContact CG-CD2 4.18Å; F89-L117 HydrophobicContact CG-CG 4.43Å; F89-L117 HydrophobicContact CZ-CB 4Å; F89-L117 HydrophobicContact CZ-CD1 4.12Å; I95-L117 HydrophobicContact CD1-CD1 3.99Å; I95-L117 HydrophobicContact CG2-CD1 3.93Å; V105-L117 HydrophobicContact CG1-CD1 3.97Å; V105-L117 HydrophobicContact CG1-CD2 3.82Å; V105-L117 HydrophobicContact CG1-CG 4.01Å; A109-L117 HydrophobicContact CB-CB 3.99Å; A109-L117 HydrophobicContact CB-CD2 4.1Å; A109-L117 HydrophobicContact CB-CG 3.89Å; V114-L117 HydrophobicContact CB-CB 4.22Å; V114-L117 HydrophobicContact CG1-CB 3.76Å; V114-L117 PolarHBondContact O-N 3.36Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 2.82Å; L117-V120 PolarHBondContact O-N 3.17Å; L117-V120 VanDerWaalsContact O-N 3.17Å; L117-C121 PolarHBondContact O-N 3.07Å; L117-C121 PolarHBondContact O-SG 2.94Å; L117-C121 VanDerWaalsContact O-SG 3.38Å
118	R	98.2	Very high	97.1	Very high	66 Å²	66	51.6 Å²	51.6	25%	0.249	25%	0.25	C	S	.	.	H	α-helix	trans	-53.3	-50	174.3	174.3	175.3	68.3	-139.2	1.6	111.2	L106 A109 D110 N113 V114 V120 C121 L122	L106-R118 HydrophobicContact CD1-CB 4.41Å; L106-R118 HydrophobicContact CD1-CG 3.91Å; A109-R118 HydrophobicContact CB-CB 4.06Å; D110-R118 WeakPolarHBondContact OD1-CD 2.78Å; D110-R118 IonicContact OD1-NH1 2.76Å; N113-R118 PolarHBondContact OD1-NH1 3.41Å; V114-R118 PolarHBondContact O-N 3.46Å; R118-V120 PolarHBondContact O-N 3.1Å; R118-C121 PolarHBondContact O-N 3.29Å; R118-L122 HydrophobicContact CG-CD1 3.88Å; R118-L122 HydrophobicContact CG-CG 4.4Å; R118-L122 VanDerWaalsContact O-CG 3.28Å; R118-L122 WeakPolarHBondContact O-CG 3.36Å; R118-L122 PolarHBondContact O-N 3.43Å
119	K	97.6	Very high	96.9	Very high	121 Å²	121	51.8 Å²	51.8	53%	0.526	25%	0.251	S	S	.	.	H	α-helix	trans	-57	-48.9	177.2	-179.3	179.1	172.2	-179	0	111.6	P115 H116 L117 C121 L122 E123	P115-K119 WeakPolarHBondContact O-CB 3.34Å; P115-K119 PolarHBondContact O-N 3.1Å; H116-K119 PolarHBondContact O-N 3.31Å; L117-K119 VanDerWaalsContact C-N 3.31Å; L117-K119 PolarHBondContact O-N 2.82Å; K119-C121 VanDerWaalsContact C-N 3.35Å; K119-C121 PolarHBondContact O-N 2.94Å; K119-L122 PolarHBondContact O-N 3.28Å; K119-E123 WeakPolarHBondContact CE-OE1 2.97Å; K119-E123 HydrophobicContact CG-CG 4.41Å; K119-E123 IonicContact NZ-OE1 3.63Å; K119-E123 WeakPolarHBondContact O-CB 3.22Å; K119-E123 WeakPolarHBondContact O-CG 3.28Å; K119-E123 PolarHBondContact O-N 2.58Å
120	V	96.9	Very high	96.8	Very high	57 Å²	57	52 Å²	52	35%	0.345	25%	0.252	S	S	.	.	H	α-helix	trans	-59.5	-43.8	178.5	170.4	0	0	0	0	111.7	I95 L97 H116 L117 R118 F124	I95-V120 HydrophobicContact CG2-CG1 4.15Å; L97-V120 HydrophobicContact CD1-CG1 4.38Å; H116-V120 WeakPolarHBondContact O-CG2 3.5Å; H116-V120 PolarHBondContact O-N 2.72Å; H116-V120 VanDerWaalsContact O-N 3.1Å; L117-V120 PolarHBondContact O-N 3.17Å; L117-V120 VanDerWaalsContact O-N 3.17Å; R118-V120 PolarHBondContact O-N 3.1Å; V120-F124 VanDerWaalsContact O-CB 3.28Å; V120-F124 WeakPolarHBondContact O-CB 3.38Å; V120-F124 PolarHBondContact O-N 3.02Å
121	C	97.9	Very high	96.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-43.1	177.7	-71.5	0	0	0	0	112.4	V105 L106 L117 R118 K119 T125	V105-C121 VanDerWaalsContact CG1-SG 3.58Å; L106-C121 HydrophobicContact CB-CB 3.94Å; L106-C121 HydrophobicContact CD1-CB 3.9Å; L106-C121 HydrophobicContact CG-CB 4.42Å; L117-C121 PolarHBondContact O-N 3.07Å; L117-C121 PolarHBondContact O-SG 2.94Å; L117-C121 VanDerWaalsContact O-SG 3.38Å; R118-C121 PolarHBondContact O-N 3.29Å; K119-C121 VanDerWaalsContact C-N 3.35Å; K119-C121 PolarHBondContact O-N 2.94Å; C121-T125 VanDerWaalsContact O-CB 3.28Å; C121-T125 WeakPolarHBondContact O-CB 3.44Å; C121-T125 PolarHBondContact O-N 2.68Å; C121-T125 PolarHBondContact O-OG1 3.16Å
122	L	98	Very high	96.4	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-49.8	177.4	-68.1	171.1	0	0	0	110.9	L106 R118 K119 F124 T125 E126 H151 L154	L106-L122 HydrophobicContact CD1-CD2 4.11Å; L106-L122 HydrophobicContact CD1-CG 4.07Å; L106-L122 HydrophobicContact CD2-CD2 3.83Å; R118-L122 HydrophobicContact CG-CD1 3.88Å; R118-L122 HydrophobicContact CG-CG 4.4Å; R118-L122 VanDerWaalsContact O-CG 3.28Å; R118-L122 WeakPolarHBondContact O-CG 3.36Å; R118-L122 PolarHBondContact O-N 3.43Å; K119-L122 PolarHBondContact O-N 3.28Å; L122-F124 PolarHBondContact O-N 2.88Å; L122-T125 PolarHBondContact O-N 2.86Å; L122-T125 VanDerWaalsContact O-N 3.16Å; L122-E126 WeakPolarHBondContact O-CB 3.28Å; L122-E126 VanDerWaalsContact O-CG 3.27Å; L122-E126 WeakPolarHBondContact O-CG 3.38Å; L122-E126 PolarHBondContact O-N 2.93Å; L122-H151 HydrophobicContact CD1-CB 4.47Å; L122-H151 HydrophobicContact CD2-CB 3.99Å; L122-L154 HydrophobicContact CD2-CB 3.89Å; L122-L154 HydrophobicContact CD2-CD2 3.92Å; L122-L154 HydrophobicContact CD2-CG 4.45Å
123	E	96.8	Very high	96.2	Very high	102 Å²	102	58.2 Å²	58.2	48%	0.477	29%	0.291	S	S	.	.	H	α-helix	trans	-60	-43.1	178.2	-72.2	175.6	167	0	0	112.1	K119 A127	K119-E123 WeakPolarHBondContact CE-OE1 2.97Å; K119-E123 HydrophobicContact CG-CG 4.41Å; K119-E123 IonicContact NZ-OE1 3.63Å; K119-E123 WeakPolarHBondContact O-CB 3.22Å; K119-E123 WeakPolarHBondContact O-CG 3.28Å; K119-E123 PolarHBondContact O-N 2.58Å; E123-A127 VanDerWaalsContact O-CB 3.22Å; E123-A127 WeakPolarHBondContact O-CB 3.47Å; E123-A127 PolarHBondContact O-N 3.4Å
124	F	96.5	Very high	96.1	Very high	59 Å²	59	58.4 Å²	58.4	26%	0.259	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-42.7	175.8	178.9	-110.5	0	0	0	111.9	L97 A102 V120 L122 R128 I129	L97-F124 HydrophobicContact CB-CD1 3.84Å; L97-F124 HydrophobicContact CB-CE1 3.69Å; L97-F124 HydrophobicContact CB-CG 4.44Å; L97-F124 HydrophobicContact CB-CZ 4.19Å; L97-F124 HydrophobicContact CD1-CB 4.24Å; L97-F124 HydrophobicContact CD1-CD1 3.95Å; L97-F124 HydrophobicContact CD1-CG 4.22Å; L97-F124 WeakPolarHBondContact O-CZ 3.27Å; A102-F124 HydrophobicContact CB-CD1 4.21Å; A102-F124 HydrophobicContact CB-CE1 4.32Å; V120-F124 VanDerWaalsContact O-CB 3.28Å; V120-F124 WeakPolarHBondContact O-CB 3.38Å; V120-F124 PolarHBondContact O-N 3.02Å; L122-F124 PolarHBondContact O-N 2.88Å; F124-R128 HydrophobicContact CD2-CB 4.15Å; F124-R128 HydrophobicContact CD2-CG 3.96Å; F124-R128 HydrophobicContact CE2-CB 3.97Å; F124-R128 HydrophobicContact CE2-CG 3.97Å; F124-R128 HydrophobicContact CZ-CB 4.46Å; F124-R128 WeakPolarHBondContact O-CA 3.32Å; F124-R128 VanDerWaalsContact O-CB 3.3Å; F124-R128 WeakPolarHBondContact O-CB 3.3Å; F124-R128 PolarHBondContact O-N 2.9Å; F124-I129 HydrophobicContact CD1-CD1 3.79Å; F124-I129 HydrophobicContact CD1-CG1 4.13Å; F124-I129 HydrophobicContact CE1-CD1 3.69Å; F124-I129 HydrophobicContact CE1-CG1 3.9Å
125	T	97.2	Very high	95.9	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.308	C	S	.	.	I	π-helix	trans	-63.9	-51.2	179.8	-60.2	0	0	0	0	111.2	C121 L122 A127 I129 L130 W142 L154	C121-T125 VanDerWaalsContact O-CB 3.28Å; C121-T125 WeakPolarHBondContact O-CB 3.44Å; C121-T125 PolarHBondContact O-N 2.68Å; C121-T125 PolarHBondContact O-OG1 3.16Å; L122-T125 PolarHBondContact O-N 2.86Å; L122-T125 VanDerWaalsContact O-N 3.16Å; T125-A127 PolarHBondContact O-N 2.96Å; T125-I129 HydrophobicContact CG2-CB 4.2Å; T125-I129 HydrophobicContact CG2-CD1 4.48Å; T125-I129 WeakPolarHBondContact O-CA 3.49Å; T125-I129 WeakPolarHBondContact O-CB 3.48Å; T125-I129 PolarHBondContact O-N 2.73Å; T125-L130 HydrophobicContact CG2-CD2 4.21Å; T125-L130 HydrophobicContact CG2-CG 4.14Å; T125-L130 PolarHBondContact O-N 3.43Å; T125-W142 HydrophobicContact CG2-CD2 3.76Å; T125-W142 HydrophobicContact CG2-CE3 3.49Å; T125-W142 VanDerWaalsContact CG2-CE3 3.49Å; T125-W142 HydrophobicContact CG2-CH2 3.52Å; T125-W142 HydrophobicContact CG2-CZ2 3.82Å; T125-W142 HydrophobicContact CG2-CZ3 3.37Å; T125-W142 WeakPolarHBondContact OG1-CH2 3.35Å; T125-L154 HydrophobicContact CG2-CD1 3.94Å
126	E	96.3	Very high	95.9	Very high	57 Å²	57	61 Å²	61	27%	0.266	30%	0.304	S	S	.	.	I	π-helix	trans	-61.5	-44.4	-179.1	-68.7	169.8	-159.7	0	0	111.4	L122 S153 L154 A157	L122-E126 WeakPolarHBondContact O-CB 3.28Å; L122-E126 VanDerWaalsContact O-CG 3.27Å; L122-E126 WeakPolarHBondContact O-CG 3.38Å; L122-E126 PolarHBondContact O-N 2.93Å; E126-S153 VanDerWaalsContact OE1-C 3.22Å; E126-S153 WeakPolarHBondContact OE1-CB 3.45Å; E126-S153 PolarHBondContact OE1-OG 2.78Å; E126-L154 HydrophobicContact CG-CD1 4.49Å; E126-L154 PolarHBondContact OE1-N 2.91Å; E126-A157 HydrophobicContact CB-CB 4.4Å; E126-A157 HydrophobicContact CG-CB 3.9Å
127	A	94.1	Very high	95.9	Very high	67 Å²	67	59.2 Å²	59.2	55%	0.554	30%	0.296	S	S	*	.	I	π-helix	trans	-82.2	-30	-174.9	0	0	0	0	0	114.3	E123 T125	E123-A127 VanDerWaalsContact O-CB 3.22Å; E123-A127 WeakPolarHBondContact O-CB 3.47Å; E123-A127 PolarHBondContact O-N 3.4Å; T125-A127 PolarHBondContact O-N 2.96Å
128	R	93.6	Very high	95.9	Very high	164 Å²	164	59.3 Å²	59.3	62%	0.619	30%	0.296	S	S	*	.	I	π-helix	trans	-122.4	-38	-169.6	-56.2	-62.7	-178.1	133.6	-1.2	113.9	F124 Q132	F124-R128 HydrophobicContact CD2-CB 4.15Å; F124-R128 HydrophobicContact CD2-CG 3.96Å; F124-R128 HydrophobicContact CE2-CB 3.97Å; F124-R128 HydrophobicContact CE2-CG 3.97Å; F124-R128 HydrophobicContact CZ-CB 4.46Å; F124-R128 WeakPolarHBondContact O-CA 3.32Å; F124-R128 VanDerWaalsContact O-CB 3.3Å; F124-R128 WeakPolarHBondContact O-CB 3.3Å; F124-R128 PolarHBondContact O-N 2.9Å; R128-Q132 PolarHBondContact O-NE2 2.61Å
129	I	94.9	Very high	95.8	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.015	29%	0.285	C	S	.	.	I	π-helix	trans	-85.9	-57.5	-172	-58.2	-178.4	0	0	0	111.1	M99 A102 F124 T125 P131 Q132 L133 W142	M99-I129 HydrophobicContact SD-CB 4.12Å; M99-I129 HydrophobicContact SD-CG1 3.9Å; M99-I129 HydrophobicContact SD-CG2 3.94Å; A102-I129 HydrophobicContact CB-CD1 3.14Å; F124-I129 HydrophobicContact CD1-CD1 3.79Å; F124-I129 HydrophobicContact CD1-CG1 4.13Å; F124-I129 HydrophobicContact CE1-CD1 3.69Å; F124-I129 HydrophobicContact CE1-CG1 3.9Å; T125-I129 HydrophobicContact CG2-CB 4.2Å; T125-I129 HydrophobicContact CG2-CD1 4.48Å; T125-I129 WeakPolarHBondContact O-CA 3.49Å; T125-I129 WeakPolarHBondContact O-CB 3.48Å; T125-I129 PolarHBondContact O-N 2.73Å; I129-P131 VanDerWaalsContact C-N 3.31Å; I129-P131 VanDerWaalsContact O-N 3.16Å; I129-Q132 PolarHBondContact O-N 3Å; I129-L133 HydrophobicContact CG2-CD1 3.69Å; I129-L133 HydrophobicContact CG2-CD2 4.29Å; I129-L133 HydrophobicContact CG2-CG 3.93Å; I129-L133 PolarHBondContact O-N 3.07Å; I129-W142 HydrophobicContact CD1-CH2 4.44Å; I129-W142 HydrophobicContact CD1-CZ2 4.17Å; I129-W142 HydrophobicContact CG2-CZ2 4.13Å
130	L	95.6	Very high	95.7	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-51	-42.8	-174.7	-63.1	-178.5	0	0	0	113.6	T125 Q132 L133 V138 W142 L154 A157	T125-L130 HydrophobicContact CG2-CD2 4.21Å; T125-L130 HydrophobicContact CG2-CG 4.14Å; T125-L130 PolarHBondContact O-N 3.43Å; L130-Q132 PolarHBondContact O-N 3.36Å; L130-Q132 VanDerWaalsContact O-N 3.13Å; L130-L133 PolarHBondContact O-N 2.93Å; L130-V138 HydrophobicContact CD2-CG1 4.44Å; L130-V138 HydrophobicContact CD2-CG2 4.36Å; L130-W142 HydrophobicContact CD2-CB 3.82Å; L130-W142 HydrophobicContact CD2-CD2 4.44Å; L130-W142 HydrophobicContact CD2-CG 3.82Å; L130-L154 HydrophobicContact CD1-CD1 4.12Å; L130-A157 HydrophobicContact CD1-CB 3.6Å
131	P	94.3	Very high	95.7	Very high	97 Å²	97	53.8 Å²	53.8	63%	0.63	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-64.5	-17	179.6	-23.2	35.8	0	0	0	115	I129	I129-P131 VanDerWaalsContact C-N 3.31Å; I129-P131 VanDerWaalsContact O-N 3.16Å
132	Q	93.3	Very high	95.7	Very high	135 Å²	135	54.3 Å²	54.3	63%	0.631	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-99.6	-11	-177.9	-63.8	-175.2	76	0	0	113.2	M99 R128 I129 L130	M99-Q132 HydrophobicContact CE-CB 4.03Å; M99-Q132 HydrophobicContact SD-CB 4.49Å; R128-Q132 PolarHBondContact O-NE2 2.61Å; I129-Q132 PolarHBondContact O-N 3Å; L130-Q132 PolarHBondContact O-N 3.36Å; L130-Q132 VanDerWaalsContact O-N 3.13Å
133	L	94.6	Very high	95.6	Very high	34 Å²	34	53.5 Å²	53.5	18%	0.178	27%	0.273	C	S	.	.	S	Bend	trans	-87.1	156.2	-174.2	-68.2	-177.4	0	0	0	112.7	M99 I129 L130 E137 V138 W142	M99-L133 HydrophobicContact CE-CD2 4.38Å; I129-L133 HydrophobicContact CG2-CD1 3.69Å; I129-L133 HydrophobicContact CG2-CD2 4.29Å; I129-L133 HydrophobicContact CG2-CG 3.93Å; I129-L133 PolarHBondContact O-N 3.07Å; L130-L133 PolarHBondContact O-N 2.93Å; L133-E137 HydrophobicContact CB-CB 4.31Å; L133-E137 HydrophobicContact CD1-CB 4.45Å; L133-V138 HydrophobicContact CB-CG2 3.81Å; L133-V138 HydrophobicContact CD1-CG2 4.45Å; L133-W142 HydrophobicContact CD1-CG 4.48Å
134	S	95.6	Very high	95.6	Very high	54 Å²	54	51 Å²	51	38%	0.378	26%	0.261	S	S	.	.			trans	-67.6	150.7	166	72.4	0	0	0	0	110.8	K136 E137 V138	S134-K136 PolarHBondContact O-N 3.22Å; S134-K136 VanDerWaalsContact O-N 3.17Å; S134-E137 VanDerWaalsContact CB-OE2 3.32Å; S134-E137 WeakPolarHBondContact CB-OE2 3.5Å; S134-E137 PolarHBondContact N-OE2 2.93Å; S134-E137 PolarHBondContact O-N 3.33Å; S134-E137 WeakPolarHBondContact OG-CG 3.13Å; S134-E137 PolarHBondContact OG-N 3.34Å; S134-E137 PolarHBondContact OG-OE2 3.44Å; S134-V138 WeakPolarHBondContact O-CG2 3.45Å; S134-V138 PolarHBondContact O-N 3.25Å
135	L	95	Very high	95.6	Very high	52 Å²	52	49.9 Å²	49.9	27%	0.272	26%	0.255	S	S	.	.	H	α-helix	trans	-57.1	-34	177.2	-61.4	-179	0	0	0	112.3	V138 F139 L162 W175	L135-V138 PolarHBondContact O-N 2.9Å; L135-F139 WeakPolarHBondContact O-CB 3.17Å; L135-F139 PolarHBondContact O-N 3.13Å; L135-L162 HydrophobicContact CB-CD2 4.06Å; L135-L162 HydrophobicContact CD2-CD2 4.21Å; L135-L162 WeakPolarHBondContact O-CD2 3.15Å; L135-W175 HydrophobicContact CB-CH2 4.22Å; L135-W175 HydrophobicContact CB-CZ2 4.04Å
136	K	94.9	Very high	95.6	Very high	63 Å²	63	49.9 Å²	49.9	27%	0.274	26%	0.255	S	S	.	.	H	α-helix	trans	-65.5	-41.3	176.4	-74.6	-73.8	-175.6	-175.5	0	111.6	S134 F139 H140 D174 W175 E178	S134-K136 PolarHBondContact O-N 3.22Å; S134-K136 VanDerWaalsContact O-N 3.17Å; K136-F139 PolarHBondContact O-N 2.62Å; K136-H140 VanDerWaalsContact O-CB 3.3Å; K136-H140 WeakPolarHBondContact O-CB 3.48Å; K136-H140 PolarHBondContact O-CD2 3.48Å; K136-H140 VanDerWaalsContact O-CD2 3.24Å; K136-H140 PolarHBondContact O-N 3.45Å; K136-D174 PolarHBondContact NZ-O 3.34Å; K136-W175 HydrophobicContact CD-CD2 4.42Å; K136-W175 HydrophobicContact CD-CE3 4.25Å; K136-W175 HydrophobicContact CD-CH2 3.57Å; K136-W175 HydrophobicContact CD-CZ2 3.73Å; K136-W175 HydrophobicContact CD-CZ3 3.84Å; K136-W175 HydrophobicContact CG-CH2 4Å; K136-W175 HydrophobicContact CG-CZ2 3.96Å; K136-W175 VanDerWaalsContact NZ-CD2 3.3Å; K136-E178 IonicContact NZ-OE1 2.78Å; K136-E178 PolarHBondContact NZ-OE1 2.82Å; K136-E178 IonicContact NZ-OE2 2.67Å; K136-E178 PolarHBondContact NZ-OE2 2.96Å
137	E	95.5	Very high	95.7	Very high	92 Å²	92	47.8 Å²	47.8	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-68.6	-42.3	175.4	-72.6	166.4	97.5	0	0	112	L133 S134 F139 V141	L133-E137 HydrophobicContact CB-CB 4.31Å; L133-E137 HydrophobicContact CD1-CB 4.45Å; S134-E137 VanDerWaalsContact CB-OE2 3.32Å; S134-E137 WeakPolarHBondContact CB-OE2 3.5Å; S134-E137 PolarHBondContact N-OE2 2.93Å; S134-E137 PolarHBondContact O-N 3.33Å; S134-E137 WeakPolarHBondContact OG-CG 3.13Å; S134-E137 PolarHBondContact OG-N 3.34Å; S134-E137 PolarHBondContact OG-OE2 3.44Å; E137-F139 VanDerWaalsContact C-N 3.26Å; E137-F139 PolarHBondContact O-N 3.27Å; E137-V141 VanDerWaalsContact O-CB 3.27Å; E137-V141 WeakPolarHBondContact O-CB 3.27Å; E137-V141 PolarHBondContact O-N 3Å
138	V	97.5	Very high	95.7	Very high	2 Å²	2	51 Å²	51	1%	0.012	25%	0.248	C	C	.	.	I	π-helix	trans	-55.3	-46	173.4	175.3	0	0	0	0	110.2	L130 L133 S134 L135 W142 F143 C158 L162	L130-V138 HydrophobicContact CD2-CG1 4.44Å; L130-V138 HydrophobicContact CD2-CG2 4.36Å; L133-V138 HydrophobicContact CB-CG2 3.81Å; L133-V138 HydrophobicContact CD1-CG2 4.45Å; S134-V138 WeakPolarHBondContact O-CG2 3.45Å; S134-V138 PolarHBondContact O-N 3.25Å; L135-V138 PolarHBondContact O-N 2.9Å; V138-W142 PolarHBondContact O-N 2.86Å; V138-F143 WeakPolarHBondContact O-CB 3.34Å; V138-F143 PolarHBondContact O-N 3.46Å; V138-C158 HydrophobicContact CG1-CB 4Å; V138-L162 HydrophobicContact CB-CD2 4.38Å; V138-L162 HydrophobicContact CG1-CD1 4.23Å; V138-L162 HydrophobicContact CG1-CD2 4.24Å; V138-L162 HydrophobicContact CG1-CG 3.98Å
139	F	96.7	Very high	95.8	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	23%	0.233	C	C	.	.	I	π-helix	trans	-68.6	-55.5	179.5	-175.1	-86.3	0	0	0	113	L135 K136 E137 F143 Q144 L162 W175 E178 L182 F190	L135-F139 WeakPolarHBondContact O-CB 3.17Å; L135-F139 PolarHBondContact O-N 3.13Å; K136-F139 PolarHBondContact O-N 2.62Å; E137-F139 VanDerWaalsContact C-N 3.26Å; E137-F139 PolarHBondContact O-N 3.27Å; F139-F143 HydrophobicContact CD2-CD1 4.28Å; F139-F143 HydrophobicContact CE2-CD1 4.36Å; F139-F143 WeakPolarHBondContact O-CB 3.32Å; F139-Q144 WeakPolarHBondContact O-CG 3.5Å; F139-Q144 PolarHBondContact O-N 2.58Å; F139-L162 HydrophobicContact CB-CD1 4.36Å; F139-L162 HydrophobicContact CB-CD2 4.3Å; F139-L162 HydrophobicContact CD2-CD1 4.11Å; F139-W175 HydrophobicContact CB-CH2 4.08Å; F139-W175 HydrophobicContact CB-CZ3 3.84Å; F139-W175 HydrophobicContact CD1-CZ3 4.21Å; F139-W175 HydrophobicContact CD2-CZ3 4.02Å; F139-W175 HydrophobicContact CG-CH2 4.49Å; F139-W175 AromaticContact CG-CZ3 3.77Å; F139-W175 HydrophobicContact CG-CZ3 3.77Å; F139-E178 HydrophobicContact CD1-CB 4.29Å; F139-E178 HydrophobicContact CD1-CG 4.1Å; F139-E178 HydrophobicContact CE1-CB 3.6Å; F139-E178 HydrophobicContact CE1-CG 3.77Å; F139-E178 HydrophobicContact CZ-CB 3.82Å; F139-E178 HydrophobicContact CZ-CG 4.47Å; F139-L182 HydrophobicContact CE2-CD2 3.72Å; F139-L182 HydrophobicContact CZ-CD2 3.42Å; F139-L182 VanDerWaalsContact CZ-CD2 3.42Å; F139-L182 HydrophobicContact CZ-CG 4.19Å; F139-F190 HydrophobicContact CD2-CZ 4.2Å; F139-F190 HydrophobicContact CE2-CE2 4.1Å; F139-F190 HydrophobicContact CE2-CZ 4.1Å
140	H	95.5	Very high	95.9	Very high	72 Å²	72	52.3 Å²	52.3	33%	0.333	26%	0.264	S	S	.	.	I	π-helix	trans	-75.3	-28.9	-169.5	-78.1	-62.8	0	0	0	113.9	K136 Q144 E178	K136-H140 VanDerWaalsContact O-CB 3.3Å; K136-H140 WeakPolarHBondContact O-CB 3.48Å; K136-H140 PolarHBondContact O-CD2 3.48Å; K136-H140 VanDerWaalsContact O-CD2 3.24Å; K136-H140 PolarHBondContact O-N 3.45Å; H140-Q144 VanDerWaalsContact O-CD 3.23Å; H140-Q144 PolarHBondContact O-OE1 3.11Å; H140-E178 WeakPolarHBondContact CE1-CG 3.43Å; H140-E178 IonicContact CE1-OE1 2.65Å; H140-E178 VanDerWaalsContact NE2-CG 3.32Å; H140-E178 WeakPolarHBondContact NE2-CG 3.24Å; H140-E178 IonicContact NE2-OE1 2.66Å; H140-E178 PolarHBondContact NE2-OE1 2.87Å
141	V	95.6	Very high	96	Very high	55 Å²	55	53.1 Å²	53.1	33%	0.333	27%	0.267	S	S	.	.	I	π-helix	trans	-102.9	-66.5	-175.9	-175.9	0	0	0	0	109.6	L103 E137 Y145	L103-V141 HydrophobicContact CD2-CG1 3.43Å; L103-V141 VanDerWaalsContact CD2-CG1 3.43Å; E137-V141 VanDerWaalsContact O-CB 3.27Å; E137-V141 WeakPolarHBondContact O-CB 3.27Å; E137-V141 PolarHBondContact O-N 3Å; V141-Y145 WeakPolarHBondContact O-CB 3.28Å; V141-Y145 PolarHBondContact O-N 3.25Å
142	W	97.5	Very high	96.1	Very high	11 Å²	11	53.3 Å²	53.3	4%	0.042	26%	0.259	C	S	.	.	I	π-helix	trans	-80.8	-40.5	-165.7	-69	101.2	0	0	0	114	A102 L103 L106 T125 I129 L130 L133 V138 G146 L154	A102-W142 HydrophobicContact CB-CH2 4.09Å; A102-W142 HydrophobicContact CB-CZ2 4.45Å; L103-W142 HydrophobicContact CB-CH2 3.68Å; L103-W142 HydrophobicContact CB-CZ2 3.89Å; L103-W142 HydrophobicContact CB-CZ3 4.23Å; L103-W142 HydrophobicContact CD1-CE3 4.35Å; L103-W142 HydrophobicContact CD1-CH2 4.36Å; L103-W142 HydrophobicContact CD1-CZ3 4.04Å; L106-W142 HydrophobicContact CD2-CZ3 3.97Å; T125-W142 HydrophobicContact CG2-CD2 3.76Å; T125-W142 HydrophobicContact CG2-CE3 3.49Å; T125-W142 VanDerWaalsContact CG2-CE3 3.49Å; T125-W142 HydrophobicContact CG2-CH2 3.52Å; T125-W142 HydrophobicContact CG2-CZ2 3.82Å; T125-W142 HydrophobicContact CG2-CZ3 3.37Å; T125-W142 WeakPolarHBondContact OG1-CH2 3.35Å; I129-W142 HydrophobicContact CD1-CH2 4.44Å; I129-W142 HydrophobicContact CD1-CZ2 4.17Å; I129-W142 HydrophobicContact CG2-CZ2 4.13Å; L130-W142 HydrophobicContact CD2-CB 3.82Å; L130-W142 HydrophobicContact CD2-CD2 4.44Å; L130-W142 HydrophobicContact CD2-CG 3.82Å; L133-W142 HydrophobicContact CD1-CG 4.48Å; V138-W142 PolarHBondContact O-N 2.86Å; W142-G146 PolarHBondContact O-N 3.17Å; W142-L154 HydrophobicContact CB-CD1 4.49Å; W142-L154 HydrophobicContact CE3-CD1 4.14Å; W142-L154 HydrophobicContact CE3-CD2 4.02Å
143	F	97.7	Very high	96.2	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.248	C	C	.	.	I	π-helix	trans	-66.7	-46.9	175.1	179.4	-111.8	0	0	0	110.6	V138 F139 Y145 G146 T147 V155 C158 V159 L182 Q186 E189 F190	V138-F143 WeakPolarHBondContact O-CB 3.34Å; V138-F143 PolarHBondContact O-N 3.46Å; F139-F143 HydrophobicContact CD2-CD1 4.28Å; F139-F143 HydrophobicContact CE2-CD1 4.36Å; F139-F143 WeakPolarHBondContact O-CB 3.32Å; F143-Y145 PolarHBondContact O-N 3.47Å; F143-G146 PolarHBondContact O-N 2.91Å; F143-T147 HydrophobicContact CD2-CG2 4.17Å; F143-T147 HydrophobicContact CE1-CG2 4.49Å; F143-T147 HydrophobicContact CE2-CG2 3.81Å; F143-T147 HydrophobicContact CZ-CG2 3.99Å; F143-T147 WeakPolarHBondContact O-CG2 3.24Å; F143-T147 PolarHBondContact O-N 3.27Å; F143-T147 PolarHBondContact O-OG1 2.9Å; F143-V155 HydrophobicContact CE2-CG1 4.1Å; F143-C158 HydrophobicContact CB-CB 3.9Å; F143-C158 HydrophobicContact CD2-CB 3.96Å; F143-C158 HydrophobicContact CG-CB 4.4Å; F143-V159 HydrophobicContact CD2-CG2 4.25Å; F143-V159 HydrophobicContact CE2-CG2 3.68Å; F143-L182 HydrophobicContact CE1-CD2 4.1Å; F143-Q186 HydrophobicContact CE1-CB 3.75Å; F143-Q186 HydrophobicContact CE1-CG 3.81Å; F143-Q186 HydrophobicContact CZ-CB 3.85Å; F143-Q186 HydrophobicContact CZ-CG 4.1Å; F143-E189 HydrophobicContact CE2-CB 4.38Å; F143-F190 HydrophobicContact CD1-CE2 4.26Å; F143-F190 HydrophobicContact CD1-CZ 4.21Å; F143-F190 HydrophobicContact CE1-CD2 4.28Å; F143-F190 AromaticContact CE1-CE2 3.4Å; F143-F190 HydrophobicContact CE1-CE2 3.4Å; F143-F190 AromaticContact CE1-CZ 3.74Å; F143-F190 HydrophobicContact CE1-CZ 3.74Å; F143-F190 HydrophobicContact CE2-CE2 4.32Å; F143-F190 HydrophobicContact CE2-CZ 4.26Å; F143-F190 AromaticContact CZ-CD2 3.94Å; F143-F190 HydrophobicContact CZ-CD2 3.94Å; F143-F190 AromaticContact CZ-CE2 3.43Å; F143-F190 HydrophobicContact CZ-CE2 3.43Å; F143-F190 VanDerWaalsContact CZ-CE2 3.43Å; F143-F190 AromaticContact CZ-CZ 3.77Å; F143-F190 HydrophobicContact CZ-CZ 3.77Å
144	Q	96.1	Very high	96.4	Very high	50 Å²	50	48 Å²	48	23%	0.234	24%	0.24	C	C	.	.	H	α-helix	trans	-59	-44.2	174.8	-72.3	-168.5	22.9	0	0	112.9	F139 H140 T147 K148	F139-Q144 WeakPolarHBondContact O-CG 3.5Å; F139-Q144 PolarHBondContact O-N 2.58Å; H140-Q144 VanDerWaalsContact O-CD 3.23Å; H140-Q144 PolarHBondContact O-OE1 3.11Å; Q144-T147 PolarHBondContact O-OG1 3.15Å; Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 WeakPolarHBondContact O-CD 3.44Å; Q144-K148 VanDerWaalsContact O-CG 3.23Å; Q144-K148 WeakPolarHBondContact O-CG 3.32Å; Q144-K148 PolarHBondContact O-N 3.19Å; Q144-K148 VanDerWaalsContact O-N 3.15Å
145	Y	96.7	Very high	96.5	Very high	34 Å²	34	45.4 Å²	45.4	13%	0.133	22%	0.222	C	C	.	.	H	α-helix	trans	-65.3	-48.6	177.3	-174.6	-96.5	0	0	0	111.3	L103 L106 I107 D110 V141 F143 T147 K148 C149 H151 L154	L103-Y145 HydrophobicContact CD1-CD1 3.98Å; L103-Y145 HydrophobicContact CD1-CD2 4Å; L103-Y145 HydrophobicContact CD1-CE1 4.35Å; L103-Y145 HydrophobicContact CD1-CE2 4.36Å; L103-Y145 HydrophobicContact CD1-CG 3.8Å; L106-Y145 HydrophobicContact CD2-CD1 4.02Å; L106-Y145 HydrophobicContact CD2-CE1 3.55Å; L106-Y145 HydrophobicContact CG-CE1 3.77Å; I107-Y145 WeakPolarHBondContact CA-OH 3.37Å; I107-Y145 HydrophobicContact CD1-CE2 4.34Å; I107-Y145 HydrophobicContact CG1-CD2 4.39Å; I107-Y145 HydrophobicContact CG1-CE2 3.53Å; D110-Y145 PolarHBondContact OD2-OH 3.42Å; V141-Y145 WeakPolarHBondContact O-CB 3.28Å; V141-Y145 PolarHBondContact O-N 3.25Å; F143-Y145 PolarHBondContact O-N 3.47Å; Y145-T147 VanDerWaalsContact C-N 3.32Å; Y145-T147 PolarHBondContact O-N 3.32Å; Y145-K148 PolarHBondContact O-N 2.96Å; Y145-C149 HydrophobicContact CE1-CB 4.21Å; Y145-C149 VanDerWaalsContact CE2-SG 3.57Å; Y145-C149 WeakPolarHBondContact O-CB 3.38Å; Y145-C149 PolarHBondContact O-N 3.22Å; Y145-H151 AromaticContact CE1-CD2 3.9Å; Y145-L154 HydrophobicContact CD1-CD2 4.44Å
146	G	97.5	Very high	96.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.3	-41.8	179.9	0	0	0	0	0	112.9	W142 F143 F150 H151 V155	W142-G146 PolarHBondContact O-N 3.17Å; F143-G146 PolarHBondContact O-N 2.91Å; G146-F150 CarbonylContact O-C 3.57Å; G146-F150 WeakPolarHBondContact O-CA 3.4Å; G146-F150 PolarHBondContact O-N 2.67Å; G146-H151 PolarHBondContact O-N 3.39Å; G146-V155 WeakPolarHBondContact O-CG2 3.39Å
147	T	96.7	Very high	96.7	Very high	14 Å²	14	46.1 Å²	46.1	9%	0.086	23%	0.227	C	C	.	.	H	α-helix	trans	-72.8	-39.2	178.1	59.5	0	0	0	0	112.6	F143 Q144 Y145 F150 V155 Q186	F143-T147 HydrophobicContact CD2-CG2 4.17Å; F143-T147 HydrophobicContact CE1-CG2 4.49Å; F143-T147 HydrophobicContact CE2-CG2 3.81Å; F143-T147 HydrophobicContact CZ-CG2 3.99Å; F143-T147 WeakPolarHBondContact O-CG2 3.24Å; F143-T147 PolarHBondContact O-N 3.27Å; F143-T147 PolarHBondContact O-OG1 2.9Å; Q144-T147 PolarHBondContact O-OG1 3.15Å; Y145-T147 VanDerWaalsContact C-N 3.32Å; Y145-T147 PolarHBondContact O-N 3.32Å; T147-F150 PolarHBondContact O-N 2.92Å; T147-V155 HydrophobicContact CG2-CG1 4.09Å; T147-V155 HydrophobicContact CG2-CG2 3.73Å; T147-Q186 HydrophobicContact CG2-CG 3.81Å; T147-Q186 WeakPolarHBondContact OG1-CG 3.34Å; T147-Q186 PolarHBondContact OG1-NE2 3.25Å
148	K	95.5	Very high	96.8	Very high	133 Å²	133	41.7 Å²	41.7	58%	0.578	21%	0.206	S	C	*	.	H	α-helix	trans	-65.3	-37.9	177.3	-75.1	172.3	-176.5	170	0	112.8	Q144 Y145 F150	Q144-K148 WeakPolarHBondContact O-CB 3.47Å; Q144-K148 WeakPolarHBondContact O-CD 3.44Å; Q144-K148 VanDerWaalsContact O-CG 3.23Å; Q144-K148 WeakPolarHBondContact O-CG 3.32Å; Q144-K148 PolarHBondContact O-N 3.19Å; Q144-K148 VanDerWaalsContact O-N 3.15Å; Y145-K148 PolarHBondContact O-N 2.96Å; K148-F150 WeakPolarHBondContact O-CE2 3.23Å
149	C	95.9	Very high	96.9	Very high	45 Å²	45	41.8 Å²	41.8	30%	0.304	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2.3	-178.8	-64.3	0	0	0	0	113.5	Y145 H151	Y145-C149 HydrophobicContact CE1-CB 4.21Å; Y145-C149 VanDerWaalsContact CE2-SG 3.57Å; Y145-C149 WeakPolarHBondContact O-CB 3.38Å; Y145-C149 PolarHBondContact O-N 3.22Å; C149-H151 VanDerWaalsContact C-N 3.3Å; C149-H151 WeakPolarHBondContact CB-NE2 3.41Å; C149-H151 PolarHBondContact O-N 2.95Å
150	F	95.6	Very high	96.9	Very high	151 Å²	151	44.6 Å²	44.6	66%	0.662	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	29.7	179.2	-54.2	-86	0	0	0	115.3	G146 T147 K148 Q152	G146-F150 CarbonylContact O-C 3.57Å; G146-F150 WeakPolarHBondContact O-CA 3.4Å; G146-F150 PolarHBondContact O-N 2.67Å; T147-F150 PolarHBondContact O-N 2.92Å; K148-F150 WeakPolarHBondContact O-CE2 3.23Å; F150-Q152 PolarHBondContact O-N 3.33Å
151	H	97.3	Very high	96.9	Very high	20 Å²	20	43 Å²	43	9%	0.093	22%	0.219	C	C	.	.			trans	-78.1	85.1	175.8	-64.3	-39.7	0	0	0	111	D110 L122 Y145 G146 C149 S153 L154 V155	D110-H151 VanDerWaalsContact CG-NE2 3.29Å; D110-H151 IonicContact OD1-CE1 3.39Å; D110-H151 PolarHBondContact OD1-CE1 2.86Å; D110-H151 IonicContact OD1-NE2 3.22Å; D110-H151 PolarHBondContact OD1-NE2 3.43Å; D110-H151 VanDerWaalsContact OD1-NE2 3.17Å; D110-H151 IonicContact OD2-CD2 3.33Å; D110-H151 IonicContact OD2-CE1 2.82Å; D110-H151 IonicContact OD2-NE2 3.72Å; D110-H151 PolarHBondContact OD2-NE2 3.38Å; L122-H151 HydrophobicContact CD1-CB 4.47Å; L122-H151 HydrophobicContact CD2-CB 3.99Å; Y145-H151 AromaticContact CE1-CD2 3.9Å; G146-H151 PolarHBondContact O-N 3.39Å; C149-H151 VanDerWaalsContact C-N 3.3Å; C149-H151 WeakPolarHBondContact CB-NE2 3.41Å; C149-H151 PolarHBondContact O-N 2.95Å; H151-S153 VanDerWaalsContact C-N 3.32Å; H151-S153 PolarHBondContact O-N 2.86Å; H151-L154 HydrophobicContact CB-CB 3.95Å; H151-L154 HydrophobicContact CB-CD2 4.38Å; H151-L154 PolarHBondContact O-N 3.25Å; H151-V155 WeakPolarHBondContact O-CG2 3.41Å; H151-V155 PolarHBondContact O-N 3.27Å
152	Q	96.4	Very high	97	Very high	101 Å²	101	40.4 Å²	40.4	47%	0.472	20%	0.203	S	C	.	.	H	α-helix	trans	-59.6	-35.8	-171.7	-65.1	-60.7	-54.1	0	0	114.2	F150 K156	F150-Q152 PolarHBondContact O-N 3.33Å; Q152-K156 WeakPolarHBondContact O-CB 3.48Å; Q152-K156 PolarHBondContact O-N 3.43Å
153	S	96.1	Very high	97.1	Very high	57 Å²	57	40 Å²	40	40%	0.399	20%	0.202	S	C	.	.	H	α-helix	trans	-64.5	-46.4	176.8	62.3	0	0	0	0	111.4	E126 H151 K156 A157	E126-S153 VanDerWaalsContact OE1-C 3.22Å; E126-S153 WeakPolarHBondContact OE1-CB 3.45Å; E126-S153 PolarHBondContact OE1-OG 2.78Å; H151-S153 VanDerWaalsContact C-N 3.32Å; H151-S153 PolarHBondContact O-N 2.86Å; S153-K156 PolarHBondContact O-N 2.96Å; S153-A157 WeakPolarHBondContact O-CB 3.4Å; S153-A157 PolarHBondContact O-N 2.94Å
154	L	98.2	Very high	96.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.4	-45	177.2	174.7	63.6	0	0	0	111.5	L122 T125 E126 L130 W142 Y145 H151 K156 A157 C158	L122-L154 HydrophobicContact CD2-CB 3.89Å; L122-L154 HydrophobicContact CD2-CD2 3.92Å; L122-L154 HydrophobicContact CD2-CG 4.45Å; T125-L154 HydrophobicContact CG2-CD1 3.94Å; E126-L154 HydrophobicContact CG-CD1 4.49Å; E126-L154 PolarHBondContact OE1-N 2.91Å; L130-L154 HydrophobicContact CD1-CD1 4.12Å; W142-L154 HydrophobicContact CB-CD1 4.49Å; W142-L154 HydrophobicContact CE3-CD1 4.14Å; W142-L154 HydrophobicContact CE3-CD2 4.02Å; Y145-L154 HydrophobicContact CD1-CD2 4.44Å; H151-L154 HydrophobicContact CB-CB 3.95Å; H151-L154 HydrophobicContact CB-CD2 4.38Å; H151-L154 PolarHBondContact O-N 3.25Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.34Å; L154-A157 PolarHBondContact O-N 2.96Å; L154-C158 WeakPolarHBondContact O-CB 3.48Å; L154-C158 PolarHBondContact O-N 3.44Å; L154-C158 PolarHBondContact O-SG 2.97Å
155	V	98.5	Very high	96.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-57	-47.9	176	169.8	0	0	0	0	110.4	F143 G146 T147 H151 C158 V159 E189	F143-V155 HydrophobicContact CE2-CG1 4.1Å; G146-V155 WeakPolarHBondContact O-CG2 3.39Å; T147-V155 HydrophobicContact CG2-CG1 4.09Å; T147-V155 HydrophobicContact CG2-CG2 3.73Å; H151-V155 WeakPolarHBondContact O-CG2 3.41Å; H151-V155 PolarHBondContact O-N 3.27Å; V155-C158 PolarHBondContact O-N 2.95Å; V155-V159 WeakPolarHBondContact O-CG2 3.48Å; V155-V159 PolarHBondContact O-N 3.48Å; V155-E189 HydrophobicContact CG1-CB 3.84Å; V155-E189 HydrophobicContact CG1-CG 3.67Å
156	K	96.8	Very high	97	Very high	109 Å²	109	41.1 Å²	41.1	47%	0.474	22%	0.221	S	C	.	.	H	α-helix	trans	-60	-48.3	176.9	178	173.1	168.9	42.4	0	111.5	Q152 S153 L154 C158 V159 D160	Q152-K156 WeakPolarHBondContact O-CB 3.48Å; Q152-K156 PolarHBondContact O-N 3.43Å; S153-K156 PolarHBondContact O-N 2.96Å; L154-K156 VanDerWaalsContact C-N 3.31Å; L154-K156 PolarHBondContact O-N 3.34Å; K156-C158 VanDerWaalsContact C-N 3.3Å; K156-C158 PolarHBondContact O-N 3.42Å; K156-V159 PolarHBondContact O-N 3.17Å; K156-D160 WeakPolarHBondContact CG-OD2 3.49Å; K156-D160 IonicContact NZ-OD1 3.42Å; K156-D160 IonicContact NZ-OD2 3.13Å; K156-D160 PolarHBondContact NZ-OD2 2.8Å; K156-D160 WeakPolarHBondContact O-CB 3.49Å; K156-D160 VanDerWaalsContact O-CG 3.23Å; K156-D160 PolarHBondContact O-N 3.24Å
157	A	97.5	Very high	96.9	Very high	21 Å²	21	45 Å²	45	17%	0.174	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-37.9	179.3	0	0	0	0	0	112.5	E126 L130 S153 L154 S161	E126-A157 HydrophobicContact CB-CB 4.4Å; E126-A157 HydrophobicContact CG-CB 3.9Å; L130-A157 HydrophobicContact CD1-CB 3.6Å; S153-A157 WeakPolarHBondContact O-CB 3.4Å; S153-A157 PolarHBondContact O-N 2.94Å; L154-A157 PolarHBondContact O-N 2.96Å; A157-S161 WeakPolarHBondContact O-CB 3.35Å; A157-S161 PolarHBondContact O-N 2.86Å; A157-S161 PolarHBondContact O-OG 3.35Å
158	C	98.4	Very high	96.8	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-47.7	172.7	-72.7	0	0	0	0	111.8	V138 F143 L154 V155 K156 D160 S161 L162	V138-C158 HydrophobicContact CG1-CB 4Å; F143-C158 HydrophobicContact CB-CB 3.9Å; F143-C158 HydrophobicContact CD2-CB 3.96Å; F143-C158 HydrophobicContact CG-CB 4.4Å; L154-C158 WeakPolarHBondContact O-CB 3.48Å; L154-C158 PolarHBondContact O-N 3.44Å; L154-C158 PolarHBondContact O-SG 2.97Å; V155-C158 PolarHBondContact O-N 2.95Å; K156-C158 VanDerWaalsContact C-N 3.3Å; K156-C158 PolarHBondContact O-N 3.42Å; C158-D160 VanDerWaalsContact C-N 3.32Å; C158-D160 PolarHBondContact O-N 3.15Å; C158-S161 PolarHBondContact O-N 3.11Å; C158-L162 WeakPolarHBondContact O-CB 3.48Å; C158-L162 WeakPolarHBondContact O-CD1 3.39Å; C158-L162 VanDerWaalsContact O-CG 3.23Å; C158-L162 WeakPolarHBondContact O-CG 3.3Å; C158-L162 PolarHBondContact O-N 2.99Å
159	V	98.5	Very high	96.8	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-44.4	177	170.4	0	0	0	0	110.7	F143 V155 K156 S161 L162 A163 E189 F190 L196	F143-V159 HydrophobicContact CD2-CG2 4.25Å; F143-V159 HydrophobicContact CE2-CG2 3.68Å; V155-V159 WeakPolarHBondContact O-CG2 3.48Å; V155-V159 PolarHBondContact O-N 3.48Å; K156-V159 PolarHBondContact O-N 3.17Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 3.03Å; V159-L162 PolarHBondContact O-N 3.32Å; V159-A163 WeakPolarHBondContact O-CB 3.38Å; V159-A163 PolarHBondContact O-N 3.26Å; V159-E189 HydrophobicContact CG2-CB 4.38Å; V159-F190 HydrophobicContact CB-CD1 4.49Å; V159-F190 HydrophobicContact CG1-CD1 4.06Å; V159-F190 HydrophobicContact CG2-CD1 4Å; V159-F190 HydrophobicContact CG2-CE1 4.09Å; V159-L196 HydrophobicContact CG1-CD2 4.11Å
160	D	96.4	Very high	96.8	Very high	59 Å²	59	40.8 Å²	40.8	32%	0.316	22%	0.216	S	C	.	.	H	α-helix	trans	-64.7	-36	179	-68	-17.2	0	0	0	111.1	K156 C158 A163	K156-D160 WeakPolarHBondContact CG-OD2 3.49Å; K156-D160 IonicContact NZ-OD1 3.42Å; K156-D160 IonicContact NZ-OD2 3.13Å; K156-D160 PolarHBondContact NZ-OD2 2.8Å; K156-D160 WeakPolarHBondContact O-CB 3.49Å; K156-D160 VanDerWaalsContact O-CG 3.23Å; K156-D160 PolarHBondContact O-N 3.24Å; C158-D160 VanDerWaalsContact C-N 3.32Å; C158-D160 PolarHBondContact O-N 3.15Å; D160-A163 WeakPolarHBondContact O-CB 3.49Å; D160-A163 PolarHBondContact O-N 3.45Å
161	S	96.8	Very high	96.6	Very high	40 Å²	40	36.8 Å²	36.8	28%	0.28	21%	0.207	S	C	.	.	H	α-helix	trans	-68.5	-36	173.6	-59.1	0	0	0	0	113	A157 C158 V159	A157-S161 WeakPolarHBondContact O-CB 3.35Å; A157-S161 PolarHBondContact O-N 2.86Å; A157-S161 PolarHBondContact O-OG 3.35Å; C158-S161 PolarHBondContact O-N 3.11Å; V159-S161 VanDerWaalsContact C-N 3.31Å; V159-S161 PolarHBondContact O-N 3.03Å
162	L	97.7	Very high	96.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-81.7	-17.5	179.1	-67.1	166.9	0	0	0	112.7	L135 V138 F139 C158 V159 S164 S165 F166 I169 F190	L135-L162 HydrophobicContact CB-CD2 4.06Å; L135-L162 HydrophobicContact CD2-CD2 4.21Å; L135-L162 WeakPolarHBondContact O-CD2 3.15Å; V138-L162 HydrophobicContact CB-CD2 4.38Å; V138-L162 HydrophobicContact CG1-CD1 4.23Å; V138-L162 HydrophobicContact CG1-CD2 4.24Å; V138-L162 HydrophobicContact CG1-CG 3.98Å; F139-L162 HydrophobicContact CB-CD1 4.36Å; F139-L162 HydrophobicContact CB-CD2 4.3Å; F139-L162 HydrophobicContact CD2-CD1 4.11Å; C158-L162 WeakPolarHBondContact O-CB 3.48Å; C158-L162 WeakPolarHBondContact O-CD1 3.39Å; C158-L162 VanDerWaalsContact O-CG 3.23Å; C158-L162 WeakPolarHBondContact O-CG 3.3Å; C158-L162 PolarHBondContact O-N 2.99Å; V159-L162 PolarHBondContact O-N 3.32Å; L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.77Å; L162-S165 PolarHBondContact O-N 2.84Å; L162-F166 PolarHBondContact O-N 3.11Å; L162-I169 HydrophobicContact CB-CD1 4.01Å; L162-I169 HydrophobicContact CD2-CD1 3.95Å; L162-I169 HydrophobicContact CG-CD1 4.48Å; L162-F190 HydrophobicContact CB-CE1 4.15Å; L162-F190 HydrophobicContact CD1-CE1 3.82Å; L162-F190 HydrophobicContact CD1-CZ 3.75Å
163	A	98.2	Very high	96.3	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-60.6	-38.2	-169.7	0	0	0	0	0	113.6	V159 D160 S165 F166 E195 L196 V197	V159-A163 WeakPolarHBondContact O-CB 3.38Å; V159-A163 PolarHBondContact O-N 3.26Å; D160-A163 WeakPolarHBondContact O-CB 3.49Å; D160-A163 PolarHBondContact O-N 3.45Å; A163-S165 VanDerWaalsContact C-N 3.31Å; A163-S165 PolarHBondContact O-N 3.08Å; A163-F166 VanDerWaalsContact O-CB 3.3Å; A163-F166 WeakPolarHBondContact O-CB 3.41Å; A163-F166 PolarHBondContact O-N 2.69Å; A163-E195 HydrophobicContact CB-CB 3.9Å; A163-E195 WeakPolarHBondContact CB-O 3.42Å; A163-L196 HydrophobicContact CB-CD2 4.24Å; A163-V197 WeakPolarHBondContact O-CB 3.5Å; A163-V197 PolarHBondContact O-N 2.73Å
164	S	95.4	Very high	96.2	Very high	80 Å²	80	40.3 Å²	40.3	56%	0.559	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-33.4	-176.4	59.1	0	0	0	0	113.6	L162	L162-S164 VanDerWaalsContact C-N 3.34Å; L162-S164 PolarHBondContact O-N 2.77Å
165	S	95.1	Very high	96.1	Very high	27 Å²	27	41.1 Å²	41.1	19%	0.189	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	17.2	-180	-61.3	0	0	0	0	111.9	L162 A163 H167 E168 I169	L162-S165 PolarHBondContact O-N 2.84Å; A163-S165 VanDerWaalsContact C-N 3.31Å; A163-S165 PolarHBondContact O-N 3.08Å; S165-H167 VanDerWaalsContact C-N 3.25Å; S165-H167 PolarHBondContact O-N 2.8Å; S165-E168 WeakPolarHBondContact O-CB 3.15Å; S165-E168 PolarHBondContact O-N 2.79Å; S165-I169 PolarHBondContact O-N 2.83Å
166	F	97.8	Very high	95.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-31.1	-173.6	-167.1	-107.1	0	0	0	113.1	L162 A163 E168 I169 V170 W179 F190 L196 V198 L204	L162-F166 PolarHBondContact O-N 3.11Å; A163-F166 VanDerWaalsContact O-CB 3.3Å; A163-F166 WeakPolarHBondContact O-CB 3.41Å; A163-F166 PolarHBondContact O-N 2.69Å; F166-E168 PolarHBondContact O-N 3.21Å; F166-I169 HydrophobicContact CD2-CB 4.32Å; F166-I169 HydrophobicContact CD2-CD1 4.12Å; F166-I169 HydrophobicContact CE2-CG2 4.48Å; F166-I169 WeakPolarHBondContact O-CB 3.38Å; F166-I169 PolarHBondContact O-N 3.29Å; F166-I169 VanDerWaalsContact O-N 3.13Å; F166-V170 HydrophobicContact CD1-CG1 3.94Å; F166-V170 HydrophobicContact CE1-CG1 3.47Å; F166-V170 VanDerWaalsContact CE1-CG1 3.47Å; F166-V170 HydrophobicContact CE2-CG1 4.25Å; F166-V170 HydrophobicContact CZ-CG1 3.65Å; F166-V170 WeakPolarHBondContact O-CG2 3.4Å; F166-V170 PolarHBondContact O-N 3.21Å; F166-W179 AromaticContact CE2-CZ3 3.98Å; F166-W179 HydrophobicContact CE2-CZ3 3.98Å; F166-W179 AromaticContact CZ-CH2 3.85Å; F166-W179 HydrophobicContact CZ-CH2 3.85Å; F166-W179 AromaticContact CZ-CZ3 3.57Å; F166-W179 HydrophobicContact CZ-CZ3 3.57Å; F166-F190 AromaticContact CD2-CD1 3.88Å; F166-F190 HydrophobicContact CD2-CD1 3.88Å; F166-F190 HydrophobicContact CD2-CE1 4.08Å; F166-F190 HydrophobicContact CE2-CB 3.94Å; F166-F190 AromaticContact CE2-CD1 3.27Å; F166-F190 HydrophobicContact CE2-CD1 3.27Å; F166-F190 HydrophobicContact CE2-CD2 4.14Å; F166-F190 AromaticContact CE2-CE1 3.71Å; F166-F190 HydrophobicContact CE2-CE1 3.71Å; F166-F190 HydrophobicContact CE2-CE2 4.49Å; F166-F190 AromaticContact CE2-CG 3.53Å; F166-F190 HydrophobicContact CE2-CG 3.53Å; F166-F190 HydrophobicContact CE2-CZ 4.31Å; F166-F190 HydrophobicContact CZ-CB 3.79Å; F166-F190 HydrophobicContact CZ-CD1 4.02Å; F166-F190 AromaticContact CZ-CG 3.89Å; F166-F190 HydrophobicContact CZ-CG 3.89Å; F166-L196 HydrophobicContact CB-CB 4.48Å; F166-L196 HydrophobicContact CB-CD2 4.33Å; F166-L196 HydrophobicContact CD1-CB 3.88Å; F166-L196 HydrophobicContact CD1-CD1 3.71Å; F166-L196 HydrophobicContact CD1-CD2 4.04Å; F166-L196 HydrophobicContact CD1-CG 4.07Å; F166-L196 HydrophobicContact CD2-CD2 3.99Å; F166-L196 HydrophobicContact CE1-CB 4.44Å; F166-L196 HydrophobicContact CE1-CD1 3.41Å; F166-L196 VanDerWaalsContact CE1-CD1 3.41Å; F166-L196 HydrophobicContact CE1-CD2 4.33Å; F166-L196 HydrophobicContact CE1-CG 4.25Å; F166-L196 HydrophobicContact CE2-CD2 4.31Å; F166-L196 HydrophobicContact CG-CB 4.29Å; F166-L196 HydrophobicContact CG-CD1 4.37Å; F166-L196 HydrophobicContact CG-CD2 3.85Å; F166-L196 HydrophobicContact CG-CG 4.38Å; F166-L196 HydrophobicContact CZ-CD1 3.86Å; F166-L196 HydrophobicContact CZ-CD2 4.46Å; F166-V198 HydrophobicContact CD1-CG1 3.61Å; F166-V198 HydrophobicContact CE1-CG1 4.2Å; F166-L204 HydrophobicContact CE1-CD1 3.82Å
167	H	95.6	Very high	95.8	Very high	82 Å²	82	49.6 Å²	49.6	38%	0.38	27%	0.271	S	S	.	.	H	α-helix	trans	-52.2	-41	169.4	160.8	-90.4	0	0	0	112.9	S165 V170 S171 V197	S165-H167 VanDerWaalsContact C-N 3.25Å; S165-H167 PolarHBondContact O-N 2.8Å; H167-V170 WeakPolarHBondContact O-CG2 3.45Å; H167-S171 VanDerWaalsContact O-CB 3.23Å; H167-S171 WeakPolarHBondContact O-CB 3.26Å; H167-S171 PolarHBondContact O-N 3.15Å; H167-S171 VanDerWaalsContact O-N 3.16Å; H167-S171 PolarHBondContact O-OG 2.84Å; H167-V197 PolarHBondContact N-O 3.3Å
168	E	94.5	Very high	95.7	Very high	98 Å²	98	49.4 Å²	49.4	46%	0.458	27%	0.266	S	S	.	.	H	α-helix	trans	-70.7	-41	178.3	-62.5	172.6	-162.1	0	0	110.7	S165 F166 V170 S171 S172	S165-E168 WeakPolarHBondContact O-CB 3.15Å; S165-E168 PolarHBondContact O-N 2.79Å; F166-E168 PolarHBondContact O-N 3.21Å; E168-V170 VanDerWaalsContact C-N 3.27Å; E168-V170 PolarHBondContact O-N 3.27Å; E168-S171 PolarHBondContact O-N 3.4Å; E168-S172 VanDerWaalsContact O-CB 3.26Å; E168-S172 WeakPolarHBondContact O-CB 3.32Å; E168-S172 PolarHBondContact O-N 2.77Å; E168-S172 PolarHBondContact O-OG 3.29Å
169	I	96.3	Very high	95.6	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-40.1	178.7	-60.9	175.6	0	0	0	111.2	L162 S165 F166 W175 W179	L162-I169 HydrophobicContact CB-CD1 4.01Å; L162-I169 HydrophobicContact CD2-CD1 3.95Å; L162-I169 HydrophobicContact CG-CD1 4.48Å; S165-I169 PolarHBondContact O-N 2.83Å; F166-I169 HydrophobicContact CD2-CB 4.32Å; F166-I169 HydrophobicContact CD2-CD1 4.12Å; F166-I169 HydrophobicContact CE2-CG2 4.48Å; F166-I169 WeakPolarHBondContact O-CB 3.38Å; F166-I169 PolarHBondContact O-N 3.29Å; F166-I169 VanDerWaalsContact O-N 3.13Å; I169-W175 HydrophobicContact CB-CD2 4.36Å; I169-W175 HydrophobicContact CB-CG 4.41Å; I169-W175 HydrophobicContact CG1-CD2 3.89Å; I169-W175 HydrophobicContact CG1-CE3 4.1Å; I169-W175 HydrophobicContact CG1-CG 4.3Å; I169-W175 HydrophobicContact CG1-CH2 4.42Å; I169-W175 HydrophobicContact CG1-CZ2 4.25Å; I169-W175 HydrophobicContact CG1-CZ3 4.35Å; I169-W175 HydrophobicContact CG2-CD2 4.42Å; I169-W175 HydrophobicContact CG2-CE3 4.13Å; I169-W175 WeakPolarHBondContact O-CB 3.44Å; I169-W179 HydrophobicContact CG2-CE3 4.09Å
170	V	95.3	Very high	95.5	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-88.2	-17	-176.9	-57	0	0	0	0	114.6	F166 H167 E168 W179 L204 A207 R210	F166-V170 HydrophobicContact CD1-CG1 3.94Å; F166-V170 HydrophobicContact CE1-CG1 3.47Å; F166-V170 VanDerWaalsContact CE1-CG1 3.47Å; F166-V170 HydrophobicContact CE2-CG1 4.25Å; F166-V170 HydrophobicContact CZ-CG1 3.65Å; F166-V170 WeakPolarHBondContact O-CG2 3.4Å; F166-V170 PolarHBondContact O-N 3.21Å; H167-V170 WeakPolarHBondContact O-CG2 3.45Å; E168-V170 VanDerWaalsContact C-N 3.27Å; E168-V170 PolarHBondContact O-N 3.27Å; V170-W179 HydrophobicContact CB-CZ2 4.47Å; V170-W179 HydrophobicContact CG1-CD2 4.16Å; V170-W179 HydrophobicContact CG1-CE3 3.86Å; V170-W179 HydrophobicContact CG1-CH2 3.56Å; V170-W179 HydrophobicContact CG1-CZ2 3.86Å; V170-W179 HydrophobicContact CG1-CZ3 3.57Å; V170-L204 HydrophobicContact CG1-CD1 4.39Å; V170-A207 HydrophobicContact CB-CB 3.74Å; V170-A207 HydrophobicContact CG1-CB 4.43Å; V170-A207 HydrophobicContact CG2-CB 4.4Å; V170-R210 PolarHBondContact O-NH2 2.99Å
171	S	91.6	Very high	95.3	Very high	67 Å²	67	51.6 Å²	51.6	47%	0.469	28%	0.284	S	S	.	.	H	α-helix	trans	-122	-25.3	-170.3	-49.9	0	0	0	0	114.7	H167 E168	H167-S171 VanDerWaalsContact O-CB 3.23Å; H167-S171 WeakPolarHBondContact O-CB 3.26Å; H167-S171 PolarHBondContact O-N 3.15Å; H167-S171 VanDerWaalsContact O-N 3.16Å; H167-S171 PolarHBondContact O-OG 2.84Å; E168-S171 PolarHBondContact O-N 3.4Å
172	S	93.2	Very high	95.3	Very high	37 Å²	37	50.1 Å²	50.1	26%	0.259	27%	0.273	S	S	.	.			trans	-83.8	149.4	-175.1	95.1	0	0	0	0	112.1	E168 D174 W175 E176	E168-S172 VanDerWaalsContact O-CB 3.26Å; E168-S172 WeakPolarHBondContact O-CB 3.32Å; E168-S172 PolarHBondContact O-N 2.77Å; E168-S172 PolarHBondContact O-OG 3.29Å; S172-D174 PolarHBondContact O-N 3.49Å; S172-D174 PolarHBondContact OG-N 2.76Å; S172-W175 PolarHBondContact O-N 3.06Å; S172-W175 PolarHBondContact OG-N 3.24Å; S172-E176 PolarHBondContact O-N 3.05Å
173	S	94.1	Very high	95.1	Very high	93 Å²	93	53 Å²	53	65%	0.65	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-62.6	-29.8	173.8	50.8	0	0	0	0	112.5	W175 E176	S173-W175 PolarHBondContact O-N 3.47Å; S173-E176 PolarHBondContact O-N 3.22Å
174	D	93.8	Very high	94.8	Very high	122 Å²	122	55.6 Å²	55.6	65%	0.652	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-70.2	-17.9	-176.8	-60.2	-21.1	0	0	0	112.8	K136 S172	K136-D174 PolarHBondContact NZ-O 3.34Å; S172-D174 PolarHBondContact O-N 3.49Å; S172-D174 PolarHBondContact OG-N 2.76Å
175	W	96.5	Very high	94.8	Very high	16 Å²	16	56.1 Å²	56.1	6%	0.061	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-113	-0.3	177.5	-73.5	97.8	0	0	0	113.4	L135 K136 F139 I169 S172 S173 R177 E178 W179	L135-W175 HydrophobicContact CB-CH2 4.22Å; L135-W175 HydrophobicContact CB-CZ2 4.04Å; K136-W175 HydrophobicContact CD-CD2 4.42Å; K136-W175 HydrophobicContact CD-CE3 4.25Å; K136-W175 HydrophobicContact CD-CH2 3.57Å; K136-W175 HydrophobicContact CD-CZ2 3.73Å; K136-W175 HydrophobicContact CD-CZ3 3.84Å; K136-W175 HydrophobicContact CG-CH2 4Å; K136-W175 HydrophobicContact CG-CZ2 3.96Å; K136-W175 VanDerWaalsContact NZ-CD2 3.3Å; F139-W175 HydrophobicContact CB-CH2 4.08Å; F139-W175 HydrophobicContact CB-CZ3 3.84Å; F139-W175 HydrophobicContact CD1-CZ3 4.21Å; F139-W175 HydrophobicContact CD2-CZ3 4.02Å; F139-W175 HydrophobicContact CG-CH2 4.49Å; F139-W175 AromaticContact CG-CZ3 3.77Å; F139-W175 HydrophobicContact CG-CZ3 3.77Å; I169-W175 HydrophobicContact CB-CD2 4.36Å; I169-W175 HydrophobicContact CB-CG 4.41Å; I169-W175 HydrophobicContact CG1-CD2 3.89Å; I169-W175 HydrophobicContact CG1-CE3 4.1Å; I169-W175 HydrophobicContact CG1-CG 4.3Å; I169-W175 HydrophobicContact CG1-CH2 4.42Å; I169-W175 HydrophobicContact CG1-CZ2 4.25Å; I169-W175 HydrophobicContact CG1-CZ3 4.35Å; I169-W175 HydrophobicContact CG2-CD2 4.42Å; I169-W175 HydrophobicContact CG2-CE3 4.13Å; I169-W175 WeakPolarHBondContact O-CB 3.44Å; S172-W175 PolarHBondContact O-N 3.06Å; S172-W175 PolarHBondContact OG-N 3.24Å; S173-W175 PolarHBondContact O-N 3.47Å; W175-R177 VanDerWaalsContact C-N 3.31Å; W175-R177 PolarHBondContact O-N 2.84Å; W175-E178 HydrophobicContact CE3-CB 3.9Å; W175-E178 HydrophobicContact CE3-CG 4.12Å; W175-E178 HydrophobicContact CZ3-CB 4.47Å; W175-E178 HydrophobicContact CZ3-CG 4.43Å; W175-E178 PolarHBondContact O-N 3.46Å; W175-W179 WeakPolarHBondContact O-CB 3.37Å; W175-W179 PolarHBondContact O-N 3.21Å
176	E	95.3	Very high	94.9	Very high	92 Å²	92	55.4 Å²	55.4	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-59.4	-42.8	-173.9	-178.3	168.8	-147.4	0	0	112	S172 S173 L180	S172-E176 PolarHBondContact O-N 3.05Å; S173-E176 PolarHBondContact O-N 3.22Å; E176-L180 HydrophobicContact CG-CD1 3.8Å; E176-L180 HydrophobicContact CG-CG 4.29Å; E176-L180 VanDerWaalsContact O-CB 3.32Å; E176-L180 WeakPolarHBondContact O-CB 3.4Å; E176-L180 WeakPolarHBondContact O-CG 3.33Å; E176-L180 PolarHBondContact O-N 3.21Å
177	R	94.4	Very high	94.9	Very high	196 Å²	196	55.4 Å²	55.4	74%	0.74	29%	0.286	S	S	*	.	H	α-helix	trans	-61.8	-48.5	178.3	-171.3	-172.6	-57.6	114.8	2	110.8	W175 S181	W175-R177 VanDerWaalsContact C-N 3.31Å; W175-R177 PolarHBondContact O-N 2.84Å; R177-S181 WeakPolarHBondContact O-CB 3.45Å; R177-S181 PolarHBondContact O-N 2.94Å; R177-S181 PolarHBondContact O-OG 3.11Å; R177-S181 VanDerWaalsContact O-OG 3.11Å
178	E	94.6	Very high	95	Very high	16 Å²	16	52 Å²	52	8%	0.075	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-51.8	179.3	-74.7	87.8	160.5	0	0	111.8	K136 F139 H140 W175 L180 S181 L182	K136-E178 IonicContact NZ-OE1 2.78Å; K136-E178 PolarHBondContact NZ-OE1 2.82Å; K136-E178 IonicContact NZ-OE2 2.67Å; K136-E178 PolarHBondContact NZ-OE2 2.96Å; F139-E178 HydrophobicContact CD1-CB 4.29Å; F139-E178 HydrophobicContact CD1-CG 4.1Å; F139-E178 HydrophobicContact CE1-CB 3.6Å; F139-E178 HydrophobicContact CE1-CG 3.77Å; F139-E178 HydrophobicContact CZ-CB 3.82Å; F139-E178 HydrophobicContact CZ-CG 4.47Å; H140-E178 WeakPolarHBondContact CE1-CG 3.43Å; H140-E178 IonicContact CE1-OE1 2.65Å; H140-E178 VanDerWaalsContact NE2-CG 3.32Å; H140-E178 WeakPolarHBondContact NE2-CG 3.24Å; H140-E178 IonicContact NE2-OE1 2.66Å; H140-E178 PolarHBondContact NE2-OE1 2.87Å; W175-E178 HydrophobicContact CE3-CB 3.9Å; W175-E178 HydrophobicContact CE3-CG 4.12Å; W175-E178 HydrophobicContact CZ3-CB 4.47Å; W175-E178 HydrophobicContact CZ3-CG 4.43Å; W175-E178 PolarHBondContact O-N 3.46Å; E178-L180 PolarHBondContact O-N 2.91Å; E178-S181 WeakPolarHBondContact CA-OG 3.36Å; E178-S181 PolarHBondContact O-N 3.24Å; E178-S181 VanDerWaalsContact O-N 3.12Å; E178-S181 PolarHBondContact O-OG 3.36Å; E178-L182 PolarHBondContact O-N 2.78Å
179	W	96.6	Very high	95.1	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.7	-50.5	178.7	-179.5	-107.8	0	0	0	111.4	F166 I169 V170 W175 S181 L182 L187 A207 V208	F166-W179 AromaticContact CE2-CZ3 3.98Å; F166-W179 HydrophobicContact CE2-CZ3 3.98Å; F166-W179 AromaticContact CZ-CH2 3.85Å; F166-W179 HydrophobicContact CZ-CH2 3.85Å; F166-W179 AromaticContact CZ-CZ3 3.57Å; F166-W179 HydrophobicContact CZ-CZ3 3.57Å; I169-W179 HydrophobicContact CG2-CE3 4.09Å; V170-W179 HydrophobicContact CB-CZ2 4.47Å; V170-W179 HydrophobicContact CG1-CD2 4.16Å; V170-W179 HydrophobicContact CG1-CE3 3.86Å; V170-W179 HydrophobicContact CG1-CH2 3.56Å; V170-W179 HydrophobicContact CG1-CZ2 3.86Å; V170-W179 HydrophobicContact CG1-CZ3 3.57Å; W175-W179 WeakPolarHBondContact O-CB 3.37Å; W175-W179 PolarHBondContact O-N 3.21Å; W179-S181 PolarHBondContact O-N 3.46Å; W179-L182 HydrophobicContact CD2-CD1 4.3Å; W179-L182 HydrophobicContact CE3-CD1 3.55Å; W179-L182 HydrophobicContact CZ3-CD1 3.67Å; W179-L182 WeakPolarHBondContact O-CB 3.4Å; W179-L182 WeakPolarHBondContact O-CG 3.5Å; W179-L182 PolarHBondContact O-N 2.74Å; W179-L187 HydrophobicContact CH2-CD1 3.59Å; W179-L187 HydrophobicContact CZ2-CD1 3.99Å; W179-L187 HydrophobicContact CZ3-CD1 4.25Å; W179-A207 HydrophobicContact CZ2-CB 4.01Å; W179-A207 PolarHBondContact NE1-O 3.44Å; W179-V208 HydrophobicContact CZ2-CG2 4.34Å
180	L	95.4	Very high	95.2	Very high	34 Å²	34	49 Å²	49	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-71.9	-17.4	-178.9	-64.4	-177.2	0	0	0	113.7	E176 E178 R210 N214	E176-L180 HydrophobicContact CG-CD1 3.8Å; E176-L180 HydrophobicContact CG-CG 4.29Å; E176-L180 VanDerWaalsContact O-CB 3.32Å; E176-L180 WeakPolarHBondContact O-CB 3.4Å; E176-L180 WeakPolarHBondContact O-CG 3.33Å; E176-L180 PolarHBondContact O-N 3.21Å; E178-L180 PolarHBondContact O-N 2.91Å; L180-R210 HydrophobicContact CD2-CG 4.16Å; L180-N214 HydrophobicContact CD2-CB 3.94Å; L180-N214 PolarHBondContact O-ND2 3.47Å
181	S	93.2	Very high	95.4	Very high	76 Å²	76	48.9 Å²	48.9	53%	0.531	26%	0.256	S	S	.	.	H	α-helix	trans	-88.7	-7.7	177.4	71.4	0	0	0	0	114.3	R177 E178 W179 D183	R177-S181 WeakPolarHBondContact O-CB 3.45Å; R177-S181 PolarHBondContact O-N 2.94Å; R177-S181 PolarHBondContact O-OG 3.11Å; R177-S181 VanDerWaalsContact O-OG 3.11Å; E178-S181 WeakPolarHBondContact CA-OG 3.36Å; E178-S181 PolarHBondContact O-N 3.24Å; E178-S181 VanDerWaalsContact O-N 3.12Å; E178-S181 PolarHBondContact O-OG 3.36Å; W179-S181 PolarHBondContact O-N 3.46Å; S181-D183 PolarHBondContact O-N 2.75Å
182	L	95.8	Very high	95.7	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.042	25%	0.254	C	S	.	.			trans	-56.2	136.8	176.9	-71.5	178.6	0	0	0	111.1	F139 F143 E178 W179 Q186 L187 F190 W211	F139-L182 HydrophobicContact CE2-CD2 3.72Å; F139-L182 HydrophobicContact CZ-CD2 3.42Å; F139-L182 VanDerWaalsContact CZ-CD2 3.42Å; F139-L182 HydrophobicContact CZ-CG 4.19Å; F143-L182 HydrophobicContact CE1-CD2 4.1Å; E178-L182 PolarHBondContact O-N 2.78Å; W179-L182 HydrophobicContact CD2-CD1 4.3Å; W179-L182 HydrophobicContact CE3-CD1 3.55Å; W179-L182 HydrophobicContact CZ3-CD1 3.67Å; W179-L182 WeakPolarHBondContact O-CB 3.4Å; W179-L182 WeakPolarHBondContact O-CG 3.5Å; W179-L182 PolarHBondContact O-N 2.74Å; L182-Q186 HydrophobicContact CB-CB 4.5Å; L182-Q186 HydrophobicContact CD2-CB 3.87Å; L182-L187 HydrophobicContact CD1-CD1 4.49Å; L182-F190 HydrophobicContact CD1-CD2 4.05Å; L182-F190 HydrophobicContact CD1-CE2 4.02Å; L182-F190 HydrophobicContact CD2-CE2 4.13Å; L182-W211 WeakPolarHBondContact O-CZ2 3.41Å; L182-W211 PolarHBondContact O-NE1 3.23Å
183	D	93.4	Very high	95.9	Very high	61 Å²	61	49.2 Å²	49.2	33%	0.326	25%	0.246	S	C	.	.			trans	-77.4	172.4	165.6	70.4	40.7	0	0	0	111.5	S181 E185 Q186 L187	S181-D183 PolarHBondContact O-N 2.75Å; D183-E185 PolarHBondContact O-N 3.13Å; D183-E185 WeakPolarHBondContact OD1-CB 3.48Å; D183-E185 PolarHBondContact OD1-N 2.9Å; D183-Q186 PolarHBondContact O-N 3.11Å; D183-Q186 WeakPolarHBondContact OD1-CB 3.23Å; D183-Q186 VanDerWaalsContact OD1-CG 3.24Å; D183-Q186 WeakPolarHBondContact OD1-CG 3.45Å; D183-Q186 PolarHBondContact OD1-N 2.56Å; D183-L187 PolarHBondContact O-N 3.37Å
184	K	93.5	Very high	96	Very high	58 Å²	58	45.5 Å²	45.5	25%	0.252	22%	0.221	S	C	.	.	H	α-helix	trans	-63.4	-42.4	-176.3	-179.4	-153.4	72.6	-155.7	0	111.2	V188 W211 T232	K184-V188 WeakPolarHBondContact O-CB 3.32Å; K184-V188 VanDerWaalsContact O-CG2 3.22Å; K184-V188 WeakPolarHBondContact O-CG2 3.29Å; K184-V188 PolarHBondContact O-N 3.44Å; K184-V188 VanDerWaalsContact O-N 3.11Å; K184-W211 HydrophobicContact CB-CH2 4.31Å; K184-T232 HydrophobicContact CD-CG2 4.25Å
185	E	94.3	Very high	96.1	Very high	90 Å²	90	42.7 Å²	42.7	42%	0.421	20%	0.204	S	C	.	.	H	α-helix	trans	-62.8	-48.5	179.9	-74.2	67.9	-158.5	0	0	110.7	D183 L187 V188 E189	D183-E185 PolarHBondContact O-N 3.13Å; D183-E185 WeakPolarHBondContact OD1-CB 3.48Å; D183-E185 PolarHBondContact OD1-N 2.9Å; E185-L187 PolarHBondContact O-N 2.69Å; E185-V188 WeakPolarHBondContact O-CB 3.26Å; E185-V188 PolarHBondContact O-N 3Å; E185-E189 WeakPolarHBondContact O-CG 3.46Å; E185-E189 PolarHBondContact O-N 3.43Å
186	Q	97.1	Very high	96.2	Very high	13 Å²	13	42 Å²	42	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-45.7	177.6	-71.6	172.5	-27.4	0	0	112.5	F143 T147 L182 D183 V188 E189 F190	F143-Q186 HydrophobicContact CE1-CB 3.75Å; F143-Q186 HydrophobicContact CE1-CG 3.81Å; F143-Q186 HydrophobicContact CZ-CB 3.85Å; F143-Q186 HydrophobicContact CZ-CG 4.1Å; T147-Q186 HydrophobicContact CG2-CG 3.81Å; T147-Q186 WeakPolarHBondContact OG1-CG 3.34Å; T147-Q186 PolarHBondContact OG1-NE2 3.25Å; L182-Q186 HydrophobicContact CB-CB 4.5Å; L182-Q186 HydrophobicContact CD2-CB 3.87Å; D183-Q186 PolarHBondContact O-N 3.11Å; D183-Q186 WeakPolarHBondContact OD1-CB 3.23Å; D183-Q186 VanDerWaalsContact OD1-CG 3.24Å; D183-Q186 WeakPolarHBondContact OD1-CG 3.45Å; D183-Q186 PolarHBondContact OD1-N 2.56Å; Q186-V188 VanDerWaalsContact C-N 3.28Å; Q186-V188 PolarHBondContact O-N 3.36Å; Q186-E189 PolarHBondContact O-N 3.17Å; Q186-F190 WeakPolarHBondContact O-CD2 3.37Å; Q186-F190 PolarHBondContact O-N 3.42Å
187	L	97.7	Very high	96.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-58.6	-43.9	176.1	178.1	64.9	0	0	0	111.1	W179 L182 D183 E185 E189 F190 L191 V208 W211 I233	W179-L187 HydrophobicContact CH2-CD1 3.59Å; W179-L187 HydrophobicContact CZ2-CD1 3.99Å; W179-L187 HydrophobicContact CZ3-CD1 4.25Å; L182-L187 HydrophobicContact CD1-CD1 4.49Å; D183-L187 PolarHBondContact O-N 3.37Å; E185-L187 PolarHBondContact O-N 2.69Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 2.77Å; L187-F190 PolarHBondContact O-N 2.62Å; L187-L191 HydrophobicContact CD1-CD1 4.23Å; L187-L191 HydrophobicContact CD1-CG 4.24Å; L187-L191 HydrophobicContact CD2-CD1 4.42Å; L187-L191 HydrophobicContact CG-CD1 3.96Å; L187-L191 HydrophobicContact CG-CG 4.32Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 3.02Å; L187-V208 HydrophobicContact CD1-CG2 4.4Å; L187-W211 HydrophobicContact CB-CZ2 4.45Å; L187-W211 HydrophobicContact CD2-CD2 3.59Å; L187-W211 HydrophobicContact CD2-CE3 3.4Å; L187-W211 HydrophobicContact CD2-CG 4.27Å; L187-W211 HydrophobicContact CD2-CH2 3.96Å; L187-W211 HydrophobicContact CD2-CZ2 4.11Å; L187-W211 HydrophobicContact CD2-CZ3 3.62Å; L187-I233 HydrophobicContact CD2-CD1 3.7Å; L187-I233 HydrophobicContact CD2-CG1 4.28Å
188	V	97.8	Very high	96.5	Very high	10 Å²	10	30 Å²	30	6%	0.061	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-39.3	179.4	164.5	0	0	0	0	111.7	K184 E185 Q186 F190 L191 K192 T232	K184-V188 WeakPolarHBondContact O-CB 3.32Å; K184-V188 VanDerWaalsContact O-CG2 3.22Å; K184-V188 WeakPolarHBondContact O-CG2 3.29Å; K184-V188 PolarHBondContact O-N 3.44Å; K184-V188 VanDerWaalsContact O-N 3.11Å; E185-V188 WeakPolarHBondContact O-CB 3.26Å; E185-V188 PolarHBondContact O-N 3Å; Q186-V188 VanDerWaalsContact C-N 3.28Å; Q186-V188 PolarHBondContact O-N 3.36Å; V188-F190 PolarHBondContact O-N 3.45Å; V188-L191 PolarHBondContact O-N 2.9Å; V188-K192 HydrophobicContact CG1-CD 4.15Å; V188-K192 VanDerWaalsContact CG1-CE 3.48Å; V188-K192 HydrophobicContact CG1-CG 4.37Å; V188-K192 WeakPolarHBondContact O-CG 3.17Å; V188-K192 PolarHBondContact O-N 3.31Å; V188-T232 HydrophobicContact CG2-CG2 3.81Å
189	E	97.9	Very high	96.6	Very high	36 Å²	36	31.9 Å²	31.9	17%	0.168	17%	0.167	C	C	.	.	H	α-helix	trans	-62.1	-40.6	177.3	-66	-53.9	138.9	0	0	112.6	F143 V155 V159 E185 Q186 L187 K192	F143-E189 HydrophobicContact CE2-CB 4.38Å; V155-E189 HydrophobicContact CG1-CB 3.84Å; V155-E189 HydrophobicContact CG1-CG 3.67Å; V159-E189 HydrophobicContact CG2-CB 4.38Å; E185-E189 WeakPolarHBondContact O-CG 3.46Å; E185-E189 PolarHBondContact O-N 3.43Å; Q186-E189 PolarHBondContact O-N 3.17Å; L187-E189 VanDerWaalsContact C-N 3.32Å; L187-E189 PolarHBondContact O-N 2.77Å; E189-K192 IonicContact OE1-NZ 3.38Å; E189-K192 PolarHBondContact OE1-NZ 2.91Å; E189-K192 IonicContact OE2-NZ 2.68Å
190	F	98.4	Very high	96.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-61.6	-52.3	169.7	-74.3	-62.8	0	0	0	111.5	F139 F143 V159 L162 F166 L182 Q186 L187 V188 K192 S193 L196	F139-F190 HydrophobicContact CD2-CZ 4.2Å; F139-F190 HydrophobicContact CE2-CE2 4.1Å; F139-F190 HydrophobicContact CE2-CZ 4.1Å; F143-F190 HydrophobicContact CD1-CE2 4.26Å; F143-F190 HydrophobicContact CD1-CZ 4.21Å; F143-F190 HydrophobicContact CE1-CD2 4.28Å; F143-F190 AromaticContact CE1-CE2 3.4Å; F143-F190 HydrophobicContact CE1-CE2 3.4Å; F143-F190 AromaticContact CE1-CZ 3.74Å; F143-F190 HydrophobicContact CE1-CZ 3.74Å; F143-F190 HydrophobicContact CE2-CE2 4.32Å; F143-F190 HydrophobicContact CE2-CZ 4.26Å; F143-F190 AromaticContact CZ-CD2 3.94Å; F143-F190 HydrophobicContact CZ-CD2 3.94Å; F143-F190 AromaticContact CZ-CE2 3.43Å; F143-F190 HydrophobicContact CZ-CE2 3.43Å; F143-F190 VanDerWaalsContact CZ-CE2 3.43Å; F143-F190 AromaticContact CZ-CZ 3.77Å; F143-F190 HydrophobicContact CZ-CZ 3.77Å; V159-F190 HydrophobicContact CB-CD1 4.49Å; V159-F190 HydrophobicContact CG1-CD1 4.06Å; V159-F190 HydrophobicContact CG2-CD1 4Å; V159-F190 HydrophobicContact CG2-CE1 4.09Å; L162-F190 HydrophobicContact CB-CE1 4.15Å; L162-F190 HydrophobicContact CD1-CE1 3.82Å; L162-F190 HydrophobicContact CD1-CZ 3.75Å; F166-F190 AromaticContact CD2-CD1 3.88Å; F166-F190 HydrophobicContact CD2-CD1 3.88Å; F166-F190 HydrophobicContact CD2-CE1 4.08Å; F166-F190 HydrophobicContact CE2-CB 3.94Å; F166-F190 AromaticContact CE2-CD1 3.27Å; F166-F190 HydrophobicContact CE2-CD1 3.27Å; F166-F190 HydrophobicContact CE2-CD2 4.14Å; F166-F190 AromaticContact CE2-CE1 3.71Å; F166-F190 HydrophobicContact CE2-CE1 3.71Å; F166-F190 HydrophobicContact CE2-CE2 4.49Å; F166-F190 AromaticContact CE2-CG 3.53Å; F166-F190 HydrophobicContact CE2-CG 3.53Å; F166-F190 HydrophobicContact CE2-CZ 4.31Å; F166-F190 HydrophobicContact CZ-CB 3.79Å; F166-F190 HydrophobicContact CZ-CD1 4.02Å; F166-F190 AromaticContact CZ-CG 3.89Å; F166-F190 HydrophobicContact CZ-CG 3.89Å; L182-F190 HydrophobicContact CD1-CD2 4.05Å; L182-F190 HydrophobicContact CD1-CE2 4.02Å; L182-F190 HydrophobicContact CD2-CE2 4.13Å; Q186-F190 WeakPolarHBondContact O-CD2 3.37Å; Q186-F190 PolarHBondContact O-N 3.42Å; L187-F190 PolarHBondContact O-N 2.62Å; V188-F190 PolarHBondContact O-N 3.45Å; F190-K192 PolarHBondContact O-N 2.86Å; F190-K192 VanDerWaalsContact O-N 3.17Å; F190-S193 PolarHBondContact O-N 3.5Å; F190-L196 HydrophobicContact CB-CD1 4.35Å; F190-L196 HydrophobicContact CD1-CD2 4.22Å; F190-L196 WeakPolarHBondContact O-CD1 3.32Å
191	L	98.4	Very high	96.7	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-64.6	-23.6	-173.9	-63.9	179.8	0	0	0	113.4	L187 V188 S193 L204 V208 I233 H236 M237 R295	L187-L191 HydrophobicContact CD1-CD1 4.23Å; L187-L191 HydrophobicContact CD1-CG 4.24Å; L187-L191 HydrophobicContact CD2-CD1 4.42Å; L187-L191 HydrophobicContact CG-CD1 3.96Å; L187-L191 HydrophobicContact CG-CG 4.32Å; L187-L191 WeakPolarHBondContact O-CG 3.4Å; L187-L191 PolarHBondContact O-N 3.02Å; V188-L191 PolarHBondContact O-N 2.9Å; L191-S193 VanDerWaalsContact C-N 3.35Å; L191-L204 HydrophobicContact CD2-CD1 4.05Å; L191-L204 HydrophobicContact CD2-CD2 3.94Å; L191-L204 HydrophobicContact CD2-CG 4.13Å; L191-V208 HydrophobicContact CD1-CG2 4.12Å; L191-V208 HydrophobicContact CD2-CG2 3.88Å; L191-I233 HydrophobicContact CD1-CG2 3.88Å; L191-H236 HydrophobicContact CB-CB 3.63Å; L191-H236 HydrophobicContact CD1-CB 4.49Å; L191-M237 HydrophobicContact CD1-SD 4.03Å; L191-M237 HydrophobicContact CD2-SD 4.06Å; L191-R295 VanDerWaalsContact O-CZ 3.25Å; L191-R295 PolarHBondContact O-NH1 3.38Å; L191-R295 PolarHBondContact O-NH2 3.36Å
192	K	97.2	Very high	96.9	Very high	96 Å²	96	28.7 Å²	28.7	42%	0.417	14%	0.141	S	C	.	.	H	α-helix	trans	-65.2	-35.2	171.2	-75.2	167.2	179.1	170.3	0	112.8	V188 E189 F190 S194 R238	V188-K192 HydrophobicContact CG1-CD 4.15Å; V188-K192 VanDerWaalsContact CG1-CE 3.48Å; V188-K192 HydrophobicContact CG1-CG 4.37Å; V188-K192 WeakPolarHBondContact O-CG 3.17Å; V188-K192 PolarHBondContact O-N 3.31Å; E189-K192 IonicContact OE1-NZ 3.38Å; E189-K192 PolarHBondContact OE1-NZ 2.91Å; E189-K192 IonicContact OE2-NZ 2.68Å; F190-K192 PolarHBondContact O-N 2.86Å; F190-K192 VanDerWaalsContact O-N 3.17Å; K192-S194 PolarHBondContact O-N 2.98Å; K192-R238 PolarHBondContact O-NH2 2.89Å
193	S	97.4	Very high	97	Very high	15 Å²	15	30.5 Å²	30.5	11%	0.105	15%	0.151	C	C	.	.			trans	-73.8	127.6	-169.3	-178.2	0	0	0	0	113.9	F190 L191 E195 R238 R295	F190-S193 PolarHBondContact O-N 3.5Å; L191-S193 VanDerWaalsContact C-N 3.35Å; S193-E195 PolarHBondContact OG-N 2.93Å; S193-E195 VanDerWaalsContact OG-N 3.09Å; S193-R238 PolarHBondContact O-NH2 2.98Å; S193-R295 PolarHBondContact O-NH1 3.14Å
194	S	96.9	Very high	97.3	Very high	16 Å²	16	27.6 Å²	27.6	11%	0.112	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-8.4	169.5	-66.7	0	0	0	0	113.4	K192 L196 R238 R295	K192-S194 PolarHBondContact O-N 2.98Å; S194-L196 VanDerWaalsContact C-N 3.32Å; S194-R238 VanDerWaalsContact CA-NH2 3.28Å; S194-R238 PolarHBondContact OG-NH1 3.44Å; S194-R238 PolarHBondContact OG-NH2 3.46Å; S194-R295 WeakPolarHBondContact O-CA 3.24Å
195	E	96.8	Very high	97.5	Very high	63 Å²	63	24.9 Å²	24.9	29%	0.294	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-15.9	-179.3	-57.8	-48	139.4	0	0	113.2	A163 S193 V197 N296 R305	A163-E195 HydrophobicContact CB-CB 3.9Å; A163-E195 WeakPolarHBondContact CB-O 3.42Å; S193-E195 PolarHBondContact OG-N 2.93Å; S193-E195 VanDerWaalsContact OG-N 3.09Å; E195-V197 PolarHBondContact O-N 3.17Å; E195-N296 WeakPolarHBondContact CA-ND2 3.14Å; E195-N296 PolarHBondContact O-ND2 3.2Å; E195-R305 IonicContact OE1-CZ 2.82Å; E195-R305 IonicContact OE1-NH1 3.59Å; E195-R305 PolarHBondContact OE1-NH1 3.01Å; E195-R305 IonicContact OE1-NH2 2.78Å; E195-R305 PolarHBondContact OE1-NH2 2.75Å; E195-R305 IonicContact OE2-CZ 3.15Å; E195-R305 IonicContact OE2-NH1 3.65Å; E195-R305 PolarHBondContact OE2-NH1 3.46Å; E195-R305 IonicContact OE2-NH2 3.63Å
196	L	98.4	Very high	97.7	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.			trans	-54.9	124	-178.5	-56.3	-173.7	0	0	0	111.7	V159 A163 F166 F190 S194 V198 N296	V159-L196 HydrophobicContact CG1-CD2 4.11Å; A163-L196 HydrophobicContact CB-CD2 4.24Å; F166-L196 HydrophobicContact CB-CB 4.48Å; F166-L196 HydrophobicContact CB-CD2 4.33Å; F166-L196 HydrophobicContact CD1-CB 3.88Å; F166-L196 HydrophobicContact CD1-CD1 3.71Å; F166-L196 HydrophobicContact CD1-CD2 4.04Å; F166-L196 HydrophobicContact CD1-CG 4.07Å; F166-L196 HydrophobicContact CD2-CD2 3.99Å; F166-L196 HydrophobicContact CE1-CB 4.44Å; F166-L196 HydrophobicContact CE1-CD1 3.41Å; F166-L196 VanDerWaalsContact CE1-CD1 3.41Å; F166-L196 HydrophobicContact CE1-CD2 4.33Å; F166-L196 HydrophobicContact CE1-CG 4.25Å; F166-L196 HydrophobicContact CE2-CD2 4.31Å; F166-L196 HydrophobicContact CG-CB 4.29Å; F166-L196 HydrophobicContact CG-CD1 4.37Å; F166-L196 HydrophobicContact CG-CD2 3.85Å; F166-L196 HydrophobicContact CG-CG 4.38Å; F166-L196 HydrophobicContact CZ-CD1 3.86Å; F166-L196 HydrophobicContact CZ-CD2 4.46Å; F190-L196 HydrophobicContact CB-CD1 4.35Å; F190-L196 HydrophobicContact CD1-CD2 4.22Å; F190-L196 WeakPolarHBondContact O-CD1 3.32Å; S194-L196 VanDerWaalsContact C-N 3.32Å; L196-V198 HydrophobicContact CB-CG1 4.39Å; L196-N296 PolarHBondContact O-N 3.17Å; L196-N296 VanDerWaalsContact O-N 3.09Å
197	V	98.3	Very high	97.7	Very high	37 Å²	37	23.3 Å²	23.3	22%	0.224	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	111.3	172.4	-177.7	0	0	0	0	108.7	A163 H167 E195 N296 T298	A163-V197 WeakPolarHBondContact O-CB 3.5Å; A163-V197 PolarHBondContact O-N 2.73Å; H167-V197 PolarHBondContact N-O 3.3Å; E195-V197 PolarHBondContact O-N 3.17Å; V197-N296 VanDerWaalsContact CA-O 3.31Å; V197-N296 WeakPolarHBondContact CA-O 3.49Å; V197-N296 HydrophobicContact CB-CB 4.41Å; V197-N296 HydrophobicContact CG2-CB 3.81Å; V197-T298 HydrophobicContact CG1-CG2 3.5Å
198	V	97.7	Very high	97.7	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.006	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.9	-178.4	-63.9	0	0	0	0	110.7	F166 L196 N296 Y297 T298	F166-V198 HydrophobicContact CD1-CG1 3.61Å; F166-V198 HydrophobicContact CE1-CG1 4.2Å; L196-V198 HydrophobicContact CB-CG1 4.39Å; V198-N296 PolarHBondContact N-O 2.9Å; V198-N296 VanDerWaalsContact N-O 3.07Å; V198-Y297 HydrophobicContact CG2-CD1 3.65Å; V198-Y297 HydrophobicContact CG2-CE1 3.7Å; V198-Y297 CarbonylContact O-C 3.51Å; V198-Y297 VanDerWaalsContact O-CA 3.28Å; V198-Y297 WeakPolarHBondContact O-CA 3.42Å; V198-T298 PolarHBondContact O-N 2.64Å
199	N	96.1	Very high	97.7	Very high	55 Å²	55	24 Å²	24	29%	0.294	12%	0.121	S	C	.	.	S	Bend	trans	-63.2	-52	178	-174.4	58.6	0	0	0	111.7	D203 T298 R299	N199-D203 WeakPolarHBondContact CB-OD2 3.35Å; N199-D203 PolarHBondContact ND2-OD2 2.67Å; N199-T298 WeakPolarHBondContact CA-OG1 3.42Å; N199-T298 PolarHBondContact OD1-OG1 2.88Å; N199-R299 WeakPolarHBondContact O-CB 3.49Å; N199-R299 PolarHBondContact O-N 3.29Å; N199-R299 VanDerWaalsContact O-N 3.09Å
200	S	96.5	Very high	97.6	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.007	13%	0.127	C	C	.	.			trans	-152.3	164	172.7	70.4	0	0	0	0	110.6	Y202 D203 L204	S200-Y202 PolarHBondContact O-N 3.11Å; S200-Y202 PolarHBondContact OG-N 3.48Å; S200-D203 WeakPolarHBondContact CB-OD2 3.45Å; S200-D203 PolarHBondContact N-OD2 3.43Å; S200-D203 PolarHBondContact O-N 3.25Å; S200-D203 PolarHBondContact OG-N 3.06Å; S200-D203 PolarHBondContact OG-OD2 3.4Å; S200-L204 PolarHBondContact O-N 2.82Å; S200-L204 VanDerWaalsContact O-N 3.12Å
201	E	97.8	Very high	97.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.5	-30.1	172.5	-165.9	70.9	-168.8	0	0	111.6	L204 W205 R238 M241 M242 R295 Y297	E201-L204 PolarHBondContact O-N 3.2Å; E201-W205 PolarHBondContact O-N 2.82Å; E201-R238 HydrophobicContact CG-CB 4.03Å; E201-R238 WeakPolarHBondContact CG-O 3.38Å; E201-R238 WeakPolarHBondContact OE1-CB 3.42Å; E201-R238 WeakPolarHBondContact OE1-CG 3.28Å; E201-R238 PolarHBondContact OE1-N 2.95Å; E201-M241 HydrophobicContact CB-CB 3.96Å; E201-M241 HydrophobicContact CG-CB 4.32Å; E201-M242 HydrophobicContact CB-CE 4.46Å; E201-M242 HydrophobicContact CB-CG 4.08Å; E201-M242 HydrophobicContact CG-CE 3.89Å; E201-M242 HydrophobicContact CG-CG 4.3Å; E201-R295 IonicContact OE1-NE 3.72Å; E201-R295 IonicContact OE1-NH2 2.74Å; E201-R295 WeakPolarHBondContact OE2-CD 3.2Å; E201-R295 IonicContact OE2-NE 2.72Å; E201-R295 PolarHBondContact OE2-NE 3.02Å; E201-R295 VanDerWaalsContact OE2-NE 3.15Å; E201-Y297 HydrophobicContact CB-CE1 3.91Å; E201-Y297 WeakPolarHBondContact OE2-CE1 3.21Å; E201-Y297 PolarHBondContact OE2-OH 3.44Å
202	Y	98	Very high	97.4	Very high	41 Å²	41	26.4 Å²	26.4	16%	0.161	13%	0.128	C	C	.	.	H	α-helix	trans	-66.4	-42.5	175.6	178.9	-108.1	0	0	0	111.9	S200 L204 W205 L206 M242 E246 L249 V250	S200-Y202 PolarHBondContact O-N 3.11Å; S200-Y202 PolarHBondContact OG-N 3.48Å; Y202-L204 VanDerWaalsContact C-N 3.31Å; Y202-L204 PolarHBondContact O-N 3.04Å; Y202-W205 CarbonylContact O-C 3.48Å; Y202-W205 WeakPolarHBondContact O-CA 3.35Å; Y202-W205 WeakPolarHBondContact O-CB 3.32Å; Y202-W205 PolarHBondContact O-N 3.33Å; Y202-W205 VanDerWaalsContact O-N 3.13Å; Y202-L206 HydrophobicContact CD1-CD1 4.08Å; Y202-L206 HydrophobicContact CD1-CG 4.41Å; Y202-L206 HydrophobicContact CE1-CD1 3.59Å; Y202-L206 HydrophobicContact CE1-CD2 4.4Å; Y202-L206 HydrophobicContact CE1-CG 4.05Å; Y202-L206 HydrophobicContact CE2-CD2 4.37Å; Y202-L206 HydrophobicContact CE2-CG 4.5Å; Y202-L206 WeakPolarHBondContact O-CG 3.22Å; Y202-L206 PolarHBondContact O-N 3.48Å; Y202-M242 HydrophobicContact CD2-SD 4.35Å; Y202-E246 HydrophobicContact CD1-CG 3.91Å; Y202-E246 HydrophobicContact CD2-CB 3.66Å; Y202-E246 HydrophobicContact CD2-CG 3.92Å; Y202-E246 HydrophobicContact CE1-CG 4.45Å; Y202-E246 HydrophobicContact CE2-CB 4.24Å; Y202-E246 HydrophobicContact CE2-CG 4.47Å; Y202-E246 HydrophobicContact CG-CB 3.85Å; Y202-E246 HydrophobicContact CG-CG 3.6Å; Y202-L249 HydrophobicContact CE2-CB 4.26Å; Y202-V250 HydrophobicContact CD2-CG2 4.15Å; Y202-V250 HydrophobicContact CE2-CG2 4.05Å
203	D	97.8	Very high	97.2	Very high	46 Å²	46	26.7 Å²	26.7	25%	0.246	13%	0.131	C	C	.	.	H	α-helix	trans	-65.5	-37.7	175.6	-57.8	-46.7	0	0	0	111.6	N199 S200 W205 L206 A207	N199-D203 WeakPolarHBondContact CB-OD2 3.35Å; N199-D203 PolarHBondContact ND2-OD2 2.67Å; S200-D203 WeakPolarHBondContact CB-OD2 3.45Å; S200-D203 PolarHBondContact N-OD2 3.43Å; S200-D203 PolarHBondContact O-N 3.25Å; S200-D203 PolarHBondContact OG-N 3.06Å; S200-D203 PolarHBondContact OG-OD2 3.4Å; D203-W205 VanDerWaalsContact C-N 3.32Å; D203-W205 PolarHBondContact O-N 3.26Å; D203-L206 PolarHBondContact O-N 3.18Å; D203-A207 PolarHBondContact O-N 3.3Å
204	L	98.5	Very high	97	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-61.2	-43.1	171.8	179.9	58.2	0	0	0	111	F166 V170 L191 S200 E201 Y202 L206 A207 V208 M237	F166-L204 HydrophobicContact CE1-CD1 3.82Å; V170-L204 HydrophobicContact CG1-CD1 4.39Å; L191-L204 HydrophobicContact CD2-CD1 4.05Å; L191-L204 HydrophobicContact CD2-CD2 3.94Å; L191-L204 HydrophobicContact CD2-CG 4.13Å; S200-L204 PolarHBondContact O-N 2.82Å; S200-L204 VanDerWaalsContact O-N 3.12Å; E201-L204 PolarHBondContact O-N 3.2Å; Y202-L204 VanDerWaalsContact C-N 3.31Å; Y202-L204 PolarHBondContact O-N 3.04Å; L204-L206 PolarHBondContact O-N 3.22Å; L204-A207 PolarHBondContact O-N 3.09Å; L204-V208 HydrophobicContact CD1-CG2 4.31Å; L204-V208 VanDerWaalsContact O-CG2 3.29Å; L204-V208 WeakPolarHBondContact O-CG2 3.34Å; L204-V208 PolarHBondContact O-N 2.88Å; L204-M237 HydrophobicContact CG-CE 4.3Å
205	W	98.2	Very high	96.7	Very high	1 Å²	1	28.3 Å²	28.3	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-59	-44.7	173.2	163.7	-101.5	0	0	0	112.2	E201 Y202 D203 A207 V208 F209 L234 M237 F239 M242 V250 V256 F263	E201-W205 PolarHBondContact O-N 2.82Å; Y202-W205 CarbonylContact O-C 3.48Å; Y202-W205 WeakPolarHBondContact O-CA 3.35Å; Y202-W205 WeakPolarHBondContact O-CB 3.32Å; Y202-W205 PolarHBondContact O-N 3.33Å; Y202-W205 VanDerWaalsContact O-N 3.13Å; D203-W205 VanDerWaalsContact C-N 3.32Å; D203-W205 PolarHBondContact O-N 3.26Å; W205-A207 VanDerWaalsContact C-N 3.3Å; W205-A207 PolarHBondContact O-N 3.06Å; W205-V208 PolarHBondContact O-N 3.27Å; W205-F209 HydrophobicContact CZ2-CB 4.23Å; W205-F209 HydrophobicContact CZ2-CD2 4.21Å; W205-F209 HydrophobicContact CZ2-CG 4.36Å; W205-F209 VanDerWaalsContact O-CB 3.25Å; W205-F209 WeakPolarHBondContact O-CB 3.47Å; W205-F209 PolarHBondContact O-N 2.82Å; W205-L234 HydrophobicContact CZ3-CD2 4.35Å; W205-M237 HydrophobicContact CB-CE 3.84Å; W205-M237 HydrophobicContact CE3-CE 4.31Å; W205-M237 HydrophobicContact CE3-CG 4.38Å; W205-F239 HydrophobicContact CE3-CE1 4.28Å; W205-F239 HydrophobicContact CE3-CZ 4.28Å; W205-F239 HydrophobicContact CZ3-CZ 4.35Å; W205-M242 HydrophobicContact CB-CE 3.48Å; W205-M242 VanDerWaalsContact CB-CE 3.48Å; W205-M242 HydrophobicContact CG-CE 4.08Å; W205-V250 HydrophobicContact CG-CG2 4.23Å; W205-V250 HydrophobicContact CZ2-CG1 4.09Å; W205-V256 HydrophobicContact CH2-CG2 4.36Å; W205-V256 HydrophobicContact CZ2-CG2 3.85Å; W205-F263 AromaticContact CH2-CE1 3.34Å; W205-F263 HydrophobicContact CH2-CE1 3.34Å; W205-F263 AromaticContact CH2-CZ 3.58Å; W205-F263 HydrophobicContact CH2-CZ 3.58Å; W205-F263 HydrophobicContact CZ2-CE1 4.06Å; W205-F263 HydrophobicContact CZ2-CZ 4.42Å; W205-F263 AromaticContact CZ3-CE1 3.82Å; W205-F263 HydrophobicContact CZ3-CE1 3.82Å; W205-F263 HydrophobicContact CZ3-CZ 4.27Å
206	L	98.1	Very high	96.3	Very high	67 Å²	67	27.2 Å²	27.2	35%	0.351	13%	0.132	S	C	.	.	H	α-helix	trans	-60.8	-40.2	177.1	-68.2	179.2	0	0	0	111.8	Y202 D203 L204 F209 R210	Y202-L206 HydrophobicContact CD1-CD1 4.08Å; Y202-L206 HydrophobicContact CD1-CG 4.41Å; Y202-L206 HydrophobicContact CE1-CD1 3.59Å; Y202-L206 HydrophobicContact CE1-CD2 4.4Å; Y202-L206 HydrophobicContact CE1-CG 4.05Å; Y202-L206 HydrophobicContact CE2-CD2 4.37Å; Y202-L206 HydrophobicContact CE2-CG 4.5Å; Y202-L206 WeakPolarHBondContact O-CG 3.22Å; Y202-L206 PolarHBondContact O-N 3.48Å; D203-L206 PolarHBondContact O-N 3.18Å; L204-L206 PolarHBondContact O-N 3.22Å; L206-F209 PolarHBondContact O-N 3.37Å; L206-R210 WeakPolarHBondContact O-CB 3.49Å; L206-R210 PolarHBondContact O-N 3.34Å
207	A	98.4	Very high	95.7	Very high	2 Å²	2	34.3 Å²	34.3	2%	0.017	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-41.8	175.9	0	0	0	0	0	112.7	V170 W179 D203 L204 W205 F209 R210 W211	V170-A207 HydrophobicContact CB-CB 3.74Å; V170-A207 HydrophobicContact CG1-CB 4.43Å; V170-A207 HydrophobicContact CG2-CB 4.4Å; W179-A207 HydrophobicContact CZ2-CB 4.01Å; W179-A207 PolarHBondContact NE1-O 3.44Å; D203-A207 PolarHBondContact O-N 3.3Å; L204-A207 PolarHBondContact O-N 3.09Å; W205-A207 VanDerWaalsContact C-N 3.3Å; W205-A207 PolarHBondContact O-N 3.06Å; A207-F209 VanDerWaalsContact C-N 3.34Å; A207-R210 PolarHBondContact O-N 3.33Å; A207-W211 PolarHBondContact O-N 3.43Å
208	V	98.3	Very high	95.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-40.8	173.8	170	0	0	0	0	110.6	W179 L187 L191 L204 W205 R210 W211 I212 I233 M237	W179-V208 HydrophobicContact CZ2-CG2 4.34Å; L187-V208 HydrophobicContact CD1-CG2 4.4Å; L191-V208 HydrophobicContact CD1-CG2 4.12Å; L191-V208 HydrophobicContact CD2-CG2 3.88Å; L204-V208 HydrophobicContact CD1-CG2 4.31Å; L204-V208 VanDerWaalsContact O-CG2 3.29Å; L204-V208 WeakPolarHBondContact O-CG2 3.34Å; L204-V208 PolarHBondContact O-N 2.88Å; W205-V208 PolarHBondContact O-N 3.27Å; V208-R210 PolarHBondContact O-N 3.12Å; V208-W211 WeakPolarHBondContact O-CB 3.33Å; V208-W211 PolarHBondContact O-N 2.98Å; V208-I212 HydrophobicContact CG1-CD1 3.94Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 VanDerWaalsContact O-CG1 3.31Å; V208-I212 WeakPolarHBondContact O-CG1 3.42Å; V208-I212 PolarHBondContact O-N 3.35Å; V208-I233 HydrophobicContact CG1-CG2 3.78Å; V208-M237 HydrophobicContact CB-SD 4.45Å; V208-M237 HydrophobicContact CG1-SD 4.39Å; V208-M237 HydrophobicContact CG2-SD 4.02Å
209	F	97.2	Very high	94.4	Very high	26 Å²	26	41.5 Å²	41.5	11%	0.114	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-42.3	177.3	-179	-122.3	0	0	0	111.4	W205 L206 A207 W211 I212 Q213 T253 F255	W205-F209 HydrophobicContact CZ2-CB 4.23Å; W205-F209 HydrophobicContact CZ2-CD2 4.21Å; W205-F209 HydrophobicContact CZ2-CG 4.36Å; W205-F209 VanDerWaalsContact O-CB 3.25Å; W205-F209 WeakPolarHBondContact O-CB 3.47Å; W205-F209 PolarHBondContact O-N 2.82Å; L206-F209 PolarHBondContact O-N 3.37Å; A207-F209 VanDerWaalsContact C-N 3.34Å; F209-W211 VanDerWaalsContact C-N 3.32Å; F209-W211 PolarHBondContact O-N 2.83Å; F209-I212 PolarHBondContact O-N 3.49Å; F209-Q213 HydrophobicContact CD2-CG 4.39Å; F209-Q213 HydrophobicContact CE1-CG 4.28Å; F209-Q213 HydrophobicContact CE2-CG 3.97Å; F209-Q213 HydrophobicContact CZ-CG 3.93Å; F209-Q213 WeakPolarHBondContact O-CG 3.39Å; F209-Q213 PolarHBondContact O-N 3.2Å; F209-T253 HydrophobicContact CE1-CG2 3.99Å; F209-T253 HydrophobicContact CE2-CG2 4.34Å; F209-T253 HydrophobicContact CZ-CG2 3.71Å; F209-F255 HydrophobicContact CD2-CD1 4.1Å; F209-F255 HydrophobicContact CE2-CB 3.63Å; F209-F255 AromaticContact CE2-CD1 3.47Å; F209-F255 HydrophobicContact CE2-CD1 3.47Å; F209-F255 VanDerWaalsContact CE2-CD1 3.47Å; F209-F255 HydrophobicContact CE2-CD2 4.41Å; F209-F255 HydrophobicContact CE2-CE1 4.21Å; F209-F255 AromaticContact CE2-CG 3.58Å; F209-F255 HydrophobicContact CE2-CG 3.58Å; F209-F255 HydrophobicContact CZ-CB 3.82Å; F209-F255 HydrophobicContact CZ-CD1 4.48Å; F209-F255 HydrophobicContact CZ-CG 4.26Å
210	R	95.8	Very high	93.7	Very high	80 Å²	80	47.9 Å²	47.9	30%	0.302	23%	0.228	S	C	.	.	H	α-helix	trans	-60.5	-41	172.8	-169.7	173.2	61.7	-105.2	0.4	112	V170 L180 L206 A207 V208 Q213 N214	V170-R210 PolarHBondContact O-NH2 2.99Å; L180-R210 HydrophobicContact CD2-CG 4.16Å; L206-R210 WeakPolarHBondContact O-CB 3.49Å; L206-R210 PolarHBondContact O-N 3.34Å; A207-R210 PolarHBondContact O-N 3.33Å; V208-R210 PolarHBondContact O-N 3.12Å; R210-Q213 PolarHBondContact O-N 3.26Å; R210-N214 PolarHBondContact O-N 3.3Å
211	W	96.8	Very high	92.8	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-61.7	-45.9	173.1	178.2	92	0	0	0	112.1	L182 K184 L187 A207 V208 F209 Q213 N214 M215 I229 I233	L182-W211 WeakPolarHBondContact O-CZ2 3.41Å; L182-W211 PolarHBondContact O-NE1 3.23Å; K184-W211 HydrophobicContact CB-CH2 4.31Å; L187-W211 HydrophobicContact CB-CZ2 4.45Å; L187-W211 HydrophobicContact CD2-CD2 3.59Å; L187-W211 HydrophobicContact CD2-CE3 3.4Å; L187-W211 HydrophobicContact CD2-CG 4.27Å; L187-W211 HydrophobicContact CD2-CH2 3.96Å; L187-W211 HydrophobicContact CD2-CZ2 4.11Å; L187-W211 HydrophobicContact CD2-CZ3 3.62Å; A207-W211 PolarHBondContact O-N 3.43Å; V208-W211 WeakPolarHBondContact O-CB 3.33Å; V208-W211 PolarHBondContact O-N 2.98Å; F209-W211 VanDerWaalsContact C-N 3.32Å; F209-W211 PolarHBondContact O-N 2.83Å; W211-Q213 VanDerWaalsContact C-N 3.34Å; W211-Q213 PolarHBondContact O-N 3.32Å; W211-N214 PolarHBondContact O-N 2.94Å; W211-M215 HydrophobicContact CH2-CE 3.95Å; W211-M215 HydrophobicContact CH2-CG 4.39Å; W211-M215 HydrophobicContact CH2-SD 3.58Å; W211-M215 VanDerWaalsContact CH2-SD 3.58Å; W211-M215 HydrophobicContact CZ2-CE 4.49Å; W211-M215 HydrophobicContact CZ2-SD 4.31Å; W211-M215 HydrophobicContact CZ3-SD 3.82Å; W211-M215 WeakPolarHBondContact O-CB 3.3Å; W211-M215 PolarHBondContact O-N 3.35Å; W211-I229 HydrophobicContact CH2-CG2 4.43Å; W211-I229 HydrophobicContact CZ3-CG2 4.09Å; W211-I233 HydrophobicContact CE3-CD1 4.13Å; W211-I233 HydrophobicContact CH2-CD1 4.23Å; W211-I233 HydrophobicContact CZ3-CD1 3.48Å; W211-I233 VanDerWaalsContact CZ3-CD1 3.48Å
212	I	94.9	Very high	92.2	Very high	4 Å²	4	57.2 Å²	57.2	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-46.2	177.3	-68.9	167.1	0	0	0	110.2	V208 F209 N214 M215 I216 L230 I233 F255	V208-I212 HydrophobicContact CG1-CD1 3.94Å; V208-I212 HydrophobicContact CG1-CG1 4.38Å; V208-I212 VanDerWaalsContact O-CG1 3.31Å; V208-I212 WeakPolarHBondContact O-CG1 3.42Å; V208-I212 PolarHBondContact O-N 3.35Å; F209-I212 PolarHBondContact O-N 3.49Å; I212-N214 PolarHBondContact O-N 3.28Å; I212-M215 PolarHBondContact O-N 3.38Å; I212-I216 HydrophobicContact CG2-CD1 3.62Å; I212-I216 HydrophobicContact CG2-CG1 4.34Å; I212-I216 WeakPolarHBondContact O-CG1 3.47Å; I212-I216 PolarHBondContact O-N 3Å; I212-L230 HydrophobicContact CD1-CD2 3.87Å; I212-I233 HydrophobicContact CD1-CD1 4.48Å; I212-I233 HydrophobicContact CG1-CD1 4.3Å; I212-F255 HydrophobicContact CG2-CE1 4.06Å; I212-F255 HydrophobicContact CG2-CE2 4.32Å; I212-F255 HydrophobicContact CG2-CZ 3.62Å
213	Q	93.2	Very high	91.6	Very high	101 Å²	101	58 Å²	58	47%	0.472	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-44.8	178.4	-71.9	-179.6	-51.5	0	0	112	F209 R210 W211 I216 H217	F209-Q213 HydrophobicContact CD2-CG 4.39Å; F209-Q213 HydrophobicContact CE1-CG 4.28Å; F209-Q213 HydrophobicContact CE2-CG 3.97Å; F209-Q213 HydrophobicContact CZ-CG 3.93Å; F209-Q213 WeakPolarHBondContact O-CG 3.39Å; F209-Q213 PolarHBondContact O-N 3.2Å; R210-Q213 PolarHBondContact O-N 3.26Å; W211-Q213 VanDerWaalsContact C-N 3.34Å; W211-Q213 PolarHBondContact O-N 3.32Å; Q213-I216 PolarHBondContact O-N 2.91Å; Q213-H217 WeakPolarHBondContact O-CB 3.3Å; Q213-H217 PolarHBondContact O-N 3.18Å
214	N	93.3	Very high	91.2	Very high	52 Å²	52	60.3 Å²	60.3	28%	0.278	30%	0.301	S	S	.	.	H	α-helix	trans	-61.3	-47	176.2	-177.9	67.5	0	0	0	111.6	L180 R210 W211 I212 I216 H217 V218	L180-N214 HydrophobicContact CD2-CB 3.94Å; L180-N214 PolarHBondContact O-ND2 3.47Å; R210-N214 PolarHBondContact O-N 3.3Å; W211-N214 PolarHBondContact O-N 2.94Å; I212-N214 PolarHBondContact O-N 3.28Å; N214-I216 PolarHBondContact O-N 3.31Å; N214-H217 PolarHBondContact O-N 3.32Å; N214-V218 WeakPolarHBondContact O-CG2 3.06Å; N214-V218 PolarHBondContact O-N 3.22Å
215	M	89.8	Confident	90.8	Very high	13 Å²	13	60.9 Å²	60.9	6%	0.064	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-45.5	178.8	-171.1	-154.1	-158.6	0	0	111.9	W211 I212 H217 V218 E219 I229	W211-M215 HydrophobicContact CH2-CE 3.95Å; W211-M215 HydrophobicContact CH2-CG 4.39Å; W211-M215 HydrophobicContact CH2-SD 3.58Å; W211-M215 VanDerWaalsContact CH2-SD 3.58Å; W211-M215 HydrophobicContact CZ2-CE 4.49Å; W211-M215 HydrophobicContact CZ2-SD 4.31Å; W211-M215 HydrophobicContact CZ3-SD 3.82Å; W211-M215 WeakPolarHBondContact O-CB 3.3Å; W211-M215 PolarHBondContact O-N 3.35Å; I212-M215 PolarHBondContact O-N 3.38Å; M215-H217 VanDerWaalsContact C-N 3.31Å; M215-H217 PolarHBondContact O-N 2.66Å; M215-V218 PolarHBondContact O-N 2.78Å; M215-E219 WeakPolarHBondContact CE-OE1 3.49Å; M215-E219 WeakPolarHBondContact CG-OE1 3.44Å; M215-E219 WeakPolarHBondContact O-CB 3.38Å; M215-E219 PolarHBondContact O-N 3.29Å; M215-I229 HydrophobicContact CE-CD1 3.54Å; M215-I229 HydrophobicContact CE-CG1 4.04Å; M215-I229 HydrophobicContact SD-CD1 3.28Å; M215-I229 WeakPolarHBondContact SD-CD1 3.47Å; M215-I229 HydrophobicContact SD-CG1 4.12Å; M215-I229 HydrophobicContact SD-CG2 4.2Å
216	I	88.9	Confident	90.5	Very high	40 Å²	40	61.5 Å²	61.5	21%	0.205	31%	0.311	C	S	.	.	H	α-helix	trans	-60.6	-43	177.6	-69.4	168	0	0	0	110.9	I212 Q213 N214 K220 I226 F255	I212-I216 HydrophobicContact CG2-CD1 3.62Å; I212-I216 HydrophobicContact CG2-CG1 4.34Å; I212-I216 WeakPolarHBondContact O-CG1 3.47Å; I212-I216 PolarHBondContact O-N 3Å; Q213-I216 PolarHBondContact O-N 2.91Å; N214-I216 PolarHBondContact O-N 3.31Å; I216-K220 PolarHBondContact O-N 3.48Å; I216-K220 VanDerWaalsContact O-N 3.09Å; I216-I226 HydrophobicContact CD1-CD1 3.86Å; I216-I226 HydrophobicContact CD1-CG1 4.11Å; I216-I226 HydrophobicContact CD1-CG2 4.11Å; I216-I226 HydrophobicContact CG1-CD1 3.96Å; I216-I226 HydrophobicContact CG1-CG1 3.97Å; I216-I226 HydrophobicContact CG2-CD1 4.16Å; I216-F255 HydrophobicContact CD1-CD2 4.49Å; I216-F255 HydrophobicContact CD1-CE2 3.46Å; I216-F255 VanDerWaalsContact CD1-CE2 3.46Å; I216-F255 HydrophobicContact CD1-CZ 3.88Å
217	H	87.1	Confident	90.3	Very high	150 Å²	150	62.1 Å²	62.1	69%	0.694	31%	0.312	S	S	*	.	H	α-helix	trans	-66.4	-47.3	-179.7	179	-89.5	0	0	0	112.3	Q213 N214 M215	Q213-H217 WeakPolarHBondContact O-CB 3.3Å; Q213-H217 PolarHBondContact O-N 3.18Å; N214-H217 PolarHBondContact O-N 3.32Å; M215-H217 VanDerWaalsContact C-N 3.31Å; M215-H217 PolarHBondContact O-N 2.66Å
218	V	85.9	Confident	90.1	Very high	97 Å²	97	70.9 Å²	70.9	59%	0.588	35%	0.345	S	S	*	.	H	α-helix	trans	-68.9	-43.6	-177.3	173	0	0	0	0	111.5	N214 M215	N214-V218 WeakPolarHBondContact O-CG2 3.06Å; N214-V218 PolarHBondContact O-N 3.22Å; M215-V218 PolarHBondContact O-N 2.78Å
219	E	82.7	Confident	89.8	Confident	92 Å²	92	71.1 Å²	71.1	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-93.6	-5.6	-171.6	-62	-170.5	-143.3	0	0	114.4	M215 R221	M215-E219 WeakPolarHBondContact CE-OE1 3.49Å; M215-E219 WeakPolarHBondContact CG-OE1 3.44Å; M215-E219 WeakPolarHBondContact O-CB 3.38Å; M215-E219 PolarHBondContact O-N 3.29Å; E219-R221 HydrophobicContact CB-CG 3.83Å; E219-R221 PolarHBondContact O-N 3.48Å; E219-R221 VanDerWaalsContact O-N 3.15Å; E219-R221 IonicContact OE1-NH2 3.23Å; E219-R221 IonicContact OE2-CZ 3.42Å; E219-R221 IonicContact OE2-NE 3.67Å; E219-R221 PolarHBondContact OE2-NE 2.97Å; E219-R221 IonicContact OE2-NH2 2.73Å; E219-R221 PolarHBondContact OE2-NH2 3.39Å
220	K	80.4	Confident	89.7	Confident	188 Å²	188	69.9 Å²	69.9	82%	0.817	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.9	42.3	-179.9	-59.6	-177.1	-179.1	178.5	0	113.3	I216	I216-K220 PolarHBondContact O-N 3.48Å; I216-K220 VanDerWaalsContact O-N 3.09Å
221	R	77.5	Confident	89.7	Confident	98 Å²	98	69 Å²	69	37%	0.37	35%	0.347	S	S	.	.			trans	-70.7	151.1	-173.2	-70.9	-168	177.4	-157.9	5.8	113	E219 I226 I229	E219-R221 HydrophobicContact CB-CG 3.83Å; E219-R221 PolarHBondContact O-N 3.48Å; E219-R221 VanDerWaalsContact O-N 3.15Å; E219-R221 IonicContact OE1-NH2 3.23Å; E219-R221 IonicContact OE2-CZ 3.42Å; E219-R221 IonicContact OE2-NE 3.67Å; E219-R221 PolarHBondContact OE2-NE 2.97Å; E219-R221 IonicContact OE2-NH2 2.73Å; E219-R221 PolarHBondContact OE2-NH2 3.39Å; R221-I226 HydrophobicContact CB-CG1 4.38Å; R221-I229 VanDerWaalsContact NH1-CD1 3.26Å
222	T	86	Confident	89.7	Confident	100 Å²	100	71.3 Å²	71.3	61%	0.613	36%	0.361	S	S	*	.			trans	-73.7	163.8	171.4	62.5	0	0	0	0	111.6	V224 G225 I226	T222-V224 PolarHBondContact O-N 2.95Å; T222-G225 WeakPolarHBondContact O-CA 3.3Å; T222-G225 PolarHBondContact O-N 3.12Å; T222-G225 PolarHBondContact OG1-N 2.95Å; T222-I226 WeakPolarHBondContact O-CG1 3.37Å; T222-I226 PolarHBondContact O-N 3.12Å; T222-I226 VanDerWaalsContact O-N 3.14Å
223	S	85.9	Confident	89.8	Confident	57 Å²	57	71.1 Å²	71.1	40%	0.399	36%	0.36	S	S	.	.	H	α-helix	trans	-50.5	-43.7	175.3	-165.8	0	0	0	0	112.5	G225 I226 E227	S223-G225 VanDerWaalsContact C-N 3.32Å; S223-G225 PolarHBondContact O-N 3.49Å; S223-I226 WeakPolarHBondContact O-CB 3.35Å; S223-I226 PolarHBondContact O-N 3.05Å; S223-I226 VanDerWaalsContact O-N 3.16Å; S223-E227 WeakPolarHBondContact O-CG 3.17Å; S223-E227 PolarHBondContact O-N 2.88Å; S223-E227 PolarHBondContact OG-OE1 2.91Å
224	V	88.9	Confident	90.1	Very high	94 Å²	94	66.3 Å²	66.3	57%	0.57	34%	0.338	S	S	*	.	H	α-helix	trans	-63.1	-38.1	178.6	-178.5	0	0	0	0	111.9	T222 I226 E227 R228	T222-V224 PolarHBondContact O-N 2.95Å; V224-I226 VanDerWaalsContact C-N 3.33Å; V224-E227 PolarHBondContact O-N 3.15Å; V224-R228 WeakPolarHBondContact O-CG 3.36Å; V224-R228 PolarHBondContact O-N 3.33Å
225	G	89.7	Confident	90.3	Very high	14 Å²	14	65.9 Å²	65.9	14%	0.144	34%	0.338	C	S	.	.	H	α-helix	trans	-63.5	-40.3	175.8	0	0	0	0	0	112.2	T222 S223 I229	T222-G225 WeakPolarHBondContact O-CA 3.3Å; T222-G225 PolarHBondContact O-N 3.12Å; T222-G225 PolarHBondContact OG1-N 2.95Å; S223-G225 VanDerWaalsContact C-N 3.32Å; S223-G225 PolarHBondContact O-N 3.49Å; G225-I229 WeakPolarHBondContact O-CD1 3.39Å; G225-I229 WeakPolarHBondContact O-CG1 3.33Å; G225-I229 PolarHBondContact O-N 3.17Å
226	I	92	Very high	90.6	Very high	14 Å²	14	67.7 Å²	67.7	7%	0.072	35%	0.346	C	S	.	.	H	α-helix	trans	-66.9	-45.7	177.8	-59.8	170.2	0	0	0	110.4	I216 R221 T222 S223 V224 R228 I229 L230 F255 F259	I216-I226 HydrophobicContact CD1-CD1 3.86Å; I216-I226 HydrophobicContact CD1-CG1 4.11Å; I216-I226 HydrophobicContact CD1-CG2 4.11Å; I216-I226 HydrophobicContact CG1-CD1 3.96Å; I216-I226 HydrophobicContact CG1-CG1 3.97Å; I216-I226 HydrophobicContact CG2-CD1 4.16Å; R221-I226 HydrophobicContact CB-CG1 4.38Å; T222-I226 WeakPolarHBondContact O-CG1 3.37Å; T222-I226 PolarHBondContact O-N 3.12Å; T222-I226 VanDerWaalsContact O-N 3.14Å; S223-I226 WeakPolarHBondContact O-CB 3.35Å; S223-I226 PolarHBondContact O-N 3.05Å; S223-I226 VanDerWaalsContact O-N 3.16Å; V224-I226 VanDerWaalsContact C-N 3.33Å; I226-R228 VanDerWaalsContact C-N 3.29Å; I226-R228 PolarHBondContact O-N 3.12Å; I226-I229 PolarHBondContact O-N 3.3Å; I226-I229 VanDerWaalsContact O-N 3.12Å; I226-L230 HydrophobicContact CG2-CD1 3.9Å; I226-L230 HydrophobicContact CG2-CG 4.19Å; I226-L230 WeakPolarHBondContact O-CG 3.04Å; I226-L230 PolarHBondContact O-N 3.43Å; I226-F255 HydrophobicContact CG2-CE2 4.24Å; I226-F255 HydrophobicContact CG2-CZ 3.92Å; I226-F259 HydrophobicContact CB-CE1 4.27Å; I226-F259 HydrophobicContact CB-CZ 3.95Å; I226-F259 HydrophobicContact CD1-CZ 4.09Å; I226-F259 HydrophobicContact CG2-CD2 4.47Å; I226-F259 HydrophobicContact CG2-CE1 4.04Å; I226-F259 HydrophobicContact CG2-CE2 3.82Å; I226-F259 HydrophobicContact CG2-CZ 3.56Å
227	E	94.3	Very high	91.1	Very high	80 Å²	80	65.8 Å²	65.8	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-57.6	-39.6	178.4	-71.9	173.1	-150.6	0	0	112.6	S223 V224 L230 S231 F259 L262	S223-E227 WeakPolarHBondContact O-CG 3.17Å; S223-E227 PolarHBondContact O-N 2.88Å; S223-E227 PolarHBondContact OG-OE1 2.91Å; V224-E227 PolarHBondContact O-N 3.15Å; E227-L230 PolarHBondContact O-N 2.96Å; E227-S231 WeakPolarHBondContact O-CB 3.44Å; E227-S231 PolarHBondContact O-N 3.13Å; E227-S231 PolarHBondContact O-OG 2.99Å; E227-F259 HydrophobicContact CG-CD1 3.93Å; E227-F259 HydrophobicContact CG-CE1 3.91Å; E227-L262 HydrophobicContact CB-CD1 4.01Å; E227-L262 HydrophobicContact CG-CD1 3.94Å
228	R	92.9	Very high	91.6	Very high	185 Å²	185	59 Å²	59	70%	0.698	30%	0.304	S	S	*	.	H	α-helix	trans	-64.6	-40.2	176.6	-72.5	176.4	67.1	-171.1	1.3	112.7	V224 I226 T232	V224-R228 WeakPolarHBondContact O-CG 3.36Å; V224-R228 PolarHBondContact O-N 3.33Å; I226-R228 VanDerWaalsContact C-N 3.29Å; I226-R228 PolarHBondContact O-N 3.12Å; R228-T232 PolarHBondContact O-N 3.37Å; R228-T232 PolarHBondContact O-OG1 2.65Å
229	I	92.2	Very high	92.2	Very high	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-67.1	-49.8	177	-66.5	154.4	0	0	0	109.9	W211 M215 R221 G225 I226 S231 T232 I233	W211-I229 HydrophobicContact CH2-CG2 4.43Å; W211-I229 HydrophobicContact CZ3-CG2 4.09Å; M215-I229 HydrophobicContact CE-CD1 3.54Å; M215-I229 HydrophobicContact CE-CG1 4.04Å; M215-I229 HydrophobicContact SD-CD1 3.28Å; M215-I229 WeakPolarHBondContact SD-CD1 3.47Å; M215-I229 HydrophobicContact SD-CG1 4.12Å; M215-I229 HydrophobicContact SD-CG2 4.2Å; R221-I229 VanDerWaalsContact NH1-CD1 3.26Å; G225-I229 WeakPolarHBondContact O-CD1 3.39Å; G225-I229 WeakPolarHBondContact O-CG1 3.33Å; G225-I229 PolarHBondContact O-N 3.17Å; I226-I229 PolarHBondContact O-N 3.3Å; I226-I229 VanDerWaalsContact O-N 3.12Å; I229-S231 VanDerWaalsContact C-N 3.27Å; I229-S231 PolarHBondContact O-N 2.83Å; I229-T232 WeakPolarHBondContact O-CA 3.41Å; I229-T232 WeakPolarHBondContact O-CB 3.36Å; I229-T232 PolarHBondContact O-N 3.3Å; I229-I233 HydrophobicContact CG2-CD1 3.49Å; I229-I233 VanDerWaalsContact CG2-CD1 3.49Å; I229-I233 HydrophobicContact CG2-CG1 4.25Å; I229-I233 PolarHBondContact O-N 3.04Å
230	L	96.4	Very high	92.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-56.9	-43.2	177.6	-70.4	176.4	0	0	0	111.3	I212 I226 E227 T232 I233 L234 F255 F259 L262 F263	I212-L230 HydrophobicContact CD1-CD2 3.87Å; I226-L230 HydrophobicContact CG2-CD1 3.9Å; I226-L230 HydrophobicContact CG2-CG 4.19Å; I226-L230 WeakPolarHBondContact O-CG 3.04Å; I226-L230 PolarHBondContact O-N 3.43Å; E227-L230 PolarHBondContact O-N 2.96Å; L230-T232 PolarHBondContact O-N 2.89Å; L230-T232 VanDerWaalsContact O-N 3.13Å; L230-I233 PolarHBondContact O-N 2.81Å; L230-I233 VanDerWaalsContact O-N 3.12Å; L230-L234 HydrophobicContact CB-CD1 4.18Å; L230-L234 HydrophobicContact CB-CG 4.41Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.86Å; L230-F255 HydrophobicContact CD1-CE1 4.21Å; L230-F255 HydrophobicContact CD1-CZ 4.15Å; L230-F255 HydrophobicContact CD2-CE1 4.08Å; L230-F255 HydrophobicContact CD2-CZ 4.34Å; L230-F259 HydrophobicContact CD1-CB 3.88Å; L230-F259 HydrophobicContact CD1-CD1 4.09Å; L230-F259 HydrophobicContact CD1-CD2 3.99Å; L230-F259 HydrophobicContact CD1-CG 3.7Å; L230-L262 HydrophobicContact CB-CD1 3.9Å; L230-L262 HydrophobicContact CD1-CD1 4.01Å; L230-F263 HydrophobicContact CD1-CE2 4.12Å; L230-F263 HydrophobicContact CD2-CE2 4.35Å; L230-F263 HydrophobicContact CD2-CZ 4.09Å
231	S	96	Very high	93.7	Very high	63 Å²	63	41 Å²	41	44%	0.441	22%	0.217	S	C	.	.	H	α-helix	trans	-60.8	-23.9	176.2	-58.7	0	0	0	0	113.5	E227 I229 P235	E227-S231 WeakPolarHBondContact O-CB 3.44Å; E227-S231 PolarHBondContact O-N 3.13Å; E227-S231 PolarHBondContact O-OG 2.99Å; I229-S231 VanDerWaalsContact C-N 3.27Å; I229-S231 PolarHBondContact O-N 2.83Å; S231-P235 WeakPolarHBondContact O-CD 3.46Å; S231-P235 WeakPolarHBondContact O-CG 3.29Å
232	T	96.1	Very high	94.6	Very high	50 Å²	50	36.4 Å²	36.4	31%	0.307	20%	0.2	S	C	.	.	H	α-helix	trans	-86.1	-37.8	175.5	-47.5	0	0	0	0	111.6	K184 V188 R228 I229 L230 H236	K184-T232 HydrophobicContact CD-CG2 4.25Å; V188-T232 HydrophobicContact CG2-CG2 3.81Å; R228-T232 PolarHBondContact O-N 3.37Å; R228-T232 PolarHBondContact O-OG1 2.65Å; I229-T232 WeakPolarHBondContact O-CA 3.41Å; I229-T232 WeakPolarHBondContact O-CB 3.36Å; I229-T232 PolarHBondContact O-N 3.3Å; L230-T232 PolarHBondContact O-N 2.89Å; L230-T232 VanDerWaalsContact O-N 3.13Å; T232-H236 PolarHBondContact O-CD2 2.85Å
233	I	97.6	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-83.7	-44.9	-173.7	-67.2	174.3	0	0	0	112.6	L187 L191 V208 W211 I212 I229 L230 P235 H236 M237	L187-I233 HydrophobicContact CD2-CD1 3.7Å; L187-I233 HydrophobicContact CD2-CG1 4.28Å; L191-I233 HydrophobicContact CD1-CG2 3.88Å; V208-I233 HydrophobicContact CG1-CG2 3.78Å; W211-I233 HydrophobicContact CE3-CD1 4.13Å; W211-I233 HydrophobicContact CH2-CD1 4.23Å; W211-I233 HydrophobicContact CZ3-CD1 3.48Å; W211-I233 VanDerWaalsContact CZ3-CD1 3.48Å; I212-I233 HydrophobicContact CD1-CD1 4.48Å; I212-I233 HydrophobicContact CG1-CD1 4.3Å; I229-I233 HydrophobicContact CG2-CD1 3.49Å; I229-I233 VanDerWaalsContact CG2-CD1 3.49Å; I229-I233 HydrophobicContact CG2-CG1 4.25Å; I229-I233 PolarHBondContact O-N 3.04Å; L230-I233 PolarHBondContact O-N 2.81Å; L230-I233 VanDerWaalsContact O-N 3.12Å; I233-P235 VanDerWaalsContact C-CD 3.41Å; I233-H236 PolarHBondContact O-N 2.74Å; I233-M237 HydrophobicContact CG2-CG 4.31Å; I233-M237 PolarHBondContact O-N 3.01Å
234	L	98	Very high	95.4	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-56.2	-38.2	-173.1	-65.6	176.5	0	0	0	114.5	W205 L230 H236 M237 F239 L262 F263 Y266	W205-L234 HydrophobicContact CZ3-CD2 4.35Å; L230-L234 HydrophobicContact CB-CD1 4.18Å; L230-L234 HydrophobicContact CB-CG 4.41Å; L230-L234 WeakPolarHBondContact O-CB 3.45Å; L230-L234 WeakPolarHBondContact O-CG 3.47Å; L230-L234 PolarHBondContact O-N 2.86Å; L234-H236 PolarHBondContact O-N 3.27Å; L234-H236 VanDerWaalsContact O-N 3.12Å; L234-M237 PolarHBondContact O-N 2.97Å; L234-M237 VanDerWaalsContact O-N 3.14Å; L234-F239 HydrophobicContact CD2-CE2 4.07Å; L234-F239 HydrophobicContact CD2-CZ 3.86Å; L234-L262 HydrophobicContact CD1-CB 3.98Å; L234-F263 HydrophobicContact CD1-CD1 4.34Å; L234-F263 HydrophobicContact CD1-CD2 4.32Å; L234-F263 HydrophobicContact CD1-CE1 4.32Å; L234-F263 HydrophobicContact CD1-CE2 4.28Å; L234-F263 HydrophobicContact CD1-CG 4.34Å; L234-F263 HydrophobicContact CD1-CZ 4.27Å; L234-F263 HydrophobicContact CD2-CD1 3.77Å; L234-F263 HydrophobicContact CD2-CE1 3.26Å; L234-F263 HydrophobicContact CD2-CE2 4.46Å; L234-F263 HydrophobicContact CD2-CZ 3.65Å; L234-F263 HydrophobicContact CG-CE1 4.41Å; L234-Y266 HydrophobicContact CB-CD2 4.03Å; L234-Y266 HydrophobicContact CB-CE1 4.49Å; L234-Y266 HydrophobicContact CB-CE2 3.59Å; L234-Y266 HydrophobicContact CD1-CD2 4.24Å; L234-Y266 HydrophobicContact CD1-CE2 4Å; L234-Y266 HydrophobicContact CG-CE2 4.43Å
235	P	97.3	Very high	95.7	Very high	43 Å²	43	34.3 Å²	34.3	28%	0.279	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-58.6	-22.8	174.7	-24.6	33.4	0	0	0	115	S231 I233 Y266 Q291	S231-P235 WeakPolarHBondContact O-CD 3.46Å; S231-P235 WeakPolarHBondContact O-CG 3.29Å; I233-P235 VanDerWaalsContact C-CD 3.41Å; P235-Y266 WeakPolarHBondContact CG-OH 3.34Å; P235-Q291 WeakPolarHBondContact O-CG 3.09Å
236	H	97.9	Very high	96.1	Very high	50 Å²	50	34.3 Å²	34.3	23%	0.231	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-96.8	-8.6	-178.2	-58.2	-62.4	0	0	0	113.3	L191 T232 I233 L234 R295	L191-H236 HydrophobicContact CB-CB 3.63Å; L191-H236 HydrophobicContact CD1-CB 4.49Å; T232-H236 PolarHBondContact O-CD2 2.85Å; I233-H236 PolarHBondContact O-N 2.74Å; L234-H236 PolarHBondContact O-N 3.27Å; L234-H236 VanDerWaalsContact O-N 3.12Å; H236-R295 PolarHBondContact O-NH2 3.01Å
237	M	98.2	Very high	96.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	S	Bend	trans	-82	128.1	172.5	-66.2	-52.9	-52.1	0	0	110.1	L191 L204 W205 V208 I233 L234 F239 M242	L191-M237 HydrophobicContact CD1-SD 4.03Å; L191-M237 HydrophobicContact CD2-SD 4.06Å; L204-M237 HydrophobicContact CG-CE 4.3Å; W205-M237 HydrophobicContact CB-CE 3.84Å; W205-M237 HydrophobicContact CE3-CE 4.31Å; W205-M237 HydrophobicContact CE3-CG 4.38Å; V208-M237 HydrophobicContact CB-SD 4.45Å; V208-M237 HydrophobicContact CG1-SD 4.39Å; V208-M237 HydrophobicContact CG2-SD 4.02Å; I233-M237 HydrophobicContact CG2-CG 4.31Å; I233-M237 PolarHBondContact O-N 3.01Å; L234-M237 PolarHBondContact O-N 2.97Å; L234-M237 VanDerWaalsContact O-N 3.14Å; M237-F239 VanDerWaalsContact C-N 3.29Å; M237-F239 HydrophobicContact CB-CD2 3.92Å; M237-F239 HydrophobicContact CB-CE1 4.48Å; M237-F239 HydrophobicContact CB-CE2 3.46Å; M237-F239 VanDerWaalsContact CB-CE2 3.46Å; M237-F239 HydrophobicContact CB-CZ 3.78Å; M237-F239 HydrophobicContact CG-CE2 4.38Å; M237-F239 HydrophobicContact CG-CZ 4.34Å; M237-F239 PolarHBondContact O-N 3.45Å; M237-F239 VanDerWaalsContact O-N 3.14Å; M237-M242 HydrophobicContact CE-CE 4.4Å
238	R	97.8	Very high	96.5	Very high	7 Å²	7	33.7 Å²	33.7	3%	0.026	18%	0.178	C	C	.	.			trans	-94.1	56.7	-173.8	-45.7	-169.7	-170.9	-179.5	-4.5	110.3	K192 S193 S194 E201 P240 M241 L293 L294 R295	K192-R238 PolarHBondContact O-NH2 2.89Å; S193-R238 PolarHBondContact O-NH2 2.98Å; S194-R238 VanDerWaalsContact CA-NH2 3.28Å; S194-R238 PolarHBondContact OG-NH1 3.44Å; S194-R238 PolarHBondContact OG-NH2 3.46Å; E201-R238 HydrophobicContact CG-CB 4.03Å; E201-R238 WeakPolarHBondContact CG-O 3.38Å; E201-R238 WeakPolarHBondContact OE1-CB 3.42Å; E201-R238 WeakPolarHBondContact OE1-CG 3.28Å; E201-R238 PolarHBondContact OE1-N 2.95Å; R238-P240 WeakPolarHBondContact O-CD 3.48Å; R238-M241 HydrophobicContact CB-CB 4.34Å; R238-M241 HydrophobicContact CB-CG 3.79Å; R238-M241 WeakPolarHBondContact O-CA 3.28Å; R238-M241 WeakPolarHBondContact O-CB 3.47Å; R238-M241 WeakPolarHBondContact O-CG 3.36Å; R238-M241 PolarHBondContact O-N 2.88Å; R238-L293 WeakPolarHBondContact CD-O 3.33Å; R238-L293 PolarHBondContact NH1-O 3.15Å; R238-L294 PolarHBondContact NH1-O 3.09Å; R238-R295 VanDerWaalsContact NH1-N 3.18Å
239	F	98.5	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.167	C	C	.	.	G	3₁₀ helix	trans	-45	-37.9	-179.7	-64.5	-77.5	0	0	0	114.5	W205 L234 M237 M241 M242 L247 V250 F263 Y266 L267 A270	W205-F239 HydrophobicContact CE3-CE1 4.28Å; W205-F239 HydrophobicContact CE3-CZ 4.28Å; W205-F239 HydrophobicContact CZ3-CZ 4.35Å; L234-F239 HydrophobicContact CD2-CE2 4.07Å; L234-F239 HydrophobicContact CD2-CZ 3.86Å; M237-F239 VanDerWaalsContact C-N 3.29Å; M237-F239 HydrophobicContact CB-CD2 3.92Å; M237-F239 HydrophobicContact CB-CE1 4.48Å; M237-F239 HydrophobicContact CB-CE2 3.46Å; M237-F239 VanDerWaalsContact CB-CE2 3.46Å; M237-F239 HydrophobicContact CB-CZ 3.78Å; M237-F239 HydrophobicContact CG-CE2 4.38Å; M237-F239 HydrophobicContact CG-CZ 4.34Å; M237-F239 PolarHBondContact O-N 3.45Å; M237-F239 VanDerWaalsContact O-N 3.14Å; F239-M241 PolarHBondContact O-N 2.77Å; F239-M242 HydrophobicContact CD1-CE 3.7Å; F239-M242 HydrophobicContact CD1-SD 3.88Å; F239-M242 HydrophobicContact CE1-CE 4.03Å; F239-M242 WeakPolarHBondContact O-CB 3.46Å; F239-M242 PolarHBondContact O-N 3.43Å; F239-L247 HydrophobicContact CB-CD2 3.98Å; F239-L247 HydrophobicContact CD1-CD2 4.26Å; F239-V250 HydrophobicContact CE1-CG1 4.12Å; F239-F263 HydrophobicContact CZ-CD1 4.21Å; F239-F263 HydrophobicContact CZ-CE1 4.24Å; F239-Y266 HydrophobicContact CD2-CG 4.32Å; F239-Y266 HydrophobicContact CE2-CG 4.29Å; F239-L267 HydrophobicContact CD1-CD2 4.1Å; F239-L267 HydrophobicContact CE1-CD2 4.45Å; F239-A270 HydrophobicContact CB-CB 3.8Å
240	P	97.6	Very high	97.1	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-57.1	-15.7	173.8	-25.8	36.3	0	0	0	114.7	R238 A270 Y273 R274 F292	R238-P240 WeakPolarHBondContact O-CD 3.48Å; P240-A270 HydrophobicContact CB-CB 4.48Å; P240-A270 HydrophobicContact CG-CB 4.14Å; P240-Y273 HydrophobicContact CB-CD1 3.74Å; P240-Y273 HydrophobicContact CB-CE1 4.3Å; P240-Y273 HydrophobicContact CB-CG 4.13Å; P240-R274 VanDerWaalsContact O-CZ 3.26Å; P240-R274 PolarHBondContact O-NE 3.47Å; P240-R274 PolarHBondContact O-NH2 2.87Å; P240-F292 HydrophobicContact CB-CD1 3.98Å; P240-F292 HydrophobicContact CB-CE1 3.72Å; P240-F292 HydrophobicContact CB-CZ 4.46Å; P240-F292 HydrophobicContact CG-CD1 4.1Å; P240-F292 HydrophobicContact CG-CE1 3.56Å; P240-F292 HydrophobicContact CG-CZ 3.8Å
241	M	97	Very high	97.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-88.8	-7	176.8	-52.8	-53.6	129	0	0	113.7	E201 R238 F239 Y273 R274 L294 Y297 R301	E201-M241 HydrophobicContact CB-CB 3.96Å; E201-M241 HydrophobicContact CG-CB 4.32Å; R238-M241 HydrophobicContact CB-CB 4.34Å; R238-M241 HydrophobicContact CB-CG 3.79Å; R238-M241 WeakPolarHBondContact O-CA 3.28Å; R238-M241 WeakPolarHBondContact O-CB 3.47Å; R238-M241 WeakPolarHBondContact O-CG 3.36Å; R238-M241 PolarHBondContact O-N 2.88Å; F239-M241 PolarHBondContact O-N 2.77Å; M241-Y273 HydrophobicContact CE-CE1 4.15Å; M241-R274 PolarHBondContact O-NH2 2.83Å; M241-L294 HydrophobicContact CG-CD2 4.32Å; M241-L294 HydrophobicContact SD-CD2 3.38Å; M241-L294 WeakPolarHBondContact SD-CD2 3.45Å; M241-L294 HydrophobicContact SD-CG 4.46Å; M241-Y297 HydrophobicContact CB-CE2 4.09Å; M241-Y297 WeakPolarHBondContact CB-OH 3.42Å; M241-Y297 HydrophobicContact CG-CE2 4.24Å; M241-R301 VanDerWaalsContact O-CZ 3.23Å; M241-R301 PolarHBondContact O-NH1 3.03Å; M241-R301 PolarHBondContact O-NH2 2.79Å
242	M	97	Very high	97.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-85.5	152.3	172.8	-60.4	177.7	-167.6	0	0	112.4	E201 Y202 W205 M237 F239 E246 L247 V250 R274	E201-M242 HydrophobicContact CB-CE 4.46Å; E201-M242 HydrophobicContact CB-CG 4.08Å; E201-M242 HydrophobicContact CG-CE 3.89Å; E201-M242 HydrophobicContact CG-CG 4.3Å; Y202-M242 HydrophobicContact CD2-SD 4.35Å; W205-M242 HydrophobicContact CB-CE 3.48Å; W205-M242 VanDerWaalsContact CB-CE 3.48Å; W205-M242 HydrophobicContact CG-CE 4.08Å; M237-M242 HydrophobicContact CE-CE 4.4Å; F239-M242 HydrophobicContact CD1-CE 3.7Å; F239-M242 HydrophobicContact CD1-SD 3.88Å; F239-M242 HydrophobicContact CE1-CE 4.03Å; F239-M242 WeakPolarHBondContact O-CB 3.46Å; F239-M242 PolarHBondContact O-N 3.43Å; M242-E246 WeakPolarHBondContact CA-OE2 3.39Å; M242-E246 HydrophobicContact CB-CB 3.97Å; M242-L247 HydrophobicContact CB-CD2 3.99Å; M242-L247 HydrophobicContact CB-CG 3.98Å; M242-L247 HydrophobicContact SD-CD2 4.14Å; M242-V250 HydrophobicContact SD-CG2 3.99Å; M242-R274 PolarHBondContact O-NE 2.87Å; M242-R274 PolarHBondContact O-NH1 3.5Å; M242-R274 PolarHBondContact O-NH2 3.26Å
243	T	93.8	Very high	97.2	Very high	31 Å²	31	34.6 Å²	34.6	19%	0.19	18%	0.183	C	C	.	.			trans	-66.7	163.8	171.9	70.2	0	0	0	0	111.3	D245 E246 L247 W302	T243-D245 VanDerWaalsContact C-N 3.27Å; T243-D245 PolarHBondContact O-N 3.36Å; T243-E246 PolarHBondContact N-OE2 2.92Å; T243-E246 PolarHBondContact O-N 3.09Å; T243-E246 WeakPolarHBondContact OG1-CB 3.38Å; T243-E246 VanDerWaalsContact OG1-CD 3.3Å; T243-E246 WeakPolarHBondContact OG1-CG 3.42Å; T243-E246 PolarHBondContact OG1-N 3.15Å; T243-E246 PolarHBondContact OG1-OE2 3.21Å; T243-L247 VanDerWaalsContact O-CG 3.31Å; T243-L247 WeakPolarHBondContact O-CG 3.36Å; T243-L247 PolarHBondContact O-N 2.68Å; T243-W302 HydrophobicContact CG2-CH2 3.86Å; T243-W302 HydrophobicContact CG2-CZ3 4.15Å
244	A	94	Very high	97.1	Very high	54 Å²	54	39.3 Å²	39.3	45%	0.446	21%	0.213	S	C	.	.	H	α-helix	trans	-61.2	-38	175.5	0	0	0	0	0	111.9	L247 H248	A244-L247 PolarHBondContact O-N 2.9Å; A244-H248 WeakPolarHBondContact O-CB 3.31Å; A244-H248 PolarHBondContact O-N 2.87Å
245	D	94.8	Very high	97	Very high	123 Å²	123	40.4 Å²	40.4	66%	0.658	22%	0.218	S	C	*	.	H	α-helix	trans	-66	-41.8	175.5	-60.9	-44.2	0	0	0	111.7	T243 H248 L249	T243-D245 VanDerWaalsContact C-N 3.27Å; T243-D245 PolarHBondContact O-N 3.36Å; D245-H248 WeakPolarHBondContact O-CB 3.48Å; D245-H248 PolarHBondContact O-N 3.07Å; D245-L249 WeakPolarHBondContact O-CG 3.35Å; D245-L249 PolarHBondContact O-N 3.34Å
246	E	97.7	Very high	96.9	Very high	13 Å²	13	38.5 Å²	38.5	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-44.3	175.6	-74	163.9	-177.2	0	0	111.1	Y202 M242 T243 H248 L249 V250 R299	Y202-E246 HydrophobicContact CD1-CG 3.91Å; Y202-E246 HydrophobicContact CD2-CB 3.66Å; Y202-E246 HydrophobicContact CD2-CG 3.92Å; Y202-E246 HydrophobicContact CE1-CG 4.45Å; Y202-E246 HydrophobicContact CE2-CB 4.24Å; Y202-E246 HydrophobicContact CE2-CG 4.47Å; Y202-E246 HydrophobicContact CG-CB 3.85Å; Y202-E246 HydrophobicContact CG-CG 3.6Å; M242-E246 WeakPolarHBondContact CA-OE2 3.39Å; M242-E246 HydrophobicContact CB-CB 3.97Å; T243-E246 PolarHBondContact N-OE2 2.92Å; T243-E246 PolarHBondContact O-N 3.09Å; T243-E246 WeakPolarHBondContact OG1-CB 3.38Å; T243-E246 VanDerWaalsContact OG1-CD 3.3Å; T243-E246 WeakPolarHBondContact OG1-CG 3.42Å; T243-E246 PolarHBondContact OG1-N 3.15Å; T243-E246 PolarHBondContact OG1-OE2 3.21Å; E246-H248 VanDerWaalsContact C-N 3.3Å; E246-H248 PolarHBondContact O-N 2.93Å; E246-L249 WeakPolarHBondContact O-CB 3.4Å; E246-L249 PolarHBondContact O-N 3.26Å; E246-V250 WeakPolarHBondContact O-CG2 3.46Å; E246-V250 PolarHBondContact O-N 3.42Å; E246-R299 IonicContact OE1-CZ 3.1Å; E246-R299 IonicContact OE1-NH1 2.69Å; E246-R299 PolarHBondContact OE1-NH1 3Å
247	L	98.4	Very high	96.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-40.6	174.8	-70.8	170.4	0	0	0	112.1	F239 M242 T243 A244 V250 E251 L267 A270 Y271	F239-L247 HydrophobicContact CB-CD2 3.98Å; F239-L247 HydrophobicContact CD1-CD2 4.26Å; M242-L247 HydrophobicContact CB-CD2 3.99Å; M242-L247 HydrophobicContact CB-CG 3.98Å; M242-L247 HydrophobicContact SD-CD2 4.14Å; T243-L247 VanDerWaalsContact O-CG 3.31Å; T243-L247 WeakPolarHBondContact O-CG 3.36Å; T243-L247 PolarHBondContact O-N 2.68Å; A244-L247 PolarHBondContact O-N 2.9Å; L247-V250 WeakPolarHBondContact O-CB 3.35Å; L247-V250 PolarHBondContact O-N 3.02Å; L247-E251 WeakPolarHBondContact O-CB 3.45Å; L247-E251 PolarHBondContact O-N 2.82Å; L247-L267 HydrophobicContact CD2-CD2 3.9Å; L247-A270 HydrophobicContact CD1-CB 3.74Å; L247-A270 HydrophobicContact CD2-CB 3.85Å; L247-A270 HydrophobicContact CG-CB 4.48Å; L247-Y271 HydrophobicContact CB-CD1 4.35Å; L247-Y271 HydrophobicContact CB-CE1 3.6Å; L247-Y271 HydrophobicContact CD1-CD1 3.85Å; L247-Y271 HydrophobicContact CD1-CE1 3.96Å; L247-Y271 HydrophobicContact CD1-CG 4.41Å; L247-Y271 HydrophobicContact CG-CE1 4.44Å
248	H	97.8	Very high	96.6	Very high	81 Å²	81	48 Å²	48	38%	0.375	25%	0.251	S	S	.	.	H	α-helix	trans	-65.1	-38.3	176	-179.6	64.1	0	0	0	112.5	A244 D245 E246 E251 K252 Y271	A244-H248 WeakPolarHBondContact O-CB 3.31Å; A244-H248 PolarHBondContact O-N 2.87Å; D245-H248 WeakPolarHBondContact O-CB 3.48Å; D245-H248 PolarHBondContact O-N 3.07Å; E246-H248 VanDerWaalsContact C-N 3.3Å; E246-H248 PolarHBondContact O-N 2.93Å; H248-E251 PolarHBondContact O-N 3.16Å; H248-K252 WeakPolarHBondContact CE1-CE 3.49Å; H248-K252 PolarHBondContact CE1-NZ 3.29Å; H248-K252 VanDerWaalsContact NE2-CE 3.32Å; H248-K252 WeakPolarHBondContact NE2-CE 3.49Å; H248-K252 PolarHBondContact NE2-NZ 3.32Å; H248-K252 VanDerWaalsContact NE2-NZ 3.1Å; H248-K252 WeakPolarHBondContact O-CB 3.43Å; H248-K252 WeakPolarHBondContact O-CG 3.01Å; H248-K252 PolarHBondContact O-N 2.86Å; H248-Y271 WeakPolarHBondContact CA-OH 3.31Å; H248-Y271 PolarHBondContact N-OH 2.87Å
249	L	98.4	Very high	96.5	Very high	88 Å²	88	48.2 Å²	48.2	46%	0.461	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-40.2	173.5	-69.7	172.4	0	0	0	111.8	Y202 D245 E246 T253	Y202-L249 HydrophobicContact CE2-CB 4.26Å; D245-L249 WeakPolarHBondContact O-CG 3.35Å; D245-L249 PolarHBondContact O-N 3.34Å; E246-L249 WeakPolarHBondContact O-CB 3.4Å; E246-L249 PolarHBondContact O-N 3.26Å; L249-T253 PolarHBondContact O-N 3.31Å; L249-T253 PolarHBondContact O-OG1 3.13Å
250	V	98.3	Very high	96.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-59.5	-52.2	172.8	176.1	0	0	0	0	110	Y202 W205 F239 M242 E246 L247 K252 T253 V256 L267	Y202-V250 HydrophobicContact CD2-CG2 4.15Å; Y202-V250 HydrophobicContact CE2-CG2 4.05Å; W205-V250 HydrophobicContact CG-CG2 4.23Å; W205-V250 HydrophobicContact CZ2-CG1 4.09Å; F239-V250 HydrophobicContact CE1-CG1 4.12Å; M242-V250 HydrophobicContact SD-CG2 3.99Å; E246-V250 WeakPolarHBondContact O-CG2 3.46Å; E246-V250 PolarHBondContact O-N 3.42Å; L247-V250 WeakPolarHBondContact O-CB 3.35Å; L247-V250 PolarHBondContact O-N 3.02Å; V250-K252 VanDerWaalsContact C-N 3.32Å; V250-K252 PolarHBondContact O-N 3.07Å; V250-T253 VanDerWaalsContact O-CB 3.28Å; V250-T253 WeakPolarHBondContact O-CB 3.22Å; V250-T253 PolarHBondContact O-N 2.99Å; V250-T253 VanDerWaalsContact O-N 3.1Å; V250-T253 PolarHBondContact O-OG1 3.01Å; V250-V256 HydrophobicContact CG1-CG1 4.49Å; V250-V256 HydrophobicContact CG1-CG2 4.19Å; V250-V256 VanDerWaalsContact O-CB 3.25Å; V250-V256 WeakPolarHBondContact O-CB 3.32Å; V250-V256 WeakPolarHBondContact O-CG1 3.23Å; V250-V256 VanDerWaalsContact O-CG2 3.31Å; V250-V256 WeakPolarHBondContact O-CG2 3.26Å; V250-L267 HydrophobicContact CG1-CD2 4.18Å
251	E	97.3	Very high	96.3	Very high	83 Å²	83	60.3 Å²	60.3	39%	0.388	31%	0.312	S	S	.	.	H	α-helix	trans	-58.8	-40.1	-177.3	-171.6	170	-169	0	0	113	L247 H248 T253 E257 L267 Y271	L247-E251 WeakPolarHBondContact O-CB 3.45Å; L247-E251 PolarHBondContact O-N 2.82Å; H248-E251 PolarHBondContact O-N 3.16Å; E251-T253 VanDerWaalsContact C-N 3.27Å; E251-T253 PolarHBondContact O-N 3.2Å; E251-E257 WeakPolarHBondContact O-CG 3.37Å; E251-L267 HydrophobicContact CB-CD1 3.95Å; E251-L267 HydrophobicContact CG-CD1 4.09Å; E251-Y271 WeakPolarHBondContact OE2-CE2 3.4Å; E251-Y271 PolarHBondContact OE2-OH 3.35Å
252	K	96.7	Very high	96.4	Very high	119 Å²	119	62.4 Å²	62.4	52%	0.517	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-5.7	178.7	-78	-176.8	160.1	-179.3	0	115.1	H248 V250 P254	H248-K252 WeakPolarHBondContact CE1-CE 3.49Å; H248-K252 PolarHBondContact CE1-NZ 3.29Å; H248-K252 VanDerWaalsContact NE2-CE 3.32Å; H248-K252 WeakPolarHBondContact NE2-CE 3.49Å; H248-K252 PolarHBondContact NE2-NZ 3.32Å; H248-K252 VanDerWaalsContact NE2-NZ 3.1Å; H248-K252 WeakPolarHBondContact O-CB 3.43Å; H248-K252 WeakPolarHBondContact O-CG 3.01Å; H248-K252 PolarHBondContact O-N 2.86Å; V250-K252 VanDerWaalsContact C-N 3.32Å; V250-K252 PolarHBondContact O-N 3.07Å; K252-P254 WeakPolarHBondContact O-CD 3.33Å
253	T	97.1	Very high	96.4	Very high	32 Å²	32	62.4 Å²	62.4	20%	0.196	32%	0.323	C	S	.	.	S	Bend	trans	-67.4	126	179	-63.9	0	0	0	0	108.5	F209 L249 V250 E251 F255 V256 E257	F209-T253 HydrophobicContact CE1-CG2 3.99Å; F209-T253 HydrophobicContact CE2-CG2 4.34Å; F209-T253 HydrophobicContact CZ-CG2 3.71Å; L249-T253 PolarHBondContact O-N 3.31Å; L249-T253 PolarHBondContact O-OG1 3.13Å; V250-T253 VanDerWaalsContact O-CB 3.28Å; V250-T253 WeakPolarHBondContact O-CB 3.22Å; V250-T253 PolarHBondContact O-N 2.99Å; V250-T253 VanDerWaalsContact O-N 3.1Å; V250-T253 PolarHBondContact O-OG1 3.01Å; E251-T253 VanDerWaalsContact C-N 3.27Å; E251-T253 PolarHBondContact O-N 3.2Å; T253-F255 HydrophobicContact CG2-CB 4.21Å; T253-F255 PolarHBondContact O-N 3.23Å; T253-V256 HydrophobicContact CG2-CG2 4.36Å; T253-V256 WeakPolarHBondContact O-CA 3.4Å; T253-V256 WeakPolarHBondContact O-CB 3.48Å; T253-V256 PolarHBondContact O-N 2.98Å; T253-E257 PolarHBondContact O-N 2.9Å
254	P	96.1	Very high	96.6	Very high	99 Å²	99	65.6 Å²	65.6	64%	0.643	34%	0.336	S	S	*	.	H	α-helix	trans	-54.7	-33.7	-174.8	-30	35.6	0	0	0	114.2	K252 E257 Q258	K252-P254 WeakPolarHBondContact O-CD 3.33Å; P254-E257 PolarHBondContact O-N 3.24Å; P254-Q258 PolarHBondContact O-N 2.92Å
255	F	94.4	Very high	96.8	Very high	25 Å²	25	66.4 Å²	66.4	11%	0.11	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-42.1	173	179.3	-94.9	0	0	0	112.5	F209 I212 I216 I226 L230 T253 Q258 F259	F209-F255 HydrophobicContact CD2-CD1 4.1Å; F209-F255 HydrophobicContact CE2-CB 3.63Å; F209-F255 AromaticContact CE2-CD1 3.47Å; F209-F255 HydrophobicContact CE2-CD1 3.47Å; F209-F255 VanDerWaalsContact CE2-CD1 3.47Å; F209-F255 HydrophobicContact CE2-CD2 4.41Å; F209-F255 HydrophobicContact CE2-CE1 4.21Å; F209-F255 AromaticContact CE2-CG 3.58Å; F209-F255 HydrophobicContact CE2-CG 3.58Å; F209-F255 HydrophobicContact CZ-CB 3.82Å; F209-F255 HydrophobicContact CZ-CD1 4.48Å; F209-F255 HydrophobicContact CZ-CG 4.26Å; I212-F255 HydrophobicContact CG2-CE1 4.06Å; I212-F255 HydrophobicContact CG2-CE2 4.32Å; I212-F255 HydrophobicContact CG2-CZ 3.62Å; I216-F255 HydrophobicContact CD1-CD2 4.49Å; I216-F255 HydrophobicContact CD1-CE2 3.46Å; I216-F255 VanDerWaalsContact CD1-CE2 3.46Å; I216-F255 HydrophobicContact CD1-CZ 3.88Å; I226-F255 HydrophobicContact CG2-CE2 4.24Å; I226-F255 HydrophobicContact CG2-CZ 3.92Å; L230-F255 HydrophobicContact CD1-CE1 4.21Å; L230-F255 HydrophobicContact CD1-CZ 4.15Å; L230-F255 HydrophobicContact CD2-CE1 4.08Å; L230-F255 HydrophobicContact CD2-CZ 4.34Å; T253-F255 HydrophobicContact CG2-CB 4.21Å; T253-F255 PolarHBondContact O-N 3.23Å; F255-Q258 WeakPolarHBondContact O-CB 3.42Å; F255-Q258 PolarHBondContact O-N 2.72Å; F255-F259 HydrophobicContact CD1-CD2 4.38Å; F255-F259 HydrophobicContact CD2-CD2 4.13Å; F255-F259 AromaticContact CD2-CE2 3.93Å; F255-F259 HydrophobicContact CD2-CE2 3.93Å; F255-F259 HydrophobicContact CE1-CD2 4.09Å; F255-F259 AromaticContact CE2-CD2 3.8Å; F255-F259 HydrophobicContact CE2-CD2 3.8Å; F255-F259 AromaticContact CE2-CE2 3.44Å; F255-F259 HydrophobicContact CE2-CE2 3.44Å; F255-F259 VanDerWaalsContact CE2-CE2 3.44Å; F255-F259 HydrophobicContact CG-CD2 4.41Å; F255-F259 AromaticContact CZ-CD2 3.78Å; F255-F259 HydrophobicContact CZ-CD2 3.78Å; F255-F259 AromaticContact CZ-CE2 3.79Å; F255-F259 HydrophobicContact CZ-CE2 3.79Å; F255-F259 VanDerWaalsContact O-CD2 3.3Å; F255-F259 WeakPolarHBondContact O-CD2 3.09Å; F255-F259 PolarHBondContact O-N 2.89Å
256	V	96.3	Very high	97	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.018	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-38.9	177.5	174.8	0	0	0	0	110.6	W205 V250 T253 Q258 F259 S260 F263	W205-V256 HydrophobicContact CH2-CG2 4.36Å; W205-V256 HydrophobicContact CZ2-CG2 3.85Å; V250-V256 HydrophobicContact CG1-CG1 4.49Å; V250-V256 HydrophobicContact CG1-CG2 4.19Å; V250-V256 VanDerWaalsContact O-CB 3.25Å; V250-V256 WeakPolarHBondContact O-CB 3.32Å; V250-V256 WeakPolarHBondContact O-CG1 3.23Å; V250-V256 VanDerWaalsContact O-CG2 3.31Å; V250-V256 WeakPolarHBondContact O-CG2 3.26Å; T253-V256 HydrophobicContact CG2-CG2 4.36Å; T253-V256 WeakPolarHBondContact O-CA 3.4Å; T253-V256 WeakPolarHBondContact O-CB 3.48Å; T253-V256 PolarHBondContact O-N 2.98Å; V256-Q258 VanDerWaalsContact C-N 3.33Å; V256-Q258 PolarHBondContact O-N 3.34Å; V256-F259 CarbonylContact O-C 3.56Å; V256-F259 VanDerWaalsContact O-C 3.24Å; V256-F259 PolarHBondContact O-N 3.24Å; V256-S260 WeakPolarHBondContact O-CA 3.49Å; V256-S260 PolarHBondContact O-N 2.97Å; V256-F263 HydrophobicContact CB-CD2 4.48Å; V256-F263 HydrophobicContact CG1-CB 3.93Å; V256-F263 HydrophobicContact CG1-CD1 3.94Å; V256-F263 HydrophobicContact CG1-CD2 3.9Å; V256-F263 HydrophobicContact CG1-CE1 4.41Å; V256-F263 HydrophobicContact CG1-CE2 4.4Å; V256-F263 HydrophobicContact CG1-CG 3.66Å; V256-F263 HydrophobicContact CG2-CD1 4.34Å; V256-F263 HydrophobicContact CG2-CE1 3.99Å; V256-F263 HydrophobicContact CG2-CE2 4.26Å; V256-F263 HydrophobicContact CG2-CZ 3.97Å
257	E	95.7	Very high	97	Very high	118 Å²	118	62.4 Å²	62.4	55%	0.551	31%	0.312	S	S	*	.	H	α-helix	trans	-59.9	-43	173.5	-66.5	-176.3	161	0	0	111.7	E251 T253 P254 F259 S260	E251-E257 WeakPolarHBondContact O-CG 3.37Å; T253-E257 PolarHBondContact O-N 2.9Å; P254-E257 PolarHBondContact O-N 3.24Å; E257-F259 VanDerWaalsContact C-N 3.29Å; E257-F259 PolarHBondContact O-N 3.49Å; E257-S260 VanDerWaalsContact O-CB 3.25Å; E257-S260 WeakPolarHBondContact O-CB 3.27Å; E257-S260 PolarHBondContact O-N 3.16Å
258	Q	94.1	Very high	97	Very high	132 Å²	132	67.2 Å²	67.2	62%	0.617	34%	0.336	S	S	*	.	H	α-helix	trans	-58.7	-39.8	175.8	-178.1	-178.5	0.2	0	0	112.3	P254 F255 V256	P254-Q258 PolarHBondContact O-N 2.92Å; F255-Q258 WeakPolarHBondContact O-CB 3.42Å; F255-Q258 PolarHBondContact O-N 2.72Å; V256-Q258 VanDerWaalsContact C-N 3.33Å; V256-Q258 PolarHBondContact O-N 3.34Å
259	F	95.7	Very high	97	Very high	11 Å²	11	65 Å²	65	5%	0.048	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	26.1	179.3	-63.1	-75.9	0	0	0	112.9	I226 E227 L230 F255 V256 E257 K261 L262 F263	I226-F259 HydrophobicContact CB-CE1 4.27Å; I226-F259 HydrophobicContact CB-CZ 3.95Å; I226-F259 HydrophobicContact CD1-CZ 4.09Å; I226-F259 HydrophobicContact CG2-CD2 4.47Å; I226-F259 HydrophobicContact CG2-CE1 4.04Å; I226-F259 HydrophobicContact CG2-CE2 3.82Å; I226-F259 HydrophobicContact CG2-CZ 3.56Å; E227-F259 HydrophobicContact CG-CD1 3.93Å; E227-F259 HydrophobicContact CG-CE1 3.91Å; L230-F259 HydrophobicContact CD1-CB 3.88Å; L230-F259 HydrophobicContact CD1-CD1 4.09Å; L230-F259 HydrophobicContact CD1-CD2 3.99Å; L230-F259 HydrophobicContact CD1-CG 3.7Å; F255-F259 HydrophobicContact CD1-CD2 4.38Å; F255-F259 HydrophobicContact CD2-CD2 4.13Å; F255-F259 AromaticContact CD2-CE2 3.93Å; F255-F259 HydrophobicContact CD2-CE2 3.93Å; F255-F259 HydrophobicContact CE1-CD2 4.09Å; F255-F259 AromaticContact CE2-CD2 3.8Å; F255-F259 HydrophobicContact CE2-CD2 3.8Å; F255-F259 AromaticContact CE2-CE2 3.44Å; F255-F259 HydrophobicContact CE2-CE2 3.44Å; F255-F259 VanDerWaalsContact CE2-CE2 3.44Å; F255-F259 HydrophobicContact CG-CD2 4.41Å; F255-F259 AromaticContact CZ-CD2 3.78Å; F255-F259 HydrophobicContact CZ-CD2 3.78Å; F255-F259 AromaticContact CZ-CE2 3.79Å; F255-F259 HydrophobicContact CZ-CE2 3.79Å; F255-F259 VanDerWaalsContact O-CD2 3.3Å; F255-F259 WeakPolarHBondContact O-CD2 3.09Å; F255-F259 PolarHBondContact O-N 2.89Å; V256-F259 CarbonylContact O-C 3.56Å; V256-F259 VanDerWaalsContact O-C 3.24Å; V256-F259 PolarHBondContact O-N 3.24Å; E257-F259 VanDerWaalsContact C-N 3.29Å; E257-F259 PolarHBondContact O-N 3.49Å; F259-K261 PolarHBondContact O-N 3.09Å; F259-L262 WeakPolarHBondContact O-CB 3.43Å; F259-L262 PolarHBondContact O-N 3.11Å; F259-F263 HydrophobicContact CB-CD2 4.21Å; F259-F263 HydrophobicContact CB-CE2 4.05Å
260	S	95.8	Very high	97	Very high	62 Å²	62	60.8 Å²	60.8	43%	0.434	31%	0.305	S	S	.	.	H	α-helix	trans	-51	-39.6	-168.6	173	0	0	0	0	113.8	V256 E257 L262 F263 Q264	V256-S260 WeakPolarHBondContact O-CA 3.49Å; V256-S260 PolarHBondContact O-N 2.97Å; E257-S260 VanDerWaalsContact O-CB 3.25Å; E257-S260 WeakPolarHBondContact O-CB 3.27Å; E257-S260 PolarHBondContact O-N 3.16Å; S260-L262 PolarHBondContact O-N 2.99Å; S260-L262 VanDerWaalsContact O-N 3.17Å; S260-F263 PolarHBondContact O-N 3.21Å; S260-F263 VanDerWaalsContact O-N 3.09Å; S260-Q264 VanDerWaalsContact O-CB 3.3Å; S260-Q264 WeakPolarHBondContact O-CB 3.19Å; S260-Q264 PolarHBondContact O-N 3.14Å
261	K	96.5	Very high	97	Very high	192 Å²	192	63.6 Å²	63.6	84%	0.835	32%	0.315	S	S	*	.	H	α-helix	trans	-56.9	-32.4	178.5	-65.6	-178	-178.3	176.4	0	113.8	F259	F259-K261 PolarHBondContact O-N 3.09Å
262	L	97.7	Very high	97	Very high	44 Å²	44	64.1 Å²	64.1	23%	0.23	32%	0.317	C	S	.	.	H	α-helix	trans	-79.1	-35.8	178.5	-66.3	-178	0	0	0	112.1	E227 L230 L234 F259 S260 Y266	E227-L262 HydrophobicContact CB-CD1 4.01Å; E227-L262 HydrophobicContact CG-CD1 3.94Å; L230-L262 HydrophobicContact CB-CD1 3.9Å; L230-L262 HydrophobicContact CD1-CD1 4.01Å; L234-L262 HydrophobicContact CD1-CB 3.98Å; F259-L262 WeakPolarHBondContact O-CB 3.43Å; F259-L262 PolarHBondContact O-N 3.11Å; S260-L262 PolarHBondContact O-N 2.99Å; S260-L262 VanDerWaalsContact O-N 3.17Å; L262-Y266 WeakPolarHBondContact O-CD2 3.4Å; L262-Y266 VanDerWaalsContact O-CE2 3.24Å; L262-Y266 WeakPolarHBondContact O-CE2 3.43Å
263	F	98.4	Very high	97	Very high	1 Å²	1	59 Å²	59	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-82.1	-33.2	-177.5	-76.1	-93.2	0	0	0	113.2	W205 L230 L234 F239 V256 F259 S260 Y266 L267	W205-F263 AromaticContact CH2-CE1 3.34Å; W205-F263 HydrophobicContact CH2-CE1 3.34Å; W205-F263 AromaticContact CH2-CZ 3.58Å; W205-F263 HydrophobicContact CH2-CZ 3.58Å; W205-F263 HydrophobicContact CZ2-CE1 4.06Å; W205-F263 HydrophobicContact CZ2-CZ 4.42Å; W205-F263 AromaticContact CZ3-CE1 3.82Å; W205-F263 HydrophobicContact CZ3-CE1 3.82Å; W205-F263 HydrophobicContact CZ3-CZ 4.27Å; L230-F263 HydrophobicContact CD1-CE2 4.12Å; L230-F263 HydrophobicContact CD2-CE2 4.35Å; L230-F263 HydrophobicContact CD2-CZ 4.09Å; L234-F263 HydrophobicContact CD1-CD1 4.34Å; L234-F263 HydrophobicContact CD1-CD2 4.32Å; L234-F263 HydrophobicContact CD1-CE1 4.32Å; L234-F263 HydrophobicContact CD1-CE2 4.28Å; L234-F263 HydrophobicContact CD1-CG 4.34Å; L234-F263 HydrophobicContact CD1-CZ 4.27Å; L234-F263 HydrophobicContact CD2-CD1 3.77Å; L234-F263 HydrophobicContact CD2-CE1 3.26Å; L234-F263 HydrophobicContact CD2-CE2 4.46Å; L234-F263 HydrophobicContact CD2-CZ 3.65Å; L234-F263 HydrophobicContact CG-CE1 4.41Å; F239-F263 HydrophobicContact CZ-CD1 4.21Å; F239-F263 HydrophobicContact CZ-CE1 4.24Å; V256-F263 HydrophobicContact CB-CD2 4.48Å; V256-F263 HydrophobicContact CG1-CB 3.93Å; V256-F263 HydrophobicContact CG1-CD1 3.94Å; V256-F263 HydrophobicContact CG1-CD2 3.9Å; V256-F263 HydrophobicContact CG1-CE1 4.41Å; V256-F263 HydrophobicContact CG1-CE2 4.4Å; V256-F263 HydrophobicContact CG1-CG 3.66Å; V256-F263 HydrophobicContact CG2-CD1 4.34Å; V256-F263 HydrophobicContact CG2-CE1 3.99Å; V256-F263 HydrophobicContact CG2-CE2 4.26Å; V256-F263 HydrophobicContact CG2-CZ 3.97Å; F259-F263 HydrophobicContact CB-CD2 4.21Å; F259-F263 HydrophobicContact CB-CE2 4.05Å; S260-F263 PolarHBondContact O-N 3.21Å; S260-F263 VanDerWaalsContact O-N 3.09Å; F263-Y266 PolarHBondContact O-N 2.71Å; F263-L267 HydrophobicContact CB-CD1 4.03Å; F263-L267 HydrophobicContact CB-CG 4.39Å; F263-L267 PolarHBondContact O-N 2.94Å
264	Q	97.9	Very high	96.8	Very high	97 Å²	97	59.1 Å²	59.1	45%	0.453	29%	0.291	S	S	.	.	H	α-helix	trans	-54	-42.9	-170.3	-169.7	-85.7	-9.5	0	0	114	S260 Y266 L267 M268	S260-Q264 VanDerWaalsContact O-CB 3.3Å; S260-Q264 WeakPolarHBondContact O-CB 3.19Å; S260-Q264 PolarHBondContact O-N 3.14Å; Q264-Y266 VanDerWaalsContact C-N 3.32Å; Q264-Y266 PolarHBondContact O-N 2.84Å; Q264-L267 PolarHBondContact O-N 3.32Å; Q264-M268 HydrophobicContact CG-CG 4.18Å; Q264-M268 WeakPolarHBondContact O-CB 3.16Å; Q264-M268 VanDerWaalsContact O-CG 3.28Å; Q264-M268 WeakPolarHBondContact O-CG 3.36Å; Q264-M268 PolarHBondContact O-N 2.86Å
265	P	97.8	Very high	96.7	Very high	71 Å²	71	58.4 Å²	58.4	46%	0.461	29%	0.293	S	S	.	.	H	α-helix	trans	-60.8	-39.8	177.2	-24.9	35.6	0	0	0	113.1	L269	P265-L269 VanDerWaalsContact O-CB 3.28Å; P265-L269 WeakPolarHBondContact O-CB 3.48Å; P265-L269 PolarHBondContact O-N 3.14Å; P265-L269 VanDerWaalsContact O-N 3.16Å
266	Y	98.2	Very high	96.7	Very high	47 Å²	47	59.3 Å²	59.3	18%	0.184	30%	0.299	C	S	.	.	H	α-helix	trans	-72.5	-43.9	-179.6	-57.5	-79	0	0	0	111.7	L234 P235 F239 L262 F263 Q264 L269 A270	L234-Y266 HydrophobicContact CB-CD2 4.03Å; L234-Y266 HydrophobicContact CB-CE1 4.49Å; L234-Y266 HydrophobicContact CB-CE2 3.59Å; L234-Y266 HydrophobicContact CD1-CD2 4.24Å; L234-Y266 HydrophobicContact CD1-CE2 4Å; L234-Y266 HydrophobicContact CG-CE2 4.43Å; P235-Y266 WeakPolarHBondContact CG-OH 3.34Å; F239-Y266 HydrophobicContact CD2-CG 4.32Å; F239-Y266 HydrophobicContact CE2-CG 4.29Å; L262-Y266 WeakPolarHBondContact O-CD2 3.4Å; L262-Y266 VanDerWaalsContact O-CE2 3.24Å; L262-Y266 WeakPolarHBondContact O-CE2 3.43Å; F263-Y266 PolarHBondContact O-N 2.71Å; Q264-Y266 VanDerWaalsContact C-N 3.32Å; Q264-Y266 PolarHBondContact O-N 2.84Å; Y266-L269 PolarHBondContact O-N 3.14Å; Y266-A270 WeakPolarHBondContact O-CB 3.45Å; Y266-A270 PolarHBondContact O-N 2.92Å
267	L	98.4	Very high	96.6	Very high	6 Å²	6	62.1 Å²	62.1	3%	0.031	32%	0.318	C	S	.	.	H	α-helix	trans	-65.2	-45.6	178.2	-66	177.5	0	0	0	111.4	F239 L247 V250 E251 F263 Q264 L269 A270 Y271	F239-L267 HydrophobicContact CD1-CD2 4.1Å; F239-L267 HydrophobicContact CE1-CD2 4.45Å; L247-L267 HydrophobicContact CD2-CD2 3.9Å; V250-L267 HydrophobicContact CG1-CD2 4.18Å; E251-L267 HydrophobicContact CB-CD1 3.95Å; E251-L267 HydrophobicContact CG-CD1 4.09Å; F263-L267 HydrophobicContact CB-CD1 4.03Å; F263-L267 HydrophobicContact CB-CG 4.39Å; F263-L267 PolarHBondContact O-N 2.94Å; Q264-L267 PolarHBondContact O-N 3.32Å; L267-L269 VanDerWaalsContact C-N 3.32Å; L267-L269 PolarHBondContact O-N 3.14Å; L267-A270 WeakPolarHBondContact O-CB 3.02Å; L267-A270 PolarHBondContact O-N 3.14Å; L267-Y271 HydrophobicContact CB-CE2 4.34Å; L267-Y271 WeakPolarHBondContact O-CD2 3.48Å; L267-Y271 PolarHBondContact O-N 2.85Å
268	M	97.9	Very high	96.5	Very high	101 Å²	101	56.5 Å²	56.5	50%	0.498	29%	0.291	S	S	.	.	H	α-helix	trans	-61.4	-41.1	177	-74	-52.2	-60.1	0	0	112.4	Q264 A270 Y271 K272	Q264-M268 HydrophobicContact CG-CG 4.18Å; Q264-M268 WeakPolarHBondContact O-CB 3.16Å; Q264-M268 VanDerWaalsContact O-CG 3.28Å; Q264-M268 WeakPolarHBondContact O-CG 3.36Å; Q264-M268 PolarHBondContact O-N 2.86Å; M268-A270 VanDerWaalsContact C-N 3.35Å; M268-Y271 PolarHBondContact O-N 3.2Å; M268-K272 VanDerWaalsContact O-CB 3.28Å; M268-K272 WeakPolarHBondContact O-CB 3.22Å; M268-K272 PolarHBondContact O-N 3.04Å
269	L	97.9	Very high	96.5	Very high	34 Å²	34	52.8 Å²	52.8	18%	0.178	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-40.4	177.1	-171.3	67.4	0	0	0	111.3	P265 Y266 L267 K272 Y273 E286 F287 F292	P265-L269 VanDerWaalsContact O-CB 3.28Å; P265-L269 WeakPolarHBondContact O-CB 3.48Å; P265-L269 PolarHBondContact O-N 3.14Å; P265-L269 VanDerWaalsContact O-N 3.16Å; Y266-L269 PolarHBondContact O-N 3.14Å; L267-L269 VanDerWaalsContact C-N 3.32Å; L267-L269 PolarHBondContact O-N 3.14Å; L269-K272 PolarHBondContact O-N 2.87Å; L269-Y273 WeakPolarHBondContact O-CB 3.48Å; L269-Y273 PolarHBondContact O-N 2.83Å; L269-E286 HydrophobicContact CD1-CB 4.14Å; L269-E286 HydrophobicContact CD1-CG 3.87Å; L269-F287 HydrophobicContact CD1-CD1 4.11Å; L269-F287 HydrophobicContact CD1-CE1 3.72Å; L269-F287 HydrophobicContact CG-CE1 4.36Å; L269-F292 HydrophobicContact CD1-CZ 4.48Å; L269-F292 HydrophobicContact CD2-CE2 3.98Å; L269-F292 HydrophobicContact CD2-CZ 3.72Å; L269-F292 HydrophobicContact CG-CZ 3.87Å
270	A	98.5	Very high	96.4	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-63.3	-47.9	174.9	0	0	0	0	0	112.2	F239 P240 L247 Y266 L267 M268 K272 Y273 R274	F239-A270 HydrophobicContact CB-CB 3.8Å; P240-A270 HydrophobicContact CB-CB 4.48Å; P240-A270 HydrophobicContact CG-CB 4.14Å; L247-A270 HydrophobicContact CD1-CB 3.74Å; L247-A270 HydrophobicContact CD2-CB 3.85Å; L247-A270 HydrophobicContact CG-CB 4.48Å; Y266-A270 WeakPolarHBondContact O-CB 3.45Å; Y266-A270 PolarHBondContact O-N 2.92Å; L267-A270 WeakPolarHBondContact O-CB 3.02Å; L267-A270 PolarHBondContact O-N 3.14Å; M268-A270 VanDerWaalsContact C-N 3.35Å; A270-K272 PolarHBondContact O-N 3.15Å; A270-Y273 WeakPolarHBondContact O-CB 3.42Å; A270-Y273 PolarHBondContact O-N 2.8Å; A270-R274 WeakPolarHBondContact O-CG 3.47Å; A270-R274 PolarHBondContact O-N 3.16Å
271	Y	98	Very high	96.4	Very high	58 Å²	58	52.3 Å²	52.3	23%	0.227	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-44.3	175.1	-73.5	-55.9	0	0	0	111.9	L247 H248 E251 L267 M268 Y273 R274 A275	L247-Y271 HydrophobicContact CB-CD1 4.35Å; L247-Y271 HydrophobicContact CB-CE1 3.6Å; L247-Y271 HydrophobicContact CD1-CD1 3.85Å; L247-Y271 HydrophobicContact CD1-CE1 3.96Å; L247-Y271 HydrophobicContact CD1-CG 4.41Å; L247-Y271 HydrophobicContact CG-CE1 4.44Å; H248-Y271 WeakPolarHBondContact CA-OH 3.31Å; H248-Y271 PolarHBondContact N-OH 2.87Å; E251-Y271 WeakPolarHBondContact OE2-CE2 3.4Å; E251-Y271 PolarHBondContact OE2-OH 3.35Å; L267-Y271 HydrophobicContact CB-CE2 4.34Å; L267-Y271 WeakPolarHBondContact O-CD2 3.48Å; L267-Y271 PolarHBondContact O-N 2.85Å; M268-Y271 PolarHBondContact O-N 3.2Å; Y271-Y273 PolarHBondContact O-N 2.78Å; Y271-R274 PolarHBondContact O-N 2.63Å; Y271-R274 VanDerWaalsContact O-N 3.16Å; Y271-A275 WeakPolarHBondContact O-CB 3.43Å; Y271-A275 PolarHBondContact O-N 2.89Å
272	K	97.7	Very high	96.1	Very high	95 Å²	95	45 Å²	45	41%	0.413	26%	0.256	S	S	.	.	H	α-helix	trans	-59.8	-46.3	176.4	-171.9	-174.7	-177.3	179.6	0	111.5	M268 L269 A270 R274 A275 L276 E286 F287	M268-K272 VanDerWaalsContact O-CB 3.28Å; M268-K272 WeakPolarHBondContact O-CB 3.22Å; M268-K272 PolarHBondContact O-N 3.04Å; L269-K272 PolarHBondContact O-N 2.87Å; A270-K272 PolarHBondContact O-N 3.15Å; K272-R274 VanDerWaalsContact C-N 3.29Å; K272-R274 PolarHBondContact O-N 3.13Å; K272-A275 PolarHBondContact O-N 3.39Å; K272-L276 HydrophobicContact CG-CD1 4.1Å; K272-L276 WeakPolarHBondContact O-CG 3.47Å; K272-L276 PolarHBondContact O-N 2.75Å; K272-L276 VanDerWaalsContact O-N 3.13Å; K272-E286 WeakPolarHBondContact CD-OE1 3.48Å; K272-E286 WeakPolarHBondContact CE-OE1 3.36Å; K272-E286 IonicContact NZ-OE1 3.17Å; K272-E286 PolarHBondContact NZ-OE1 3.03Å; K272-E286 IonicContact NZ-OE2 2.77Å; K272-E286 PolarHBondContact NZ-OE2 2.99Å; K272-E286 VanDerWaalsContact NZ-OE2 3.09Å; K272-F287 HydrophobicContact CB-CZ 4.48Å; K272-F287 HydrophobicContact CD-CZ 4.26Å; K272-F287 HydrophobicContact CG-CZ 4.09Å
273	Y	96.4	Very high	95.6	Very high	12 Å²	12	46 Å²	46	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-56.6	-45	174.8	-178.3	-105.4	0	0	0	110.8	P240 M241 L269 A270 Y271 R281 F287 F292 M373	P240-Y273 HydrophobicContact CB-CD1 3.74Å; P240-Y273 HydrophobicContact CB-CE1 4.3Å; P240-Y273 HydrophobicContact CB-CG 4.13Å; M241-Y273 HydrophobicContact CE-CE1 4.15Å; L269-Y273 WeakPolarHBondContact O-CB 3.48Å; L269-Y273 PolarHBondContact O-N 2.83Å; A270-Y273 WeakPolarHBondContact O-CB 3.42Å; A270-Y273 PolarHBondContact O-N 2.8Å; Y271-Y273 PolarHBondContact O-N 2.78Å; Y273-R281 HydrophobicContact CD2-CG 4.14Å; Y273-R281 HydrophobicContact CE2-CB 4.27Å; Y273-R281 HydrophobicContact CE2-CG 4.15Å; Y273-R281 PolarHBondContact O-NE 2.95Å; Y273-R281 PolarHBondContact O-NH2 2.87Å; Y273-F287 HydrophobicContact CD2-CB 4.13Å; Y273-F287 AromaticContact CD2-CD1 3.9Å; Y273-F287 HydrophobicContact CD2-CD1 3.9Å; Y273-F287 AromaticContact CD2-CD2 3.61Å; Y273-F287 HydrophobicContact CD2-CD2 3.61Å; Y273-F287 HydrophobicContact CD2-CE1 4.18Å; Y273-F287 AromaticContact CD2-CE2 3.93Å; Y273-F287 HydrophobicContact CD2-CE2 3.93Å; Y273-F287 AromaticContact CD2-CG 3.63Å; Y273-F287 HydrophobicContact CD2-CG 3.63Å; Y273-F287 HydrophobicContact CD2-CZ 4.21Å; Y273-F287 HydrophobicContact CE2-CB 4.28Å; Y273-F287 HydrophobicContact CE2-CD2 4.21Å; Y273-F287 HydrophobicContact CE2-CG 4.24Å; Y273-F292 HydrophobicContact CD1-CE1 4.44Å; Y273-F292 AromaticContact CD2-CD1 3.66Å; Y273-F292 HydrophobicContact CD2-CD1 3.66Å; Y273-F292 AromaticContact CD2-CE1 3.51Å; Y273-F292 HydrophobicContact CD2-CE1 3.51Å; Y273-F292 AromaticContact CE2-CD1 3.68Å; Y273-F292 HydrophobicContact CE2-CD1 3.68Å; Y273-F292 HydrophobicContact CE2-CE1 4.04Å; Y273-F292 HydrophobicContact CG-CD1 4.11Å; Y273-F292 AromaticContact CG-CE1 3.73Å; Y273-F292 HydrophobicContact CG-CE1 3.73Å; Y273-M373 WeakPolarHBondContact OH-CE 3.3Å
274	R	93.6	Very high	95.4	Very high	33 Å²	33	47.7 Å²	47.7	13%	0.125	29%	0.288	C	S	.	.	H	α-helix	trans	-69.2	-40	179.8	-67.4	-50	-173.9	112.6	-3.9	114.5	P240 M241 M242 A270 Y271 K272 L276 R281 W302 R432	P240-R274 VanDerWaalsContact O-CZ 3.26Å; P240-R274 PolarHBondContact O-NE 3.47Å; P240-R274 PolarHBondContact O-NH2 2.87Å; M241-R274 PolarHBondContact O-NH2 2.83Å; M242-R274 PolarHBondContact O-NE 2.87Å; M242-R274 PolarHBondContact O-NH1 3.5Å; M242-R274 PolarHBondContact O-NH2 3.26Å; A270-R274 WeakPolarHBondContact O-CG 3.47Å; A270-R274 PolarHBondContact O-N 3.16Å; Y271-R274 PolarHBondContact O-N 2.63Å; Y271-R274 VanDerWaalsContact O-N 3.16Å; K272-R274 VanDerWaalsContact C-N 3.29Å; K272-R274 PolarHBondContact O-N 3.13Å; R274-L276 VanDerWaalsContact C-N 3.35Å; R274-R281 PolarHBondContact O-NH2 3.42Å; R274-W302 VanDerWaalsContact NH1-CE2 3.33Å; R274-R432 PolarHBondContact O-NH1 3.1Å
275	A	94.3	Very high	95.2	Very high	84 Å²	84	54 Å²	54	69%	0.694	31%	0.307	S	S	*	.	H	α-helix	trans	-68.1	-33.2	-178.8	0	0	0	0	0	112.6	Y271 K272	Y271-A275 WeakPolarHBondContact O-CB 3.43Å; Y271-A275 PolarHBondContact O-N 2.89Å; K272-A275 PolarHBondContact O-N 3.39Å
276	L	94.8	Very high	95	Very high	44 Å²	44	54 Å²	54	23%	0.23	30%	0.301	C	S	.	.	S	Bend	trans	-73.8	140.6	-177.4	-73.2	172.8	0	0	0	112.8	K272 R274 R281 F287	K272-L276 HydrophobicContact CG-CD1 4.1Å; K272-L276 WeakPolarHBondContact O-CG 3.47Å; K272-L276 PolarHBondContact O-N 2.75Å; K272-L276 VanDerWaalsContact O-N 3.13Å; R274-L276 VanDerWaalsContact C-N 3.35Å; L276-R281 HydrophobicContact CB-CG 4.01Å; L276-R281 PolarHBondContact O-NE 2.9Å; L276-R281 PolarHBondContact O-NH2 3.49Å; L276-F287 HydrophobicContact CD1-CE2 3.69Å; L276-F287 HydrophobicContact CD1-CZ 3.86Å
277	P	92.8	Very high	95	Very high	63 Å²	63	52.3 Å²	52.3	41%	0.409	30%	0.295	S	S	.	.			trans	-56.6	152.9	165.4	-22.2	33	0	0	0	111.2	A279 S280 R281	P277-A279 PolarHBondContact O-N 3.2Å; P277-S280 PolarHBondContact O-N 3.44Å; P277-R281 WeakPolarHBondContact O-CG 3.29Å; P277-R281 PolarHBondContact O-N 3.03Å; P277-R281 VanDerWaalsContact O-N 3.11Å
278	L	95.2	Very high	94.8	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-37.6	-176.5	-59.8	-175.6	0	0	0	111.9	S280 R281 A282 E371 M373 T430 R432	L278-S280 VanDerWaalsContact C-N 3.27Å; L278-S280 PolarHBondContact O-N 3.19Å; L278-R281 WeakPolarHBondContact O-CB 3.3Å; L278-R281 PolarHBondContact O-N 3.49Å; L278-R281 VanDerWaalsContact O-N 3.13Å; L278-A282 PolarHBondContact O-N 3.49Å; L278-E371 VanDerWaalsContact CB-CD 3.43Å; L278-E371 HydrophobicContact CB-CG 3.9Å; L278-E371 HydrophobicContact CD1-CB 4.22Å; L278-E371 HydrophobicContact CD1-CG 3.98Å; L278-E371 WeakPolarHBondContact CD1-O 3.33Å; L278-E371 HydrophobicContact CG-CG 4.09Å; L278-E371 WeakPolarHBondContact CG-OE2 3.48Å; L278-E371 PolarHBondContact N-OE1 3.29Å; L278-E371 VanDerWaalsContact N-OE1 3.13Å; L278-E371 PolarHBondContact N-OE2 3.26Å; L278-M373 HydrophobicContact CB-CB 4.1Å; L278-M373 HydrophobicContact CD1-CB 3.99Å; L278-M373 HydrophobicContact CD2-CB 4.49Å; L278-M373 HydrophobicContact CG-CB 4.43Å; L278-T430 HydrophobicContact CD1-CG2 3.9Å; L278-T430 HydrophobicContact CD2-CG2 3.69Å; L278-T430 HydrophobicContact CG-CG2 4.47Å; L278-R432 HydrophobicContact CD1-CB 4.41Å; L278-R432 HydrophobicContact CD1-CG 4.16Å; L278-R432 HydrophobicContact CD2-CG 4.32Å; L278-R432 HydrophobicContact CG-CG 4.33Å
279	A	92.6	Very high	94.6	Very high	54 Å²	54	52.2 Å²	52.2	45%	0.446	30%	0.303	S	S	.	.	H	α-helix	trans	-56.5	-39.8	175.5	0	0	0	0	0	113.4	P277 E371 V387	P277-A279 PolarHBondContact O-N 3.2Å; A279-E371 PolarHBondContact N-OE1 2.85Å; A279-E371 VanDerWaalsContact N-OE1 3.07Å; A279-V387 HydrophobicContact CB-CG2 4.33Å
280	S	94.6	Very high	94.5	Very high	56 Å²	56	52.7 Å²	52.7	39%	0.392	31%	0.311	S	S	.	.	H	α-helix	trans	-73.8	-35.2	177.7	-57.9	0	0	0	0	112	P277 L278 A282 G283 C284	P277-S280 PolarHBondContact O-N 3.44Å; L278-S280 VanDerWaalsContact C-N 3.27Å; L278-S280 PolarHBondContact O-N 3.19Å; S280-A282 PolarHBondContact O-N 3.01Å; S280-G283 PolarHBondContact O-N 3.06Å; S280-C284 PolarHBondContact O-SG 3.42Å
281	R	95	Very high	94.5	Very high	7 Å²	7	54 Å²	54	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-45.2	179.3	-65	175.6	-165.3	-164.7	-6.5	112	Y273 R274 L276 P277 L278 G283 C284 F287 M373	Y273-R281 HydrophobicContact CD2-CG 4.14Å; Y273-R281 HydrophobicContact CE2-CB 4.27Å; Y273-R281 HydrophobicContact CE2-CG 4.15Å; Y273-R281 PolarHBondContact O-NE 2.95Å; Y273-R281 PolarHBondContact O-NH2 2.87Å; R274-R281 PolarHBondContact O-NH2 3.42Å; L276-R281 HydrophobicContact CB-CG 4.01Å; L276-R281 PolarHBondContact O-NE 2.9Å; L276-R281 PolarHBondContact O-NH2 3.49Å; P277-R281 WeakPolarHBondContact O-CG 3.29Å; P277-R281 PolarHBondContact O-N 3.03Å; P277-R281 VanDerWaalsContact O-N 3.11Å; L278-R281 WeakPolarHBondContact O-CB 3.3Å; L278-R281 PolarHBondContact O-N 3.49Å; L278-R281 VanDerWaalsContact O-N 3.13Å; R281-G283 PolarHBondContact O-N 3.4Å; R281-G283 VanDerWaalsContact O-N 3.14Å; R281-C284 PolarHBondContact O-N 3.43Å; R281-F287 HydrophobicContact CB-CD2 3.99Å; R281-F287 HydrophobicContact CB-CE2 4.28Å; R281-F287 HydrophobicContact CG-CD2 4.28Å; R281-F287 HydrophobicContact CG-CE2 4.15Å; R281-M373 HydrophobicContact CB-SD 4.26Å
282	A	90.4	Very high	94.4	Very high	39 Å²	39	51.2 Å²	51.2	32%	0.322	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24	-178.4	0	0	0	0	0	113.5	L278 S280 M373 V387	L278-A282 PolarHBondContact O-N 3.49Å; S280-A282 PolarHBondContact O-N 3.01Å; A282-M373 HydrophobicContact CB-SD 4.43Å; A282-V387 HydrophobicContact CB-CG1 3.53Å; A282-V387 HydrophobicContact CB-CG2 4.48Å
283	G	87.6	Confident	94.5	Very high	65 Å²	65	46.8 Å²	46.8	67%	0.67	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-12.5	176.3	0	0	0	0	0	114.8	S280 R281 R285	S280-G283 PolarHBondContact O-N 3.06Å; R281-G283 PolarHBondContact O-N 3.4Å; R281-G283 VanDerWaalsContact O-N 3.14Å; G283-R285 PolarHBondContact O-N 2.95Å
284	C	94.4	Very high	94.5	Very high	35 Å²	35	46.3 Å²	46.3	24%	0.236	29%	0.285	C	S	.	.			trans	-88.6	108.9	-174.3	-72	0	0	0	0	111.3	S280 R281 E286 F287	S280-C284 PolarHBondContact O-SG 3.42Å; R281-C284 PolarHBondContact O-N 3.43Å; C284-E286 HydrophobicContact CB-CG 4.27Å; C284-E286 PolarHBondContact O-N 3.29Å; C284-F287 HydrophobicContact CB-CD2 3.35Å; C284-F287 HydrophobicContact CB-CE2 3.53Å; C284-F287 HydrophobicContact CB-CG 3.97Å; C284-F287 HydrophobicContact CB-CZ 4.31Å; C284-F287 PolarHBondContact O-N 2.83Å
285	R	92.7	Very high	94.7	Very high	229 Å²	229	44.8 Å²	44.8	86%	0.864	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-59.5	-29.3	179.6	-65.9	-176.6	179.6	-178	-0.7	114.1	G283 F287 S288	G283-R285 PolarHBondContact O-N 2.95Å; R285-F287 PolarHBondContact O-N 3.28Å; R285-S288 PolarHBondContact O-N 3.09Å; R285-S288 PolarHBondContact O-OG 3.12Å
286	E	94.9	Very high	94.8	Very high	72 Å²	72	42.8 Å²	42.8	34%	0.336	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-64.9	-17.9	176.6	65.9	-169.3	164.9	0	0	113	L269 K272 C284 S288 F292	L269-E286 HydrophobicContact CD1-CB 4.14Å; L269-E286 HydrophobicContact CD1-CG 3.87Å; K272-E286 WeakPolarHBondContact CD-OE1 3.48Å; K272-E286 WeakPolarHBondContact CE-OE1 3.36Å; K272-E286 IonicContact NZ-OE1 3.17Å; K272-E286 PolarHBondContact NZ-OE1 3.03Å; K272-E286 IonicContact NZ-OE2 2.77Å; K272-E286 PolarHBondContact NZ-OE2 2.99Å; K272-E286 VanDerWaalsContact NZ-OE2 3.09Å; C284-E286 HydrophobicContact CB-CG 4.27Å; C284-E286 PolarHBondContact O-N 3.29Å; E286-S288 VanDerWaalsContact C-N 3.33Å; E286-F292 WeakPolarHBondContact O-CE2 3.25Å
287	F	96.6	Very high	94.9	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.048	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-92.7	17.4	179.1	-55.6	-27.2	0	0	0	114.1	L269 K272 Y273 L276 R281 C284 R285 F292	L269-F287 HydrophobicContact CD1-CD1 4.11Å; L269-F287 HydrophobicContact CD1-CE1 3.72Å; L269-F287 HydrophobicContact CG-CE1 4.36Å; K272-F287 HydrophobicContact CB-CZ 4.48Å; K272-F287 HydrophobicContact CD-CZ 4.26Å; K272-F287 HydrophobicContact CG-CZ 4.09Å; Y273-F287 HydrophobicContact CD2-CB 4.13Å; Y273-F287 AromaticContact CD2-CD1 3.9Å; Y273-F287 HydrophobicContact CD2-CD1 3.9Å; Y273-F287 AromaticContact CD2-CD2 3.61Å; Y273-F287 HydrophobicContact CD2-CD2 3.61Å; Y273-F287 HydrophobicContact CD2-CE1 4.18Å; Y273-F287 AromaticContact CD2-CE2 3.93Å; Y273-F287 HydrophobicContact CD2-CE2 3.93Å; Y273-F287 AromaticContact CD2-CG 3.63Å; Y273-F287 HydrophobicContact CD2-CG 3.63Å; Y273-F287 HydrophobicContact CD2-CZ 4.21Å; Y273-F287 HydrophobicContact CE2-CB 4.28Å; Y273-F287 HydrophobicContact CE2-CD2 4.21Å; Y273-F287 HydrophobicContact CE2-CG 4.24Å; L276-F287 HydrophobicContact CD1-CE2 3.69Å; L276-F287 HydrophobicContact CD1-CZ 3.86Å; R281-F287 HydrophobicContact CB-CD2 3.99Å; R281-F287 HydrophobicContact CB-CE2 4.28Å; R281-F287 HydrophobicContact CG-CD2 4.28Å; R281-F287 HydrophobicContact CG-CE2 4.15Å; C284-F287 HydrophobicContact CB-CD2 3.35Å; C284-F287 HydrophobicContact CB-CE2 3.53Å; C284-F287 HydrophobicContact CB-CG 3.97Å; C284-F287 HydrophobicContact CB-CZ 4.31Å; C284-F287 PolarHBondContact O-N 2.83Å; R285-F287 PolarHBondContact O-N 3.28Å; F287-F292 VanDerWaalsContact C-CD2 3.44Å; F287-F292 HydrophobicContact CB-CD1 3.87Å; F287-F292 HydrophobicContact CB-CD2 4.46Å; F287-F292 HydrophobicContact CB-CE1 3.84Å; F287-F292 HydrophobicContact CB-CE2 4.45Å; F287-F292 HydrophobicContact CB-CG 4.19Å; F287-F292 HydrophobicContact CB-CZ 4.15Å; F287-F292 HydrophobicContact CD1-CD1 4.26Å; F287-F292 AromaticContact CD1-CE1 3.36Å; F287-F292 HydrophobicContact CD1-CE1 3.36Å; F287-F292 HydrophobicContact CD1-CE2 4.26Å; F287-F292 AromaticContact CD1-CZ 3.38Å; F287-F292 HydrophobicContact CD1-CZ 3.38Å; F287-F292 HydrophobicContact CE1-CE1 4.18Å; F287-F292 HydrophobicContact CE1-CZ 4.21Å; F287-F292 HydrophobicContact CG-CD1 4.31Å; F287-F292 AromaticContact CG-CE1 3.84Å; F287-F292 HydrophobicContact CG-CE1 3.84Å; F287-F292 HydrophobicContact CG-CZ 4.15Å; F287-F292 VanDerWaalsContact O-CB 3.27Å; F287-F292 WeakPolarHBondContact O-CB 3.5Å; F287-F292 WeakPolarHBondContact O-CG 3.02Å
288	S	94	Very high	95	Very high	46 Å²	46	42.1 Å²	42.1	32%	0.322	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-101.5	-2.7	-176.9	75.6	0	0	0	0	114.3	R285 E286 A381 V382	R285-S288 PolarHBondContact O-N 3.09Å; R285-S288 PolarHBondContact O-OG 3.12Å; E286-S288 VanDerWaalsContact C-N 3.33Å; S288-A381 CarbonylContact O-C 3.54Å; S288-A381 WeakPolarHBondContact O-CA 3.44Å; S288-A381 WeakPolarHBondContact O-CB 3.38Å; S288-V382 PolarHBondContact O-N 2.7Å
289	T	95.5	Very high	94.8	Very high	60 Å²	60	47.7 Å²	47.7	37%	0.368	27%	0.274	S	S	.	.	B	Isolated β-bridge	trans	-83.9	174.2	-174.2	66.2	0	0	0	0	112.8	Q291 F292 K380	T289-Q291 PolarHBondContact O-N 2.84Å; T289-F292 PolarHBondContact O-N 3.47Å; T289-F292 WeakPolarHBondContact OG1-CD2 3.33Å; T289-K380 CarbonylContact C-O 3.56Å
290	A	95.7	Very high	94.7	Very high	44 Å²	44	48.6 Å²	48.6	36%	0.364	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-54.9	-25.5	180	0	0	0	0	0	114.5	F292 L293 K380	A290-F292 PolarHBondContact O-N 3.2Å; A290-L293 HydrophobicContact CB-CD1 4.36Å; A290-L293 WeakPolarHBondContact O-CB 3.28Å; A290-L293 PolarHBondContact O-N 3.48Å; A290-L293 VanDerWaalsContact O-N 3.14Å; A290-K380 WeakPolarHBondContact CA-O 3.41Å; A290-K380 PolarHBondContact N-O 3.45Å
291	Q	96.9	Very high	94.5	Very high	26 Å²	26	46.4 Å²	46.4	12%	0.121	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-66	-15.9	176.3	-67.5	178.6	56.7	0	0	113.5	P235 T289	P235-Q291 WeakPolarHBondContact O-CG 3.09Å; T289-Q291 PolarHBondContact O-N 2.84Å
292	F	97.6	Very high	94.3	Very high	1 Å²	1	48.4 Å²	48.4	0%	0.004	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-99.9	1.6	178.5	-60.3	-86.5	0	0	0	112.9	P240 L269 Y273 E286 F287 T289 A290 V382 Q428	P240-F292 HydrophobicContact CB-CD1 3.98Å; P240-F292 HydrophobicContact CB-CE1 3.72Å; P240-F292 HydrophobicContact CB-CZ 4.46Å; P240-F292 HydrophobicContact CG-CD1 4.1Å; P240-F292 HydrophobicContact CG-CE1 3.56Å; P240-F292 HydrophobicContact CG-CZ 3.8Å; L269-F292 HydrophobicContact CD1-CZ 4.48Å; L269-F292 HydrophobicContact CD2-CE2 3.98Å; L269-F292 HydrophobicContact CD2-CZ 3.72Å; L269-F292 HydrophobicContact CG-CZ 3.87Å; Y273-F292 HydrophobicContact CD1-CE1 4.44Å; Y273-F292 AromaticContact CD2-CD1 3.66Å; Y273-F292 HydrophobicContact CD2-CD1 3.66Å; Y273-F292 AromaticContact CD2-CE1 3.51Å; Y273-F292 HydrophobicContact CD2-CE1 3.51Å; Y273-F292 AromaticContact CE2-CD1 3.68Å; Y273-F292 HydrophobicContact CE2-CD1 3.68Å; Y273-F292 HydrophobicContact CE2-CE1 4.04Å; Y273-F292 HydrophobicContact CG-CD1 4.11Å; Y273-F292 AromaticContact CG-CE1 3.73Å; Y273-F292 HydrophobicContact CG-CE1 3.73Å; E286-F292 WeakPolarHBondContact O-CE2 3.25Å; F287-F292 VanDerWaalsContact C-CD2 3.44Å; F287-F292 HydrophobicContact CB-CD1 3.87Å; F287-F292 HydrophobicContact CB-CD2 4.46Å; F287-F292 HydrophobicContact CB-CE1 3.84Å; F287-F292 HydrophobicContact CB-CE2 4.45Å; F287-F292 HydrophobicContact CB-CG 4.19Å; F287-F292 HydrophobicContact CB-CZ 4.15Å; F287-F292 HydrophobicContact CD1-CD1 4.26Å; F287-F292 AromaticContact CD1-CE1 3.36Å; F287-F292 HydrophobicContact CD1-CE1 3.36Å; F287-F292 HydrophobicContact CD1-CE2 4.26Å; F287-F292 AromaticContact CD1-CZ 3.38Å; F287-F292 HydrophobicContact CD1-CZ 3.38Å; F287-F292 HydrophobicContact CE1-CE1 4.18Å; F287-F292 HydrophobicContact CE1-CZ 4.21Å; F287-F292 HydrophobicContact CG-CD1 4.31Å; F287-F292 AromaticContact CG-CE1 3.84Å; F287-F292 HydrophobicContact CG-CE1 3.84Å; F287-F292 HydrophobicContact CG-CZ 4.15Å; F287-F292 VanDerWaalsContact O-CB 3.27Å; F287-F292 WeakPolarHBondContact O-CB 3.5Å; F287-F292 WeakPolarHBondContact O-CG 3.02Å; T289-F292 PolarHBondContact O-N 3.47Å; T289-F292 WeakPolarHBondContact OG1-CD2 3.33Å; A290-F292 PolarHBondContact O-N 3.2Å; F292-V382 HydrophobicContact CB-CG2 4.11Å; F292-Q428 PolarHBondContact O-NE2 3.02Å
293	L	98	Very high	94.5	Very high	1 Å²	1	47 Å²	47	1%	0.005	25%	0.248	C	C	.	.	S	Bend	trans	-79.9	136.7	173.4	-58.3	-178.3	0	0	0	110.3	R238 A290 V377 N378 D379 V382 Q428	R238-L293 WeakPolarHBondContact CD-O 3.33Å; R238-L293 PolarHBondContact NH1-O 3.15Å; A290-L293 HydrophobicContact CB-CD1 4.36Å; A290-L293 WeakPolarHBondContact O-CB 3.28Å; A290-L293 PolarHBondContact O-N 3.48Å; A290-L293 VanDerWaalsContact O-N 3.14Å; L293-V377 HydrophobicContact CD2-CB 3.6Å; L293-V377 HydrophobicContact CD2-CG1 3.89Å; L293-V377 HydrophobicContact CD2-CG2 4.08Å; L293-N378 VanDerWaalsContact CD1-O 3.29Å; L293-N378 WeakPolarHBondContact CD1-O 3.49Å; L293-D379 WeakPolarHBondContact CD1-O 3.49Å; L293-V382 HydrophobicContact CD2-CG2 4.17Å; L293-Q428 VanDerWaalsContact CA-OE1 3.25Å
294	L	97.8	Very high	94.9	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.01	23%	0.234	C	C	.	.			trans	-76.2	141.9	174.8	-69.5	173.2	0	0	0	110.3	R238 M241 Y297 D303 R305 Q428	R238-L294 PolarHBondContact NH1-O 3.09Å; M241-L294 HydrophobicContact CG-CD2 4.32Å; M241-L294 HydrophobicContact SD-CD2 3.38Å; M241-L294 WeakPolarHBondContact SD-CD2 3.45Å; M241-L294 HydrophobicContact SD-CG 4.46Å; L294-Y297 HydrophobicContact CB-CE2 4.43Å; L294-Y297 HydrophobicContact CD2-CD2 4.14Å; L294-Y297 HydrophobicContact CD2-CE2 3.72Å; L294-D303 HydrophobicContact CD1-CB 3.89Å; L294-D303 HydrophobicContact CD2-CB 4.17Å; L294-D303 VanDerWaalsContact CD2-OD1 3.3Å; L294-D303 WeakPolarHBondContact CD2-OD1 3.16Å; L294-R305 HydrophobicContact CB-CB 3.96Å; L294-R305 HydrophobicContact CD1-CB 4.37Å; L294-R305 WeakPolarHBondContact O-CD 2.88Å; L294-Q428 HydrophobicContact CB-CG 4.14Å; L294-Q428 HydrophobicContact CD1-CB 3.85Å; L294-Q428 HydrophobicContact CD1-CG 3.83Å; L294-Q428 HydrophobicContact CG-CB 4.45Å; L294-Q428 HydrophobicContact CG-CG 4.04Å; L294-Q428 VanDerWaalsContact N-CD 3.3Å
295	R	97.5	Very high	95	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.008	23%	0.226	C	C	.	.			trans	-84.9	-177.3	157.5	-59.6	-174.3	-164.5	-86.8	3.3	109.1	L191 S193 S194 E201 H236 R238 Y297	L191-R295 VanDerWaalsContact O-CZ 3.25Å; L191-R295 PolarHBondContact O-NH1 3.38Å; L191-R295 PolarHBondContact O-NH2 3.36Å; S193-R295 PolarHBondContact O-NH1 3.14Å; S194-R295 WeakPolarHBondContact O-CA 3.24Å; E201-R295 IonicContact OE1-NE 3.72Å; E201-R295 IonicContact OE1-NH2 2.74Å; E201-R295 WeakPolarHBondContact OE2-CD 3.2Å; E201-R295 IonicContact OE2-NE 2.72Å; E201-R295 PolarHBondContact OE2-NE 3.02Å; E201-R295 VanDerWaalsContact OE2-NE 3.15Å; H236-R295 PolarHBondContact O-NH2 3.01Å; R238-R295 VanDerWaalsContact NH1-N 3.18Å; R295-Y297 HydrophobicContact CB-CD1 4.46Å; R295-Y297 HydrophobicContact CB-CE1 3.88Å; R295-Y297 HydrophobicContact CB-CE2 4.34Å; R295-Y297 HydrophobicContact CG-CE1 4.45Å; R295-Y297 PolarHBondContact O-N 3.01Å; R295-Y297 VanDerWaalsContact O-N 3.16Å
296	N	97	Very high	95.1	Very high	42 Å²	42	36.7 Å²	36.7	23%	0.225	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	83.9	173.3	-65.5	-40.9	0	0	0	110.1	E195 L196 V197 V198 R305	E195-N296 WeakPolarHBondContact CA-ND2 3.14Å; E195-N296 PolarHBondContact O-ND2 3.2Å; L196-N296 PolarHBondContact O-N 3.17Å; L196-N296 VanDerWaalsContact O-N 3.09Å; V197-N296 VanDerWaalsContact CA-O 3.31Å; V197-N296 WeakPolarHBondContact CA-O 3.49Å; V197-N296 HydrophobicContact CB-CB 4.41Å; V197-N296 HydrophobicContact CG2-CB 3.81Å; V198-N296 PolarHBondContact N-O 2.9Å; V198-N296 VanDerWaalsContact N-O 3.07Å; N296-R305 PolarHBondContact OD1-NH1 2.95Å
297	Y	96.1	Very high	95.1	Very high	10 Å²	10	35.8 Å²	35.8	4%	0.039	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	132	178.4	-56.3	-61	0	0	0	112.2	V198 E201 M241 L294 R295 K304	V198-Y297 HydrophobicContact CG2-CD1 3.65Å; V198-Y297 HydrophobicContact CG2-CE1 3.7Å; V198-Y297 CarbonylContact O-C 3.51Å; V198-Y297 VanDerWaalsContact O-CA 3.28Å; V198-Y297 WeakPolarHBondContact O-CA 3.42Å; E201-Y297 HydrophobicContact CB-CE1 3.91Å; E201-Y297 WeakPolarHBondContact OE2-CE1 3.21Å; E201-Y297 PolarHBondContact OE2-OH 3.44Å; M241-Y297 HydrophobicContact CB-CE2 4.09Å; M241-Y297 WeakPolarHBondContact CB-OH 3.42Å; M241-Y297 HydrophobicContact CG-CE2 4.24Å; L294-Y297 HydrophobicContact CB-CE2 4.43Å; L294-Y297 HydrophobicContact CD2-CD2 4.14Å; L294-Y297 HydrophobicContact CD2-CE2 3.72Å; R295-Y297 HydrophobicContact CB-CD1 4.46Å; R295-Y297 HydrophobicContact CB-CE1 3.88Å; R295-Y297 HydrophobicContact CB-CE2 4.34Å; R295-Y297 HydrophobicContact CG-CE1 4.45Å; R295-Y297 PolarHBondContact O-N 3.01Å; R295-Y297 VanDerWaalsContact O-N 3.16Å; Y297-K304 PolarHBondContact O-NZ 2.87Å
298	T	94.5	Very high	95	Very high	82 Å²	82	35.6 Å²	35.6	50%	0.503	19%	0.186	S	C	.	.			trans	-91.8	-28.3	177.5	66.3	0	0	0	0	113.2	V197 V198 N199	V197-T298 HydrophobicContact CG1-CG2 3.5Å; V198-T298 PolarHBondContact O-N 2.64Å; N199-T298 WeakPolarHBondContact CA-OG1 3.42Å; N199-T298 PolarHBondContact OD1-OG1 2.88Å
299	R	92.5	Very high	95	Very high	117 Å²	117	35.9 Å²	35.9	44%	0.442	19%	0.191	S	C	.	.	S	Bend	trans	-64.8	142.6	172.8	-172.7	174.8	177	-165.7	-3.8	110.7	N199 E246 R301	N199-R299 WeakPolarHBondContact O-CB 3.49Å; N199-R299 PolarHBondContact O-N 3.29Å; N199-R299 VanDerWaalsContact O-N 3.09Å; E246-R299 IonicContact OE1-CZ 3.1Å; E246-R299 IonicContact OE1-NH1 2.69Å; E246-R299 PolarHBondContact OE1-NH1 3Å; R299-R301 WeakPolarHBondContact O-CG 3.32Å
300	I	89.3	Confident	94.8	Very high	74 Å²	74	38 Å²	38	38%	0.379	20%	0.2	S	C	.	.			trans	-64.4	134	174.2	-168.1	169	0	0	0	111.4	N325 P335	I300-N325 HydrophobicContact CD1-CB 4.07Å; I300-N325 HydrophobicContact CG1-CB 4.44Å; I300-P335 HydrophobicContact CD1-CB 3.44Å; I300-P335 VanDerWaalsContact CD1-CB 3.44Å
301	R	91.5	Very high	94.6	Very high	10 Å²	10	36 Å²	36	4%	0.038	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-145.3	178.5	-169.9	-69.6	167.7	62.7	82.9	3.4	111.2	M241 R299 D303 T326 C327	M241-R301 VanDerWaalsContact O-CZ 3.23Å; M241-R301 PolarHBondContact O-NH1 3.03Å; M241-R301 PolarHBondContact O-NH2 2.79Å; R299-R301 WeakPolarHBondContact O-CG 3.32Å; R301-D303 VanDerWaalsContact C-N 3.29Å; R301-D303 IonicContact CZ-OD1 2.61Å; R301-D303 IonicContact CZ-OD2 3.24Å; R301-D303 IonicContact NE-OD1 3.84Å; R301-D303 PolarHBondContact NE-OD1 2.78Å; R301-D303 IonicContact NE-OD2 3.09Å; R301-D303 IonicContact NH2-OD1 2.77Å; R301-D303 PolarHBondContact NH2-OD1 2.86Å; R301-D303 IonicContact NH2-OD2 2.8Å; R301-D303 PolarHBondContact NH2-OD2 2.75Å; R301-T326 WeakPolarHBondContact O-CA 3.38Å; R301-T326 WeakPolarHBondContact O-CB 3.45Å; R301-C327 PolarHBondContact O-N 2.79Å; R301-C327 VanDerWaalsContact O-N 3.16Å
302	W	90.6	Very high	94.3	Very high	49 Å²	49	38.5 Å²	38.5	19%	0.186	20%	0.203	C	C	.	.	S	Bend	trans	-82.2	-8.4	167.9	53.2	73.9	0	0	0	112.3	T243 R274 T430 L431	T243-W302 HydrophobicContact CG2-CH2 3.86Å; T243-W302 HydrophobicContact CG2-CZ3 4.15Å; R274-W302 VanDerWaalsContact NH1-CE2 3.33Å; W302-T430 CarbonylContact O-C 3.54Å; W302-T430 WeakPolarHBondContact O-CA 3.21Å; W302-L431 VanDerWaalsContact CB-O 3.24Å; W302-L431 WeakPolarHBondContact CB-O 3.32Å; W302-L431 PolarHBondContact O-N 2.78Å
303	D	94	Very high	94	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	152.4	-174.6	58.3	51.9	0	0	0	113.1	L294 R301 L429	L294-D303 HydrophobicContact CD1-CB 3.89Å; L294-D303 HydrophobicContact CD2-CB 4.17Å; L294-D303 VanDerWaalsContact CD2-OD1 3.3Å; L294-D303 WeakPolarHBondContact CD2-OD1 3.16Å; R301-D303 VanDerWaalsContact C-N 3.29Å; R301-D303 IonicContact CZ-OD1 2.61Å; R301-D303 IonicContact CZ-OD2 3.24Å; R301-D303 IonicContact NE-OD1 3.84Å; R301-D303 PolarHBondContact NE-OD1 2.78Å; R301-D303 IonicContact NE-OD2 3.09Å; R301-D303 IonicContact NH2-OD1 2.77Å; R301-D303 PolarHBondContact NH2-OD1 2.86Å; R301-D303 IonicContact NH2-OD2 2.8Å; R301-D303 PolarHBondContact NH2-OD2 2.75Å; D303-L429 CarbonylContact C-O 3.57Å; D303-L429 WeakPolarHBondContact CA-O 3.09Å; D303-L429 WeakPolarHBondContact CB-O 3.07Å
304	K	95.5	Very high	93.7	Very high	82 Å²	82	44.6 Å²	44.6	36%	0.357	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	141.9	177.1	-164.3	67.9	178.1	180	0	111.4	Y297 F306 V324 Q428 L429	Y297-K304 PolarHBondContact O-NZ 2.87Å; K304-F306 HydrophobicContact CB-CE1 4.37Å; K304-F306 HydrophobicContact CB-CE2 4.04Å; K304-F306 HydrophobicContact CB-CZ 3.67Å; K304-F306 HydrophobicContact CG-CE1 3.81Å; K304-F306 HydrophobicContact CG-CE2 4.3Å; K304-F306 HydrophobicContact CG-CZ 3.63Å; K304-F306 WeakPolarHBondContact O-CE2 3.48Å; K304-V324 HydrophobicContact CB-CG1 3.85Å; K304-V324 HydrophobicContact CG-CG1 4.17Å; K304-Q428 WeakPolarHBondContact O-CA 3.22Å; K304-L429 PolarHBondContact N-O 3.5Å; K304-L429 PolarHBondContact O-N 3.45Å
305	R	96	Very high	93.3	Very high	21 Å²	21	48.5 Å²	48.5	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.2	173.7	-175.6	173.6	179.5	-102.4	-0.4	110.5	E195 L294 N296 V307 V426 L427	E195-R305 IonicContact OE1-CZ 2.82Å; E195-R305 IonicContact OE1-NH1 3.59Å; E195-R305 PolarHBondContact OE1-NH1 3.01Å; E195-R305 IonicContact OE1-NH2 2.78Å; E195-R305 PolarHBondContact OE1-NH2 2.75Å; E195-R305 IonicContact OE2-CZ 3.15Å; E195-R305 IonicContact OE2-NH1 3.65Å; E195-R305 PolarHBondContact OE2-NH1 3.46Å; E195-R305 IonicContact OE2-NH2 3.63Å; L294-R305 HydrophobicContact CB-CB 3.96Å; L294-R305 HydrophobicContact CD1-CB 4.37Å; L294-R305 WeakPolarHBondContact O-CD 2.88Å; N296-R305 PolarHBondContact OD1-NH1 2.95Å; R305-V307 VanDerWaalsContact CZ-CG2 3.46Å; R305-V426 HydrophobicContact CG-CG1 4.21Å; R305-L427 CarbonylContact C-O 3.56Å; R305-L427 WeakPolarHBondContact CA-O 3.33Å
306	F	95.7	Very high	92.9	Very high	9 Å²	9	55.9 Å²	55.9	4%	0.039	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.3	174.3	-48.8	-81.5	0	0	0	109.8	K304 F322 V324 L340 V426 L427 L429	K304-F306 HydrophobicContact CB-CE1 4.37Å; K304-F306 HydrophobicContact CB-CE2 4.04Å; K304-F306 HydrophobicContact CB-CZ 3.67Å; K304-F306 HydrophobicContact CG-CE1 3.81Å; K304-F306 HydrophobicContact CG-CE2 4.3Å; K304-F306 HydrophobicContact CG-CZ 3.63Å; K304-F306 WeakPolarHBondContact O-CE2 3.48Å; F306-F322 HydrophobicContact CB-CD2 4.37Å; F306-F322 HydrophobicContact CB-CE1 4.45Å; F306-F322 HydrophobicContact CB-CE2 4.24Å; F306-F322 HydrophobicContact CB-CZ 4.28Å; F306-F322 HydrophobicContact CD1-CB 3.51Å; F306-F322 AromaticContact CD1-CD1 3.76Å; F306-F322 HydrophobicContact CD1-CD1 3.76Å; F306-F322 AromaticContact CD1-CD2 3.9Å; F306-F322 HydrophobicContact CD1-CD2 3.9Å; F306-F322 HydrophobicContact CD1-CE1 4.43Å; F306-F322 AromaticContact CD1-CG 3.45Å; F306-F322 HydrophobicContact CD1-CG 3.45Å; F306-F322 VanDerWaalsContact CD1-CG 3.45Å; F306-F322 HydrophobicContact CE1-CB 3.52Å; F306-F322 HydrophobicContact CE1-CG 4.03Å; F306-F322 HydrophobicContact CG-CD2 4.28Å; F306-F322 HydrophobicContact CG-CG 4.25Å; F306-V324 HydrophobicContact CE1-CG2 3.67Å; F306-V324 HydrophobicContact CZ-CB 4.48Å; F306-V324 HydrophobicContact CZ-CG1 4.25Å; F306-V324 HydrophobicContact CZ-CG2 3.43Å; F306-V324 VanDerWaalsContact CZ-CG2 3.43Å; F306-L340 HydrophobicContact CD2-CD2 3.97Å; F306-L340 HydrophobicContact CE2-CD2 3.78Å; F306-L340 HydrophobicContact CG-CD2 4.47Å; F306-L340 HydrophobicContact CZ-CD2 4.12Å; F306-V426 WeakPolarHBondContact O-CA 3.46Å; F306-L427 HydrophobicContact CB-CB 4.29Å; F306-L427 HydrophobicContact CD2-CB 4.33Å; F306-L427 PolarHBondContact N-O 3.45Å; F306-L427 PolarHBondContact O-N 2.94Å; F306-L429 HydrophobicContact CE2-CB 3.65Å; F306-L429 HydrophobicContact CE2-CD2 4.44Å; F306-L429 HydrophobicContact CZ-CB 4.45Å
307	V	95.6	Very high	92.6	Very high	54 Å²	54	57.9 Å²	57.9	33%	0.327	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	128.1	179.7	-177.4	0	0	0	0	107.5	R305 T424	R305-V307 VanDerWaalsContact CZ-CG2 3.46Å; V307-T424 HydrophobicContact CG1-CG2 3.4Å; V307-T424 VanDerWaalsContact CG1-CG2 3.4Å
308	I	94.7	Very high	92.5	Very high	7 Å²	7	58.7 Å²	58.7	4%	0.036	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	94.4	175.4	-56.3	167.1	0	0	0	106.3	F311 L314 I320 F322 L342 T424 M425 L427	I308-F311 HydrophobicContact CG2-CD2 3.96Å; I308-L314 HydrophobicContact CG2-CD1 3.67Å; I308-I320 HydrophobicContact CG2-CD1 3.75Å; I308-F322 HydrophobicContact CD1-CE2 4.35Å; I308-F322 HydrophobicContact CG1-CE2 4.09Å; I308-F322 HydrophobicContact CG1-CZ 3.8Å; I308-L342 HydrophobicContact CD1-CD2 4.14Å; I308-T424 CarbonylContact O-C 3.54Å; I308-T424 WeakPolarHBondContact O-CA 3.47Å; I308-M425 HydrophobicContact CB-CB 4.28Å; I308-M425 HydrophobicContact CD1-SD 4.47Å; I308-M425 PolarHBondContact N-O 2.84Å; I308-M425 PolarHBondContact O-N 2.79Å; I308-L427 HydrophobicContact CD1-CD1 4.23Å
309	A	92.9	Very high	92.4	Very high	52 Å²	52	59.1 Å²	59.1	43%	0.43	30%	0.301	S	S	.	.			trans	-78	164.7	175.9	0	0	0	0	0	111.6	F311	A309-F311 PolarHBondContact O-N 2.94Å
310	D	92	Very high	92.6	Very high	103 Å²	103	55.2 Å²	55.2	55%	0.551	29%	0.289	S	S	*	.	S	Bend	trans	50.2	42.7	177.8	-54.1	-47.5	0	0	0	112.7	S312 T313 D423	D310-S312 PolarHBondContact O-N 2.85Å; D310-T313 HydrophobicContact CB-CG2 3.99Å; D310-T313 WeakPolarHBondContact CB-OG1 2.98Å; D310-T313 WeakPolarHBondContact O-CB 3.3Å; D310-T313 PolarHBondContact O-N 2.8Å; D310-T313 PolarHBondContact O-OG1 2.81Å; D310-D423 VanDerWaalsContact C-OD2 3.25Å; D310-D423 WeakPolarHBondContact CA-OD2 3.36Å; D310-D423 PolarHBondContact N-O 2.87Å
311	F	91.3	Very high	92.8	Very high	2 Å²	2	54 Å²	54	1%	0.009	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-57.4	-37.9	-170.6	-169.3	-82.4	0	0	0	112.1	I308 A309 T313 L314 P344 K345 V412 L413 L420 D423 M425	I308-F311 HydrophobicContact CG2-CD2 3.96Å; A309-F311 PolarHBondContact O-N 2.94Å; F311-T313 PolarHBondContact O-N 2.85Å; F311-L314 HydrophobicContact CD2-CD1 3.81Å; F311-L314 HydrophobicContact CE2-CD1 4.14Å; F311-L314 HydrophobicContact CG-CD1 4.14Å; F311-L314 WeakPolarHBondContact O-CB 3.48Å; F311-L314 WeakPolarHBondContact O-CG 3.19Å; F311-L314 PolarHBondContact O-N 2.84Å; F311-P344 HydrophobicContact CE2-CB 3.53Å; F311-P344 HydrophobicContact CE2-CG 4.41Å; F311-P344 HydrophobicContact CZ-CB 3.52Å; F311-K345 HydrophobicContact CE1-CG 4.36Å; F311-K345 WeakPolarHBondContact O-CE 3.47Å; F311-K345 PolarHBondContact O-NZ 3.25Å; F311-V412 HydrophobicContact CD1-CG1 4.12Å; F311-V412 HydrophobicContact CE1-CB 4.39Å; F311-V412 HydrophobicContact CE1-CG1 3.32Å; F311-V412 HydrophobicContact CE2-CG1 4.15Å; F311-V412 HydrophobicContact CZ-CB 4.42Å; F311-V412 HydrophobicContact CZ-CG1 3.32Å; F311-L413 HydrophobicContact CE1-CD2 4.42Å; F311-L420 HydrophobicContact CB-CD1 4.4Å; F311-L420 HydrophobicContact CB-CD2 4.18Å; F311-L420 HydrophobicContact CD1-CD1 3.99Å; F311-L420 HydrophobicContact CD1-CD2 4.19Å; F311-L420 HydrophobicContact CD2-CD2 4.11Å; F311-L420 HydrophobicContact CG-CD1 4.31Å; F311-L420 HydrophobicContact CG-CD2 3.89Å; F311-D423 VanDerWaalsContact CB-O 3.26Å; F311-D423 WeakPolarHBondContact CB-O 3.3Å; F311-D423 PolarHBondContact N-O 3.48Å; F311-D423 PolarHBondContact N-OD2 3.36Å; F311-M425 HydrophobicContact CD2-CB 3.84Å; F311-M425 HydrophobicContact CD2-CE 4.49Å; F311-M425 HydrophobicContact CE2-CB 4.14Å; F311-M425 HydrophobicContact CE2-CE 3.76Å; F311-M425 HydrophobicContact CE2-SD 4.01Å; F311-M425 HydrophobicContact CZ-CE 4.01Å
312	S	89.6	Confident	93	Very high	79 Å²	79	55.6 Å²	55.6	55%	0.552	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.3	-34.6	176	67	0	0	0	0	112.3	D310 L314 K345 D423	D310-S312 PolarHBondContact O-N 2.85Å; S312-L314 VanDerWaalsContact C-N 3.34Å; S312-L314 PolarHBondContact O-N 2.76Å; S312-K345 PolarHBondContact O-NZ 2.86Å; S312-D423 VanDerWaalsContact CB-OD1 3.24Å; S312-D423 WeakPolarHBondContact CB-OD1 3.48Å; S312-D423 VanDerWaalsContact CB-OD2 3.28Å; S312-D423 WeakPolarHBondContact CB-OD2 3.45Å; S312-D423 VanDerWaalsContact N-CG 3.33Å; S312-D423 PolarHBondContact N-OD1 2.97Å; S312-D423 PolarHBondContact N-OD2 3.01Å; S312-D423 VanDerWaalsContact N-OD2 3.11Å; S312-D423 VanDerWaalsContact OG-CG 3.32Å; S312-D423 PolarHBondContact OG-OD1 3.24Å; S312-D423 PolarHBondContact OG-OD2 3.26Å
313	T	91.5	Very high	93.1	Very high	99 Å²	99	61.8 Å²	61.8	61%	0.607	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-77.6	-17.2	-178	77.1	0	0	0	0	113.6	D310 F311	D310-T313 HydrophobicContact CB-CG2 3.99Å; D310-T313 WeakPolarHBondContact CB-OG1 2.98Å; D310-T313 WeakPolarHBondContact O-CB 3.3Å; D310-T313 PolarHBondContact O-N 2.8Å; D310-T313 PolarHBondContact O-OG1 2.81Å; F311-T313 PolarHBondContact O-N 2.85Å
314	L	91.2	Very high	93	Very high	31 Å²	31	61.5 Å²	61.5	16%	0.162	32%	0.321	C	S	.	.	S	Bend	trans	-59.4	131.9	-179.3	-65.5	173.1	0	0	0	111.6	I308 F311 S312 I320 P344 K345	I308-L314 HydrophobicContact CG2-CD1 3.67Å; F311-L314 HydrophobicContact CD2-CD1 3.81Å; F311-L314 HydrophobicContact CE2-CD1 4.14Å; F311-L314 HydrophobicContact CG-CD1 4.14Å; F311-L314 WeakPolarHBondContact O-CB 3.48Å; F311-L314 WeakPolarHBondContact O-CG 3.19Å; F311-L314 PolarHBondContact O-N 2.84Å; S312-L314 VanDerWaalsContact C-N 3.34Å; S312-L314 PolarHBondContact O-N 2.76Å; L314-I320 HydrophobicContact CD1-CD1 3.73Å; L314-I320 HydrophobicContact CD2-CD1 3.78Å; L314-I320 HydrophobicContact CG-CD1 4.41Å; L314-P344 HydrophobicContact CD1-CG 3.95Å; L314-K345 HydrophobicContact CB-CD 4.39Å; L314-K345 WeakPolarHBondContact O-CD 3.33Å; L314-K345 WeakPolarHBondContact O-CE 3.13Å; L314-K345 PolarHBondContact O-NZ 3.31Å
315	P	91	Very high	92.7	Very high	85 Å²	85	61.7 Å²	61.7	55%	0.552	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-60.7	149.6	175.3	-21.1	32.1	0	0	0	112.1	S318	P315-S318 PolarHBondContact O-N 2.78Å; P315-S318 PolarHBondContact O-OG 3.02Å; P315-S318 VanDerWaalsContact O-OG 3.05Å
316	R	89.1	Confident	92.4	Very high	156 Å²	156	60.9 Å²	60.9	59%	0.589	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	141.7	166.4	-72.9	-172.2	175.3	-131.1	-1.5	109.3	S318	R316-S318 PolarHBondContact O-N 3.44Å
317	Y	90.2	Very high	91.9	Very high	85 Å²	85	61.8 Å²	61.8	33%	0.333	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	13.9	178	-36.7	-60	0	0	0	116.2	K345 G346 S348 E352	Y317-K345 PolarHBondContact N-O 2.61Å; Y317-G346 VanDerWaalsContact CA-O 3.3Å; Y317-G346 WeakPolarHBondContact CA-O 3.32Å; Y317-S348 WeakPolarHBondContact CE1-O 3.36Å; Y317-E352 HydrophobicContact CE1-CG 4.38Å; Y317-E352 PolarHBondContact OH-OE1 2.88Å
318	S	93.1	Very high	90.9	Very high	26 Å²	26	59.6 Å²	59.6	18%	0.182	32%	0.319	C	S	.	.			trans	-73.1	148.2	174	63	0	0	0	0	112.6	P315 R316	P315-S318 PolarHBondContact O-N 2.78Å; P315-S318 PolarHBondContact O-OG 3.02Å; P315-S318 VanDerWaalsContact O-OG 3.05Å; R316-S318 PolarHBondContact O-N 3.44Å
319	E	94.2	Very high	89.7	Confident	91 Å²	91	62.3 Å²	62.3	43%	0.425	34%	0.339	S	S	.	.			trans	-98.8	134.9	168	-175.6	-179.7	107	0	0	110.1	S321 K341 L342 H343	E319-S321 PolarHBondContact OE1-OG 3.45Å; E319-K341 HydrophobicContact CG-CB 4.34Å; E319-K341 IonicContact OE1-NZ 2.86Å; E319-K341 PolarHBondContact OE1-NZ 3.36Å; E319-K341 IonicContact OE2-NZ 3.69Å; E319-L342 CarbonylContact C-O 3.57Å; E319-L342 WeakPolarHBondContact CA-O 3.48Å; E319-H343 IonicContact OE2-CE1 3.96Å; E319-H343 IonicContact OE2-NE2 3.7Å
320	I	95	Very high	88.5	Confident	35 Å²	35	63.6 Å²	63.6	18%	0.179	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	131.2	168.4	-54.5	175.5	0	0	0	108	I308 L314 F322 K341 L342 P344	I308-I320 HydrophobicContact CG2-CD1 3.75Å; L314-I320 HydrophobicContact CD1-CD1 3.73Å; L314-I320 HydrophobicContact CD2-CD1 3.78Å; L314-I320 HydrophobicContact CG-CD1 4.41Å; I320-F322 HydrophobicContact CG2-CD2 4.38Å; I320-F322 HydrophobicContact CG2-CE1 4.46Å; I320-F322 HydrophobicContact CG2-CE2 3.65Å; I320-F322 HydrophobicContact CG2-CZ 3.7Å; I320-K341 CarbonylContact O-C 3.55Å; I320-K341 WeakPolarHBondContact O-CA 3.4Å; I320-L342 PolarHBondContact N-O 2.68Å; I320-L342 PolarHBondContact O-N 2.81Å; I320-P344 HydrophobicContact CD1-CG 4.1Å
321	S	95.2	Very high	87.2	Confident	48 Å²	48	66.7 Å²	66.7	34%	0.336	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.5	-174.9	-67.9	0	0	0	0	111.7	E319 L340	E319-S321 PolarHBondContact OE1-OG 3.45Å; S321-L340 CarbonylContact C-O 3.47Å; S321-L340 WeakPolarHBondContact CA-O 2.89Å
322	F	94.7	Very high	85.8	Confident	44 Å²	44	71.6 Å²	71.6	19%	0.193	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	130.4	177.9	-60.8	-81	0	0	0	110.9	F306 I308 I320 E339 L340 L342	F306-F322 HydrophobicContact CB-CD2 4.37Å; F306-F322 HydrophobicContact CB-CE1 4.45Å; F306-F322 HydrophobicContact CB-CE2 4.24Å; F306-F322 HydrophobicContact CB-CZ 4.28Å; F306-F322 HydrophobicContact CD1-CB 3.51Å; F306-F322 AromaticContact CD1-CD1 3.76Å; F306-F322 HydrophobicContact CD1-CD1 3.76Å; F306-F322 AromaticContact CD1-CD2 3.9Å; F306-F322 HydrophobicContact CD1-CD2 3.9Å; F306-F322 HydrophobicContact CD1-CE1 4.43Å; F306-F322 AromaticContact CD1-CG 3.45Å; F306-F322 HydrophobicContact CD1-CG 3.45Å; F306-F322 VanDerWaalsContact CD1-CG 3.45Å; F306-F322 HydrophobicContact CE1-CB 3.52Å; F306-F322 HydrophobicContact CE1-CG 4.03Å; F306-F322 HydrophobicContact CG-CD2 4.28Å; F306-F322 HydrophobicContact CG-CG 4.25Å; I308-F322 HydrophobicContact CD1-CE2 4.35Å; I308-F322 HydrophobicContact CG1-CE2 4.09Å; I308-F322 HydrophobicContact CG1-CZ 3.8Å; I320-F322 HydrophobicContact CG2-CD2 4.38Å; I320-F322 HydrophobicContact CG2-CE1 4.46Å; I320-F322 HydrophobicContact CG2-CE2 3.65Å; I320-F322 HydrophobicContact CG2-CZ 3.7Å; F322-E339 CarbonylContact O-C 3.24Å; F322-E339 WeakPolarHBondContact O-CA 3.44Å; F322-L340 HydrophobicContact CB-CB 4.45Å; F322-L340 PolarHBondContact N-O 3.41Å; F322-L340 PolarHBondContact O-N 3.01Å; F322-L342 HydrophobicContact CD2-CD1 3.79Å; F322-L342 HydrophobicContact CE2-CD1 3.96Å
323	K	93.1	Very high	84.8	Confident	179 Å²	179	71.4 Å²	71.4	78%	0.778	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.8	136.2	170.2	-65.3	-176.6	-179.1	179.9	0	110.2
324	V	90.7	Very high	84.2	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.018	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	133.3	-178.3	-164.3	0	0	0	0	109	K304 F306 T326 W338 L340	K304-V324 HydrophobicContact CB-CG1 3.85Å; K304-V324 HydrophobicContact CG-CG1 4.17Å; F306-V324 HydrophobicContact CE1-CG2 3.67Å; F306-V324 HydrophobicContact CZ-CB 4.48Å; F306-V324 HydrophobicContact CZ-CG1 4.25Å; F306-V324 HydrophobicContact CZ-CG2 3.43Å; F306-V324 VanDerWaalsContact CZ-CG2 3.43Å; V324-T326 HydrophobicContact CG1-CG2 3.95Å; V324-W338 HydrophobicContact CB-CB 4.2Å; V324-W338 PolarHBondContact N-O 3.25Å; V324-W338 PolarHBondContact O-N 3.34Å; V324-L340 HydrophobicContact CG2-CB 4.25Å
325	N	90.1	Very high	83.9	Confident	87 Å²	87	74.1 Å²	74.1	47%	0.465	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.9	172.1	-65.3	169.1	0	0	0	107.8	I300 W336 D337	I300-N325 HydrophobicContact CD1-CB 4.07Å; I300-N325 HydrophobicContact CG1-CB 4.44Å; N325-W336 WeakPolarHBondContact CA-O 3.46Å; N325-D337 PolarHBondContact ND2-OD1 2.78Å
326	T	89.1	Confident	83.7	Confident	3 Å²	3	71 Å²	71	2%	0.018	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.4	177.6	68.2	0	0	0	0	112.6	R301 V324 G328 P335 W336 W338 L431	R301-T326 WeakPolarHBondContact O-CA 3.38Å; R301-T326 WeakPolarHBondContact O-CB 3.45Å; V324-T326 HydrophobicContact CG1-CG2 3.95Å; T326-G328 PolarHBondContact O-N 2.95Å; T326-P335 CarbonylContact O-C 3.53Å; T326-P335 WeakPolarHBondContact O-CA 3.44Å; T326-W336 PolarHBondContact N-O 2.83Å; T326-W336 PolarHBondContact O-N 2.69Å; T326-W338 PolarHBondContact OG1-NE1 3.38Å; T326-L431 HydrophobicContact CG2-CB 4.27Å; T326-L431 HydrophobicContact CG2-CD1 3.99Å; T326-L431 HydrophobicContact CG2-CG 4.35Å
327	C	85.3	Confident	83.8	Confident	28 Å²	28	66 Å²	66	19%	0.189	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	131	171.6	-60.3	0	0	0	0	110.9	R301 P333	R301-C327 PolarHBondContact O-N 2.79Å; R301-C327 VanDerWaalsContact O-N 3.16Å; C327-P333 HydrophobicContact CB-CB 4.23Å
328	G	75.3	Confident	83.9	Confident	9 Å²	9	62 Å²	62	9%	0.093	34%	0.34	C	S	.	.			trans	-76.1	178	165.1	0	0	0	0	0	112.7	T326 N330 Q334	T326-G328 PolarHBondContact O-N 2.95Å; G328-N330 VanDerWaalsContact C-N 3.35Å; G328-Q334 PolarHBondContact N-O 2.63Å
329	S	68.7	Low	84	Confident	64 Å²	64	63.4 Å²	63.4	45%	0.448	34%	0.344	S	S	.	.	S	Bend	trans	-79	-14.9	176.5	46.8	0	0	0	0	114.1
330	N	67.6	Low	84.1	Confident	78 Å²	78	59 Å²	59	42%	0.417	32%	0.324	S	S	.	.	S	Bend	trans	-62.8	155.7	-176.9	-64.9	-5	0	0	0	111.8	G328 P332 P333	G328-N330 VanDerWaalsContact C-N 3.35Å; N330-P332 CarbonylContact C-O 3.44Å; N330-P332 CarbonylContact O-C 3.39Å; N330-P333 WeakPolarHBondContact O-CA 3.22Å
331	L	64.8	Low	84.2	Confident	169 Å²	169	59.7 Å²	59.7	89%	0.885	33%	0.325	S	S	*	.	S	Bend	trans	-119.9	115.3	168	-166.2	71	0	0	0	109
332	P	63.3	Low	84.1	Confident	104 Å²	104	57.4 Å²	57.4	68%	0.675	31%	0.309	S	S	*	.	S	Bend	cis	-67.4	151.7	-1.5	30.3	-35.2	0	0	0	112.3	N330 Q334	N330-P332 CarbonylContact C-O 3.44Å; N330-P332 CarbonylContact O-C 3.39Å; P332-Q334 PolarHBondContact O-N 3.07Å
333	P	68.7	Low	84.1	Confident	75 Å²	75	56.5 Å²	56.5	49%	0.487	31%	0.305	S	S	.	.			trans	-64.2	110	-178.9	24.1	-32.1	0	0	0	110.2	C327 N330	C327-P333 HydrophobicContact CB-CB 4.23Å; N330-P333 WeakPolarHBondContact O-CA 3.22Å
334	Q	78.4	Confident	83.9	Confident	118 Å²	118	48 Å²	48	55%	0.551	27%	0.269	S	S	*	.			trans	-78.5	140	169.1	-75.1	179.8	-9.4	0	0	109.6	G328 P332	G328-Q334 PolarHBondContact N-O 2.63Å; P332-Q334 PolarHBondContact O-N 3.07Å
335	P	84.6	Confident	83.8	Confident	70 Å²	70	48.7 Å²	48.7	46%	0.455	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	139.5	176.3	28.2	-34.7	0	0	0	110.6	I300 T326	I300-P335 HydrophobicContact CD1-CB 3.44Å; I300-P335 VanDerWaalsContact CD1-CB 3.44Å; T326-P335 CarbonylContact O-C 3.53Å; T326-P335 WeakPolarHBondContact O-CA 3.44Å
336	W	87.2	Confident	83.7	Confident	19 Å²	19	44.6 Å²	44.6	7%	0.072	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.6	167	-71	-2.4	0	0	0	108.6	N325 T326 W338 R368 I370 P433	N325-W336 WeakPolarHBondContact CA-O 3.46Å; T326-W336 PolarHBondContact N-O 2.83Å; T326-W336 PolarHBondContact O-N 2.69Å; W336-W338 HydrophobicContact CB-CZ2 4.14Å; W336-W338 HydrophobicContact CD2-CZ2 4.28Å; W336-W338 HydrophobicContact CE3-CH2 4.48Å; W336-W338 AromaticContact CE3-CZ2 3.59Å; W336-W338 HydrophobicContact CE3-CZ2 3.59Å; W336-W338 HydrophobicContact CZ3-CZ2 4.27Å; W336-W338 PolarHBondContact O-NE1 3.31Å; W336-R368 HydrophobicContact CH2-CB 3.92Å; W336-R368 HydrophobicContact CH2-CG 3.83Å; W336-R368 HydrophobicContact CZ2-CB 4.38Å; W336-R368 HydrophobicContact CZ2-CG 3.77Å; W336-R368 HydrophobicContact CZ3-CB 4.13Å; W336-R368 HydrophobicContact CZ3-CG 4.3Å; W336-I370 HydrophobicContact CE3-CG2 4.46Å; W336-I370 HydrophobicContact CZ3-CG2 3.79Å; W336-P433 HydrophobicContact CE3-CG 4.37Å; W336-P433 HydrophobicContact CH2-CB 3.93Å; W336-P433 HydrophobicContact CH2-CG 4.03Å; W336-P433 HydrophobicContact CZ3-CB 3.97Å; W336-P433 HydrophobicContact CZ3-CG 3.75Å
337	D	90.7	Very high	83.6	Confident	52 Å²	52	46.6 Å²	46.6	28%	0.278	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.5	177.7	-58.2	-57.8	0	0	0	110.9	N325 S361 V362	N325-D337 PolarHBondContact ND2-OD1 2.78Å; D337-S361 PolarHBondContact O-N 3.12Å; D337-V362 HydrophobicContact CB-CG1 4.35Å
338	W	93.2	Very high	83.8	Confident	1 Å²	1	47.5 Å²	47.5	0%	0.004	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160.6	177.3	-46.7	93.5	0	0	0	111	V324 T326 W336 L358 V359 S361 I370 F392 L431	V324-W338 HydrophobicContact CB-CB 4.2Å; V324-W338 PolarHBondContact N-O 3.25Å; V324-W338 PolarHBondContact O-N 3.34Å; T326-W338 PolarHBondContact OG1-NE1 3.38Å; W336-W338 HydrophobicContact CB-CZ2 4.14Å; W336-W338 HydrophobicContact CD2-CZ2 4.28Å; W336-W338 HydrophobicContact CE3-CH2 4.48Å; W336-W338 AromaticContact CE3-CZ2 3.59Å; W336-W338 HydrophobicContact CE3-CZ2 3.59Å; W336-W338 HydrophobicContact CZ3-CZ2 4.27Å; W336-W338 PolarHBondContact O-NE1 3.31Å; W338-L358 HydrophobicContact CB-CD1 3.81Å; W338-L358 HydrophobicContact CD2-CD1 4.46Å; W338-L358 HydrophobicContact CD2-CD2 4.43Å; W338-L358 HydrophobicContact CD2-CG 4.49Å; W338-L358 HydrophobicContact CE3-CD1 4.39Å; W338-L358 HydrophobicContact CE3-CD2 4.08Å; W338-L358 HydrophobicContact CE3-CG 4Å; W338-L358 HydrophobicContact CG-CD1 4.26Å; W338-L358 HydrophobicContact CZ3-CD2 4.37Å; W338-V359 CarbonylContact C-O 3.58Å; W338-V359 VanDerWaalsContact CA-O 3.23Å; W338-V359 WeakPolarHBondContact CA-O 3.48Å; W338-S361 WeakPolarHBondContact CA-OG 2.96Å; W338-S361 PolarHBondContact O-OG 3.07Å; W338-I370 HydrophobicContact CH2-CD1 4.18Å; W338-I370 HydrophobicContact CH2-CG2 4.19Å; W338-I370 HydrophobicContact CZ2-CD1 4.44Å; W338-I370 HydrophobicContact CZ2-CG2 4.16Å; W338-F392 AromaticContact CH2-CD2 3.95Å; W338-F392 HydrophobicContact CH2-CD2 3.95Å; W338-F392 HydrophobicContact CH2-CE2 4.27Å; W338-F392 HydrophobicContact CH2-CG 4.23Å; W338-F392 AromaticContact CZ3-CD1 3.95Å; W338-F392 HydrophobicContact CZ3-CD1 3.95Å; W338-F392 AromaticContact CZ3-CD2 3.82Å; W338-F392 HydrophobicContact CZ3-CD2 3.82Å; W338-F392 HydrophobicContact CZ3-CE1 4.04Å; W338-F392 AromaticContact CZ3-CE2 3.94Å; W338-F392 HydrophobicContact CZ3-CE2 3.94Å; W338-F392 AromaticContact CZ3-CG 3.84Å; W338-F392 HydrophobicContact CZ3-CG 3.84Å; W338-F392 HydrophobicContact CZ3-CZ 4.05Å; W338-L431 HydrophobicContact CD2-CD1 4.13Å; W338-L431 HydrophobicContact CG-CD1 4.01Å
339	E	95.3	Very high	84.1	Confident	54 Å²	54	49.6 Å²	49.6	25%	0.252	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.7	167.6	-174.2	173.6	-136	0	0	108.1	F322 K341 V359 S361	F322-E339 CarbonylContact O-C 3.24Å; F322-E339 WeakPolarHBondContact O-CA 3.44Å; E339-K341 HydrophobicContact CG-CG 4.1Å; E339-K341 WeakPolarHBondContact OE2-CE 3.47Å; E339-K341 IonicContact OE2-NZ 3.55Å; E339-V359 HydrophobicContact CB-CB 4.44Å; E339-V359 PolarHBondContact N-O 2.87Å; E339-V359 PolarHBondContact O-N 3.43Å; E339-S361 PolarHBondContact N-OG 3.25Å
340	L	96	Very high	84.9	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	113.5	174	-170.3	72.7	0	0	0	108.2	F306 S321 F322 V324 L342 C356 L358 L401 L429	F306-L340 HydrophobicContact CD2-CD2 3.97Å; F306-L340 HydrophobicContact CE2-CD2 3.78Å; F306-L340 HydrophobicContact CG-CD2 4.47Å; F306-L340 HydrophobicContact CZ-CD2 4.12Å; S321-L340 CarbonylContact C-O 3.47Å; S321-L340 WeakPolarHBondContact CA-O 2.89Å; F322-L340 HydrophobicContact CB-CB 4.45Å; F322-L340 PolarHBondContact N-O 3.41Å; F322-L340 PolarHBondContact O-N 3.01Å; V324-L340 HydrophobicContact CG2-CB 4.25Å; L340-L342 HydrophobicContact CB-CD1 4.41Å; L340-L342 HydrophobicContact CD2-CD1 3.77Å; L340-L342 HydrophobicContact CG-CD1 3.68Å; L340-C356 WeakPolarHBondContact CD1-SG 3.23Å; L340-L358 HydrophobicContact CD1-CD1 4.11Å; L340-L401 HydrophobicContact CD1-CD1 3.81Å; L340-L429 HydrophobicContact CD1-CD2 4.08Å; L340-L429 HydrophobicContact CD2-CD2 4.37Å
341	K	95.7	Very high	85.7	Confident	48 Å²	48	52.4 Å²	52.4	21%	0.209	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	-179	-55.8	-169.8	158.2	-132.8	0	110.3	E319 I320 E339 C356 M357 V359	E319-K341 HydrophobicContact CG-CB 4.34Å; E319-K341 IonicContact OE1-NZ 2.86Å; E319-K341 PolarHBondContact OE1-NZ 3.36Å; E319-K341 IonicContact OE2-NZ 3.69Å; I320-K341 CarbonylContact O-C 3.55Å; I320-K341 WeakPolarHBondContact O-CA 3.4Å; E339-K341 HydrophobicContact CG-CG 4.1Å; E339-K341 WeakPolarHBondContact OE2-CE 3.47Å; E339-K341 IonicContact OE2-NZ 3.55Å; K341-C356 CarbonylContact O-C 3.53Å; K341-C356 WeakPolarHBondContact O-CA 3.36Å; K341-M357 HydrophobicContact CB-CB 4.37Å; K341-M357 PolarHBondContact N-O 2.91Å; K341-M357 PolarHBondContact O-N 3.48Å; K341-V359 HydrophobicContact CD-CG2 4.06Å; K341-V359 HydrophobicContact CG-CG2 4.32Å
342	L	94.7	Very high	86.6	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	136.4	-177.5	-69.6	91.3	0	0	0	111.1	I308 E319 I320 F322 L340 P344 F354 K355 C356 L427	I308-L342 HydrophobicContact CD1-CD2 4.14Å; E319-L342 CarbonylContact C-O 3.57Å; E319-L342 WeakPolarHBondContact CA-O 3.48Å; I320-L342 PolarHBondContact N-O 2.68Å; I320-L342 PolarHBondContact O-N 2.81Å; F322-L342 HydrophobicContact CD2-CD1 3.79Å; F322-L342 HydrophobicContact CE2-CD1 3.96Å; L340-L342 HydrophobicContact CB-CD1 4.41Å; L340-L342 HydrophobicContact CD2-CD1 3.77Å; L340-L342 HydrophobicContact CG-CD1 3.68Å; L342-P344 VanDerWaalsContact C-CD 3.47Å; L342-P344 VanDerWaalsContact O-CD 3.3Å; L342-P344 WeakPolarHBondContact O-CD 3.44Å; L342-F354 HydrophobicContact CD2-CE2 4Å; L342-F354 HydrophobicContact CD2-CZ 4.15Å; L342-K355 WeakPolarHBondContact CA-O 3.4Å; L342-C356 HydrophobicContact CG-CB 4.49Å; L342-L427 HydrophobicContact CD2-CD1 3.21Å
343	H	93.4	Very high	87.8	Confident	25 Å²	25	48.8 Å²	48.8	12%	0.116	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	80.1	168.2	-65.7	-85.2	0	0	0	108.4	E319 K345 V347 K355	E319-H343 IonicContact OE2-CE1 3.96Å; E319-H343 IonicContact OE2-NE2 3.7Å; H343-K345 VanDerWaalsContact C-N 3.28Å; H343-K345 PolarHBondContact O-N 3.09Å; H343-V347 HydrophobicContact CB-CG2 3.8Å; H343-K355 HydrophobicContact CB-CB 4.21Å; H343-K355 PolarHBondContact N-O 2.9Å; H343-K355 PolarHBondContact O-N 3.16Å
344	P	88.4	Confident	88.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-28.4	-170.3	22.2	-31.6	0	0	0	114.4	F311 L314 I320 L342 F354	F311-P344 HydrophobicContact CE2-CB 3.53Å; F311-P344 HydrophobicContact CE2-CG 4.41Å; F311-P344 HydrophobicContact CZ-CB 3.52Å; L314-P344 HydrophobicContact CD1-CG 3.95Å; I320-P344 HydrophobicContact CD1-CG 4.1Å; L342-P344 VanDerWaalsContact C-CD 3.47Å; L342-P344 VanDerWaalsContact O-CD 3.3Å; L342-P344 WeakPolarHBondContact O-CD 3.44Å; P344-F354 HydrophobicContact CB-CE2 4.19Å
345	K	89	Confident	89.3	Confident	18 Å²	18	42.1 Å²	42.1	8%	0.078	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.2	43.8	-176.2	-61.1	-172.8	-179.5	173.3	0	111.7	F311 S312 L314 Y317 H343 L413	F311-K345 HydrophobicContact CE1-CG 4.36Å; F311-K345 WeakPolarHBondContact O-CE 3.47Å; F311-K345 PolarHBondContact O-NZ 3.25Å; S312-K345 PolarHBondContact O-NZ 2.86Å; L314-K345 HydrophobicContact CB-CD 4.39Å; L314-K345 WeakPolarHBondContact O-CD 3.33Å; L314-K345 WeakPolarHBondContact O-CE 3.13Å; L314-K345 PolarHBondContact O-NZ 3.31Å; Y317-K345 PolarHBondContact N-O 2.61Å; H343-K345 VanDerWaalsContact C-N 3.28Å; H343-K345 PolarHBondContact O-N 3.09Å; K345-L413 HydrophobicContact CD-CD2 3.9Å; K345-L413 HydrophobicContact CG-CD2 4.03Å
346	G	88	Confident	89.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.211	C	C	.	.			trans	84.5	162.4	-175.2	0	0	0	0	0	113.3	Y317 E353	Y317-G346 VanDerWaalsContact CA-O 3.3Å; Y317-G346 WeakPolarHBondContact CA-O 3.32Å; G346-E353 WeakPolarHBondContact CA-O 3.44Å
347	V	87.9	Confident	90.1	Very high	45 Å²	45	40.8 Å²	40.8	27%	0.273	22%	0.222	S	C	.	.	S	Bend	trans	-95.8	-38.6	178.8	-176	0	0	0	0	111.4	H343 C351 K355	H343-V347 HydrophobicContact CB-CG2 3.8Å; V347-C351 HydrophobicContact CB-CB 4.4Å; V347-C351 PolarHBondContact N-O 3.11Å; V347-K355 HydrophobicContact CG2-CB 3.66Å; V347-K355 HydrophobicContact CG2-CD 3.6Å; V347-K355 HydrophobicContact CG2-CG 4.3Å
348	S	89	Confident	90.3	Very high	48 Å²	48	38.3 Å²	38.3	34%	0.336	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-159.5	170	179.9	67	0	0	0	0	110	Y317 N350 C351	Y317-S348 WeakPolarHBondContact CE1-O 3.36Å; S348-N350 PolarHBondContact O-N 3.28Å; S348-N350 PolarHBondContact OG-N 3.45Å; S348-C351 PolarHBondContact N-O 3.13Å; S348-C351 CarbonylContact O-C 3.53Å; S348-C351 PolarHBondContact O-N 3.04Å; S348-C351 PolarHBondContact OG-N 3.25Å
349	G	81.7	Confident	90.4	Very high	53 Å²	53	39 Å²	39	55%	0.546	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.4	175.4	0	0	0	0	0	114.8
350	N	84.5	Confident	90.1	Very high	167 Å²	167	36.7 Å²	36.7	89%	0.893	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-7.9	175.2	-63.9	-22.5	0	0	0	113.3	S348	S348-N350 PolarHBondContact O-N 3.28Å; S348-N350 PolarHBondContact OG-N 3.45Å
351	C	84.2	Confident	89.6	Confident	34 Å²	34	39.8 Å²	39.8	23%	0.23	23%	0.225	C	C	.	.	B	Isolated β-bridge	trans	-144	86.8	-176.7	177.9	0	0	0	0	108.5	V347 S348 E353	V347-C351 HydrophobicContact CB-CB 4.4Å; V347-C351 PolarHBondContact N-O 3.11Å; S348-C351 PolarHBondContact N-O 3.13Å; S348-C351 CarbonylContact O-C 3.53Å; S348-C351 PolarHBondContact O-N 3.04Å; S348-C351 PolarHBondContact OG-N 3.25Å; C351-E353 PolarHBondContact O-N 3.4Å
352	E	84.5	Confident	89	Confident	97 Å²	97	40.1 Å²	40.1	45%	0.453	23%	0.231	S	C	.	.			trans	-92	39.2	-177.6	-55.8	-155.2	133.9	0	0	112	Y317 V409	Y317-E352 HydrophobicContact CE1-CG 4.38Å; Y317-E352 PolarHBondContact OH-OE1 2.88Å; E352-V409 WeakPolarHBondContact O-CG2 3.37Å
353	E	88.1	Confident	88.1	Confident	100 Å²	100	48.4 Å²	48.4	47%	0.467	27%	0.272	S	S	.	.	S	Bend	trans	-101.8	145.8	-176.6	-68.1	177.3	165.1	0	0	111.7	G346 C351 K355 E404	G346-E353 WeakPolarHBondContact CA-O 3.44Å; C351-E353 PolarHBondContact O-N 3.4Å; E353-K355 PolarHBondContact O-N 3.43Å; E353-E404 HydrophobicContact CB-CB 3.94Å; E353-E404 HydrophobicContact CB-CG 4.41Å; E353-E404 HydrophobicContact CG-CB 4.41Å
354	F	88	Confident	87.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.			trans	-75.2	94.3	174.4	-179.7	-169	0	0	0	109	L342 P344 I376 L403 E404 V407 V409 V412 M425	L342-F354 HydrophobicContact CD2-CE2 4Å; L342-F354 HydrophobicContact CD2-CZ 4.15Å; P344-F354 HydrophobicContact CB-CE2 4.19Å; F354-I376 HydrophobicContact CE1-CD1 4.1Å; F354-L403 HydrophobicContact CD1-CD2 3.85Å; F354-L403 HydrophobicContact CD1-CG 4.39Å; F354-L403 HydrophobicContact CD2-CD2 4.42Å; F354-L403 HydrophobicContact CE1-CD2 3.45Å; F354-L403 VanDerWaalsContact CE1-CD2 3.45Å; F354-L403 HydrophobicContact CE1-CG 4.38Å; F354-L403 HydrophobicContact CE2-CD2 4.07Å; F354-L403 HydrophobicContact CG-CD2 4.34Å; F354-L403 HydrophobicContact CZ-CD2 3.57Å; F354-E404 PolarHBondContact O-N 3.26Å; F354-V407 HydrophobicContact CD1-CB 3.97Å; F354-V407 HydrophobicContact CD1-CG1 3.69Å; F354-V407 HydrophobicContact CE1-CG1 4.24Å; F354-V409 HydrophobicContact CB-CG2 3.84Å; F354-V412 HydrophobicContact CD1-CG2 4.36Å; F354-M425 HydrophobicContact CE1-CE 3.83Å; F354-M425 HydrophobicContact CE1-SD 3.8Å; F354-M425 HydrophobicContact CZ-CE 4.19Å; F354-M425 HydrophobicContact CZ-SD 3.63Å
355	K	91.1	Very high	86.7	Confident	52 Å²	52	53.5 Å²	53.5	23%	0.226	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	138.8	-173.3	-161.3	170.5	-167.9	165	0	112.2	L342 H343 V347 E353 D400	L342-K355 WeakPolarHBondContact CA-O 3.4Å; H343-K355 HydrophobicContact CB-CB 4.21Å; H343-K355 PolarHBondContact N-O 2.9Å; H343-K355 PolarHBondContact O-N 3.16Å; V347-K355 HydrophobicContact CG2-CB 3.66Å; V347-K355 HydrophobicContact CG2-CD 3.6Å; V347-K355 HydrophobicContact CG2-CG 4.3Å; E353-K355 PolarHBondContact O-N 3.43Å; K355-D400 WeakPolarHBondContact CE-OD2 3.24Å; K355-D400 IonicContact NZ-OD2 3.46Å
356	C	94	Very high	86.2	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	114.3	175.7	-173.2	0	0	0	0	109.6	L340 K341 L342 L374 D400 L401 L403	L340-C356 WeakPolarHBondContact CD1-SG 3.23Å; K341-C356 CarbonylContact O-C 3.53Å; K341-C356 WeakPolarHBondContact O-CA 3.36Å; L342-C356 HydrophobicContact CG-CB 4.49Å; C356-L374 HydrophobicContact CB-CD2 4Å; C356-L374 VanDerWaalsContact SG-CD2 3.52Å; C356-D400 VanDerWaalsContact O-OD1 3.11Å; C356-L401 HydrophobicContact CB-CB 4.46Å; C356-L401 WeakPolarHBondContact O-CB 3.44Å; C356-L401 PolarHBondContact O-N 3.48Å; C356-L403 HydrophobicContact CB-CB 4.13Å; C356-L403 HydrophobicContact CB-CD2 4.28Å
357	M	94.8	Very high	86.1	Confident	61 Å²	61	63.8 Å²	63.8	30%	0.3	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.6	-178.6	-170.4	-179.2	-61.9	0	0	110.3	K341 V359 S399	K341-M357 HydrophobicContact CB-CB 4.37Å; K341-M357 PolarHBondContact N-O 2.91Å; K341-M357 PolarHBondContact O-N 3.48Å; M357-V359 HydrophobicContact CG-CG2 4.01Å; M357-V359 HydrophobicContact SD-CG2 4.06Å; M357-S399 WeakPolarHBondContact CA-O 3.36Å; M357-S399 WeakPolarHBondContact CG-O 3.4Å
358	L	95.6	Very high	86.1	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.3	169.5	-173.6	69	0	0	0	109.2	W338 L340 I370 F392 G398 S399 L401 L429 L431	W338-L358 HydrophobicContact CB-CD1 3.81Å; W338-L358 HydrophobicContact CD2-CD1 4.46Å; W338-L358 HydrophobicContact CD2-CD2 4.43Å; W338-L358 HydrophobicContact CD2-CG 4.49Å; W338-L358 HydrophobicContact CE3-CD1 4.39Å; W338-L358 HydrophobicContact CE3-CD2 4.08Å; W338-L358 HydrophobicContact CE3-CG 4Å; W338-L358 HydrophobicContact CG-CD1 4.26Å; W338-L358 HydrophobicContact CZ3-CD2 4.37Å; L340-L358 HydrophobicContact CD1-CD1 4.11Å; L358-I370 HydrophobicContact CD2-CD1 3.53Å; L358-F392 HydrophobicContact CB-CZ 4.15Å; L358-F392 HydrophobicContact CD2-CE2 4.19Å; L358-F392 HydrophobicContact CD2-CZ 3.84Å; L358-F392 HydrophobicContact CG-CZ 4.07Å; L358-F392 WeakPolarHBondContact O-CE1 3.47Å; L358-G398 CarbonylContact O-C 3.54Å; L358-G398 WeakPolarHBondContact O-CA 3.25Å; L358-S399 PolarHBondContact N-O 3.34Å; L358-S399 PolarHBondContact O-N 3.39Å; L358-L401 HydrophobicContact CB-CD1 4.15Å; L358-L401 HydrophobicContact CB-CD2 3.86Å; L358-L401 HydrophobicContact CB-CG 4.1Å; L358-L429 HydrophobicContact CD1-CD2 4.23Å; L358-L431 HydrophobicContact CD1-CD1 4.24Å; L358-L431 HydrophobicContact CD2-CD1 3.82Å; L358-L431 HydrophobicContact CD2-CD2 3.86Å
359	V	94.1	Very high	86.1	Confident	15 Å²	15	62.9 Å²	62.9	9%	0.091	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.9	-178.8	-171.1	0	0	0	0	108.9	W338 E339 K341 M357 Y397	W338-V359 CarbonylContact C-O 3.58Å; W338-V359 VanDerWaalsContact CA-O 3.23Å; W338-V359 WeakPolarHBondContact CA-O 3.48Å; E339-V359 HydrophobicContact CB-CB 4.44Å; E339-V359 PolarHBondContact N-O 2.87Å; E339-V359 PolarHBondContact O-N 3.43Å; K341-V359 HydrophobicContact CD-CG2 4.06Å; K341-V359 HydrophobicContact CG-CG2 4.32Å; M357-V359 HydrophobicContact CG-CG2 4.01Å; M357-V359 HydrophobicContact SD-CG2 4.06Å; V359-Y397 CarbonylContact C-O 3.16Å; V359-Y397 WeakPolarHBondContact CA-O 3.32Å; V359-Y397 HydrophobicContact CG1-CD2 3.68Å; V359-Y397 HydrophobicContact CG1-CE2 4.15Å
360	S	90.4	Very high	86.6	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.049	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125	169.2	-167.3	0	0	0	0	109.4	V362 L364 Y397	S360-V362 PolarHBondContact O-N 3.09Å; S360-V362 PolarHBondContact OG-O 2.9Å; S360-L364 WeakPolarHBondContact OG-CD2 3.46Å; S360-Y397 PolarHBondContact N-O 3.03Å
361	S	84.8	Confident	87.1	Confident	64 Å²	64	53.5 Å²	53.5	45%	0.448	28%	0.283	S	S	.	.	S	Bend	trans	-77.6	-7.6	-176.5	-52.3	0	0	0	0	113.3	D337 W338 E339	D337-S361 PolarHBondContact O-N 3.12Å; W338-S361 WeakPolarHBondContact CA-OG 2.96Å; W338-S361 PolarHBondContact O-OG 3.07Å; E339-S361 PolarHBondContact N-OG 3.25Å
362	V	82	Confident	87.6	Confident	56 Å²	56	51.9 Å²	51.9	34%	0.339	27%	0.273	S	S	.	.	S	Bend	trans	-126.2	148.8	-177.6	-67.9	0	0	0	0	110.5	D337 S360 L364	D337-V362 HydrophobicContact CB-CG1 4.35Å; S360-V362 PolarHBondContact O-N 3.09Å; S360-V362 PolarHBondContact OG-O 2.9Å; V362-L364 PolarHBondContact O-N 2.76Å
363	M	76.4	Confident	88.1	Confident	173 Å²	173	47.8 Å²	47.8	85%	0.852	25%	0.254	S	S	*	.			trans	-62.6	123.8	171.3	-75.3	-68.3	-176.7	0	0	109.6	D365	M363-D365 PolarHBondContact O-N 3.16Å
364	L	77	Confident	88.5	Confident	3 Å²	3	43 Å²	43	2%	0.016	23%	0.231	C	C	.	.			trans	-86.6	109.5	-174.5	-66.9	177.5	0	0	0	110.7	S360 V362 Q366 R368 F392 K394	S360-L364 WeakPolarHBondContact OG-CD2 3.46Å; V362-L364 PolarHBondContact O-N 2.76Å; L364-Q366 VanDerWaalsContact C-N 3.29Å; L364-Q366 PolarHBondContact O-N 3.39Å; L364-R368 HydrophobicContact CD2-CG 4.14Å; L364-R368 VanDerWaalsContact CD2-NE 3.33Å; L364-F392 HydrophobicContact CD1-CB 3.44Å; L364-F392 VanDerWaalsContact CD1-CB 3.44Å; L364-K394 WeakPolarHBondContact O-CE 3.34Å; L364-K394 WeakPolarHBondContact O-CG 3.28Å
365	D	75.5	Confident	88.9	Confident	130 Å²	130	43.2 Å²	43.2	70%	0.695	23%	0.233	S	C	*	.	S	Bend	trans	-69.4	-31.1	173.7	-80.8	-41	0	0	0	113.7	M363 K394	M363-D365 PolarHBondContact O-N 3.16Å; D365-K394 VanDerWaalsContact CA-CE 3.43Å; D365-K394 WeakPolarHBondContact O-CE 3.28Å; D365-K394 IonicContact OD1-NZ 2.77Å; D365-K394 PolarHBondContact OD1-NZ 3.32Å
366	Q	79.8	Confident	89.1	Confident	159 Å²	159	40.8 Å²	40.8	74%	0.743	22%	0.222	S	C	*	.	S	Bend	trans	-126.5	150.2	178.2	-62.9	178.5	5.4	0	0	109.9	L364	L364-Q366 VanDerWaalsContact C-N 3.29Å; L364-Q366 PolarHBondContact O-N 3.39Å
367	S	85.4	Confident	89.3	Confident	76 Å²	76	40.9 Å²	40.9	53%	0.531	22%	0.222	S	C	.	.			trans	-65.7	133.8	177	-171.2	0	0	0	0	110.5	V391 F392	S367-V391 WeakPolarHBondContact OG-CG1 3.47Å; S367-F392 CarbonylContact C-O 3.48Å; S367-F392 WeakPolarHBondContact CA-O 3.42Å; S367-F392 PolarHBondContact OG-O 2.92Å
368	R	86.7	Confident	89.3	Confident	46 Å²	46	39.7 Å²	39.7	17%	0.174	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	110.6	176.4	-64	-179.1	-178.8	166.1	2.3	109.2	W336 L364 F392	W336-R368 HydrophobicContact CH2-CB 3.92Å; W336-R368 HydrophobicContact CH2-CG 3.83Å; W336-R368 HydrophobicContact CZ2-CB 4.38Å; W336-R368 HydrophobicContact CZ2-CG 3.77Å; W336-R368 HydrophobicContact CZ3-CB 4.13Å; W336-R368 HydrophobicContact CZ3-CG 4.3Å; L364-R368 HydrophobicContact CD2-CG 4.14Å; L364-R368 VanDerWaalsContact CD2-NE 3.33Å; R368-F392 HydrophobicContact CB-CB 4.49Å; R368-F392 PolarHBondContact N-O 3.4Å; R368-F392 PolarHBondContact O-N 3.27Å
369	A	90.1	Very high	89	Confident	28 Å²	28	44.1 Å²	44.1	23%	0.231	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	132.1	170.2	0	0	0	0	0	109.3	V391 I434	A369-V391 HydrophobicContact CB-CG2 4.09Å; A369-I434 HydrophobicContact CB-CB 4.02Å; A369-I434 PolarHBondContact O-N 2.97Å
370	I	92.2	Very high	89	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.8	179.3	69	173.8	0	0	0	111.7	W336 W338 L358 K389 K390 F392 L431 R432 I434	W336-I370 HydrophobicContact CE3-CG2 4.46Å; W336-I370 HydrophobicContact CZ3-CG2 3.79Å; W338-I370 HydrophobicContact CH2-CD1 4.18Å; W338-I370 HydrophobicContact CH2-CG2 4.19Å; W338-I370 HydrophobicContact CZ2-CD1 4.44Å; W338-I370 HydrophobicContact CZ2-CG2 4.16Å; L358-I370 HydrophobicContact CD2-CD1 3.53Å; I370-K389 CarbonylContact O-C 3.46Å; I370-K389 VanDerWaalsContact O-CA 3.25Å; I370-K389 WeakPolarHBondContact O-CA 3.43Å; I370-K390 HydrophobicContact CG1-CB 4.49Å; I370-K390 PolarHBondContact N-O 3.32Å; I370-K390 PolarHBondContact O-N 3Å; I370-F392 HydrophobicContact CD1-CD2 4.15Å; I370-F392 HydrophobicContact CD1-CE2 3.49Å; I370-F392 VanDerWaalsContact CD1-CE2 3.49Å; I370-F392 HydrophobicContact CD1-CZ 4.35Å; I370-F392 HydrophobicContact CG1-CD2 4.22Å; I370-F392 HydrophobicContact CG1-CE2 3.82Å; I370-L431 HydrophobicContact CD1-CD1 4.44Å; I370-L431 HydrophobicContact CD1-CD2 4Å; I370-R432 CarbonylContact C-O 3.16Å; I370-R432 VanDerWaalsContact CA-O 3.28Å; I370-R432 WeakPolarHBondContact CA-O 3.28Å; I370-I434 WeakPolarHBondContact O-CD1 3.4Å
371	E	94	Very high	89.3	Confident	20 Å²	20	51.1 Å²	51.1	9%	0.093	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	132.4	160.4	-167	-173.8	-157.2	0	0	107	L278 A279 G388 K389 R432 I434	L278-E371 VanDerWaalsContact CB-CD 3.43Å; L278-E371 HydrophobicContact CB-CG 3.9Å; L278-E371 HydrophobicContact CD1-CB 4.22Å; L278-E371 HydrophobicContact CD1-CG 3.98Å; L278-E371 WeakPolarHBondContact CD1-O 3.33Å; L278-E371 HydrophobicContact CG-CG 4.09Å; L278-E371 WeakPolarHBondContact CG-OE2 3.48Å; L278-E371 PolarHBondContact N-OE1 3.29Å; L278-E371 VanDerWaalsContact N-OE1 3.13Å; L278-E371 PolarHBondContact N-OE2 3.26Å; A279-E371 PolarHBondContact N-OE1 2.85Å; A279-E371 VanDerWaalsContact N-OE1 3.07Å; E371-G388 WeakPolarHBondContact CA-O 3.25Å; E371-K389 HydrophobicContact CB-CG 4.46Å; E371-K389 HydrophobicContact CG-CG 4.24Å; E371-R432 PolarHBondContact N-O 2.99Å; E371-R432 PolarHBondContact O-N 3.48Å; E371-I434 HydrophobicContact CB-CD1 4.03Å; E371-I434 HydrophobicContact CB-CG1 3.96Å
372	Y	95.3	Very high	89.8	Confident	1 Å²	1	49.2 Å²	49.2	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.3	177.5	72.4	-89.1	0	0	0	111.5	I386 V387 G388 K390 L401 T430	Y372-I386 HydrophobicContact CE2-CG2 4.41Å; Y372-V387 VanDerWaalsContact O-CA 3.31Å; Y372-V387 WeakPolarHBondContact O-CA 3.41Å; Y372-G388 VanDerWaalsContact CD1-C 3.47Å; Y372-G388 VanDerWaalsContact CD1-O 3.24Å; Y372-G388 WeakPolarHBondContact CD1-O 3.42Å; Y372-G388 PolarHBondContact N-O 2.82Å; Y372-G388 PolarHBondContact O-N 2.87Å; Y372-G388 VanDerWaalsContact O-N 3.12Å; Y372-K390 HydrophobicContact CD1-CG 4.16Å; Y372-K390 HydrophobicContact CE1-CD 4.47Å; Y372-K390 HydrophobicContact CE1-CG 3.8Å; Y372-L401 HydrophobicContact CD1-CD2 3.93Å; Y372-L401 HydrophobicContact CD2-CB 4.35Å; Y372-L401 HydrophobicContact CD2-CD1 4.28Å; Y372-L401 HydrophobicContact CD2-CD2 3.93Å; Y372-L401 HydrophobicContact CD2-CG 4.42Å; Y372-L401 HydrophobicContact CE1-CD2 3.89Å; Y372-L401 HydrophobicContact CE2-CB 3.78Å; Y372-L401 HydrophobicContact CE2-CD2 3.9Å; Y372-L401 HydrophobicContact CE2-CG 4.27Å; Y372-L401 HydrophobicContact CG-CD2 3.95Å; Y372-L401 PolarHBondContact OH-O 2.84Å; Y372-T430 CarbonylContact C-O 3.58Å; Y372-T430 VanDerWaalsContact CA-O 3.25Å; Y372-T430 WeakPolarHBondContact CA-O 3.12Å
373	M	95.7	Very high	90.5	Very high	11 Å²	11	49.5 Å²	49.5	5%	0.054	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	119.9	165.3	-177.5	174.2	73.9	0	0	108.2	Y273 L278 R281 A282 I386 V387 L429 T430	Y273-M373 WeakPolarHBondContact OH-CE 3.3Å; L278-M373 HydrophobicContact CB-CB 4.1Å; L278-M373 HydrophobicContact CD1-CB 3.99Å; L278-M373 HydrophobicContact CD2-CB 4.49Å; L278-M373 HydrophobicContact CG-CB 4.43Å; R281-M373 HydrophobicContact CB-SD 4.26Å; A282-M373 HydrophobicContact CB-SD 4.43Å; M373-I386 CarbonylContact C-O 3.17Å; M373-I386 VanDerWaalsContact CA-O 3.3Å; M373-I386 WeakPolarHBondContact CA-O 3.31Å; M373-V387 HydrophobicContact CB-CG1 4.01Å; M373-V387 HydrophobicContact CG-CG1 3.8Å; M373-V387 HydrophobicContact SD-CG1 4.37Å; M373-L429 CarbonylContact O-C 3.57Å; M373-L429 WeakPolarHBondContact O-CA 3.28Å; M373-T430 PolarHBondContact N-O 2.9Å; M373-T430 PolarHBondContact O-N 2.85Å
374	L	96.3	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	125.6	174.3	176.6	62.7	0	0	0	108.4	C356 S385 I386 L401 L403 L427 Q428 L429	C356-L374 HydrophobicContact CB-CD2 4Å; C356-L374 VanDerWaalsContact SG-CD2 3.52Å; L374-S385 CarbonylContact O-C 3.6Å; L374-S385 WeakPolarHBondContact O-CA 3.47Å; L374-I386 HydrophobicContact CB-CG2 3.89Å; L374-I386 PolarHBondContact N-O 2.77Å; L374-I386 PolarHBondContact O-N 3.46Å; L374-L401 HydrophobicContact CD2-CD1 4.19Å; L374-L403 HydrophobicContact CD2-CB 4.43Å; L374-L403 HydrophobicContact CD2-CD1 4.16Å; L374-L403 HydrophobicContact CD2-CD2 3.96Å; L374-L403 HydrophobicContact CD2-CG 4.42Å; L374-L403 HydrophobicContact CG-CD1 4.45Å; L374-L427 HydrophobicContact CD1-CB 4.31Å; L374-Q428 WeakPolarHBondContact CA-O 2.92Å; L374-L429 HydrophobicContact CB-CD1 4.06Å; L374-L429 HydrophobicContact CD1-CB 4.28Å; L374-L429 HydrophobicContact CD1-CD1 4.19Å
375	S	96	Very high	92.1	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.028	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140	-176.5	-59.1	0	0	0	0	112.2	R384 S385 L427 Q428	S375-R384 CarbonylContact C-O 3.58Å; S375-R384 WeakPolarHBondContact CA-O 3.13Å; S375-R384 WeakPolarHBondContact CB-O 3.25Å; S375-S385 WeakPolarHBondContact OG-CB 3.31Å; S375-S385 PolarHBondContact OG-OG 3.2Å; S375-L427 CarbonylContact O-C 3.5Å; S375-L427 VanDerWaalsContact O-CA 3.28Å; S375-L427 WeakPolarHBondContact O-CA 3.28Å; S375-Q428 PolarHBondContact N-O 3.5Å; S375-Q428 PolarHBondContact O-N 3.16Å
376	I	95.9	Very high	93	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	133.4	162.3	-50	-159.7	0	0	0	107.9	F354 L383 R384 V407 L419 M425 L427	F354-I376 HydrophobicContact CE1-CD1 4.1Å; I376-L383 HydrophobicContact CG2-CD1 4.46Å; I376-L383 WeakPolarHBondContact O-CB 3.36Å; I376-L383 PolarHBondContact O-N 2.94Å; I376-R384 PolarHBondContact N-O 3.03Å; I376-R384 PolarHBondContact O-N 3.21Å; I376-V407 HydrophobicContact CD1-CB 4.44Å; I376-V407 HydrophobicContact CD1-CG1 4.15Å; I376-V407 HydrophobicContact CD1-CG2 3.6Å; I376-V407 HydrophobicContact CG1-CG2 4.39Å; I376-L419 HydrophobicContact CG2-CB 4.3Å; I376-L419 HydrophobicContact CG2-CD2 4.19Å; I376-M425 HydrophobicContact CD1-CE 4.36Å; I376-M425 HydrophobicContact CD1-SD 4.48Å; I376-L427 HydrophobicContact CB-CD2 4.26Å; I376-L427 HydrophobicContact CD1-CD2 4.17Å; I376-L427 HydrophobicContact CG1-CD2 3.61Å
377	V	96.8	Very high	93.8	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	156.8	-175.6	-52.1	0	0	0	0	111.1	L293 A381 V382 V426 Q428	L293-V377 HydrophobicContact CD2-CB 3.6Å; L293-V377 HydrophobicContact CD2-CG1 3.89Å; L293-V377 HydrophobicContact CD2-CG2 4.08Å; V377-A381 WeakPolarHBondContact CA-O 3.49Å; V377-V382 HydrophobicContact CG1-CB 4.32Å; V377-V382 HydrophobicContact CG1-CG1 4.28Å; V377-V382 HydrophobicContact CG1-CG2 4.04Å; V377-V426 HydrophobicContact CG2-CB 3.75Å; V377-V426 HydrophobicContact CG2-CG1 3.45Å; V377-V426 VanDerWaalsContact CG2-CG1 3.45Å; V377-V426 PolarHBondContact N-O 3.44Å; V377-Q428 HydrophobicContact CG1-CG 4.05Å; V377-Q428 HydrophobicContact CG2-CG 4.24Å
378	N	94.6	Very high	94.2	Very high	37 Å²	37	32.5 Å²	32.5	20%	0.198	17%	0.173	C	C	.	.			trans	-110.6	-163.8	162.3	69.1	11.5	0	0	0	111.2	L293 K380 A381 L383 I421	L293-N378 VanDerWaalsContact CD1-O 3.29Å; L293-N378 WeakPolarHBondContact CD1-O 3.49Å; N378-K380 PolarHBondContact O-N 3.2Å; N378-K380 WeakPolarHBondContact OD1-CA 3.49Å; N378-K380 PolarHBondContact OD1-N 2.98Å; N378-A381 PolarHBondContact N-O 3.36Å; N378-A381 PolarHBondContact OD1-N 2.87Å; N378-A381 PolarHBondContact OD1-O 3.22Å; N378-L383 HydrophobicContact CB-CD1 4.17Å; N378-L383 HydrophobicContact CB-CG 4.47Å; N378-I421 VanDerWaalsContact CA-CD1 3.45Å; N378-I421 HydrophobicContact CB-CD1 3.85Å; N378-I421 HydrophobicContact CB-CG1 3.83Å
379	D	90.8	Very high	94.6	Very high	92 Å²	92	37 Å²	37	49%	0.492	19%	0.194	S	C	.	.	S	Bend	trans	-72.9	-15.8	179.2	62.8	-31.9	0	0	0	113.1	L293 I421	L293-D379 WeakPolarHBondContact CD1-O 3.49Å; D379-I421 HydrophobicContact CB-CD1 4.16Å; D379-I421 VanDerWaalsContact N-CD1 3.3Å
380	K	93.6	Very high	94.8	Very high	144 Å²	144	37.2 Å²	37.2	63%	0.626	19%	0.19	S	C	*	.	S	Bend	trans	-113.3	-29.9	-173.1	-67.2	170.6	-170.4	177.1	0	113.5	T289 A290 N378	T289-K380 CarbonylContact C-O 3.56Å; A290-K380 WeakPolarHBondContact CA-O 3.41Å; A290-K380 PolarHBondContact N-O 3.45Å; N378-K380 PolarHBondContact O-N 3.2Å; N378-K380 WeakPolarHBondContact OD1-CA 3.49Å; N378-K380 PolarHBondContact OD1-N 2.98Å
381	A	95.9	Very high	94.8	Very high	25 Å²	25	40.6 Å²	40.6	21%	0.207	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-160.1	157.5	-163.7	0	0	0	0	0	114.3	S288 V377 N378	S288-A381 CarbonylContact O-C 3.54Å; S288-A381 WeakPolarHBondContact O-CA 3.44Å; S288-A381 WeakPolarHBondContact O-CB 3.38Å; V377-A381 WeakPolarHBondContact CA-O 3.49Å; N378-A381 PolarHBondContact N-O 3.36Å; N378-A381 PolarHBondContact OD1-N 2.87Å; N378-A381 PolarHBondContact OD1-O 3.22Å
382	V	96.6	Very high	94.7	Very high	24 Å²	24	39.6 Å²	39.6	15%	0.145	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.4	163	-178.6	0	0	0	0	108.3	S288 F292 L293 V377	S288-V382 PolarHBondContact O-N 2.7Å; F292-V382 HydrophobicContact CB-CG2 4.11Å; L293-V382 HydrophobicContact CD2-CG2 4.17Å; V377-V382 HydrophobicContact CG1-CB 4.32Å; V377-V382 HydrophobicContact CG1-CG1 4.28Å; V377-V382 HydrophobicContact CG1-CG2 4.04Å
383	L	95.1	Very high	94.4	Very high	62 Å²	62	41 Å²	41	33%	0.325	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	-51.2	-174.2	-58.6	179.3	0	0	0	111.5	I376 N378 P418 L419	I376-L383 HydrophobicContact CG2-CD1 4.46Å; I376-L383 WeakPolarHBondContact O-CB 3.36Å; I376-L383 PolarHBondContact O-N 2.94Å; N378-L383 HydrophobicContact CB-CD1 4.17Å; N378-L383 HydrophobicContact CB-CG 4.47Å; L383-P418 WeakPolarHBondContact CD1-O 3.42Å; L383-L419 HydrophobicContact CB-CD2 4.42Å; L383-L419 HydrophobicContact CD1-CD2 4.03Å
384	R	93.2	Very high	93.9	Very high	80 Å²	80	47 Å²	47	30%	0.302	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	144.9	-176.5	-62.7	-171.8	-179	-179.3	6.8	109.5	S375 I376 K406 E411	S375-R384 CarbonylContact C-O 3.58Å; S375-R384 WeakPolarHBondContact CA-O 3.13Å; S375-R384 WeakPolarHBondContact CB-O 3.25Å; I376-R384 PolarHBondContact N-O 3.03Å; I376-R384 PolarHBondContact O-N 3.21Å; R384-K406 WeakPolarHBondContact CD-O 3.2Å; R384-K406 PolarHBondContact NH1-O 3.39Å; R384-E411 IonicContact CZ-OE1 3.75Å; R384-E411 VanDerWaalsContact CZ-OE1 3.25Å; R384-E411 IonicContact CZ-OE2 3.85Å; R384-E411 IonicContact NH1-OE1 3.8Å; R384-E411 PolarHBondContact NH1-OE1 3.05Å; R384-E411 IonicContact NH1-OE2 3.8Å; R384-E411 PolarHBondContact NH1-OE2 3.13Å; R384-E411 IonicContact NH2-OE1 3.62Å; R384-E411 PolarHBondContact NH2-OE1 3.26Å; R384-E411 IonicContact NH2-OE2 2.64Å; R384-E411 PolarHBondContact NH2-OE2 3.38Å
385	S	94.6	Very high	93.4	Very high	26 Å²	26	52.4 Å²	52.4	18%	0.182	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	138.9	174.3	-58.8	0	0	0	0	109.7	L374 S375	L374-S385 CarbonylContact O-C 3.6Å; L374-S385 WeakPolarHBondContact O-CA 3.47Å; S375-S385 WeakPolarHBondContact OG-CB 3.31Å; S375-S385 PolarHBondContact OG-OG 3.2Å
386	I	95	Very high	93	Very high	9 Å²	9	59.2 Å²	59.2	5%	0.046	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	143.8	162.9	-169.4	159.9	0	0	0	109.3	Y372 M373 L374 L401 E402 L403 K405 K406	Y372-I386 HydrophobicContact CE2-CG2 4.41Å; M373-I386 CarbonylContact C-O 3.17Å; M373-I386 VanDerWaalsContact CA-O 3.3Å; M373-I386 WeakPolarHBondContact CA-O 3.31Å; L374-I386 HydrophobicContact CB-CG2 3.89Å; L374-I386 PolarHBondContact N-O 2.77Å; L374-I386 PolarHBondContact O-N 3.46Å; I386-L401 WeakPolarHBondContact CD1-O 3.24Å; I386-E402 HydrophobicContact CD1-CB 3.97Å; I386-E402 WeakPolarHBondContact CD1-O 3.16Å; I386-L403 HydrophobicContact CB-CD1 4.48Å; I386-L403 HydrophobicContact CG2-CD1 3.7Å; I386-K405 HydrophobicContact CD1-CB 4.35Å; I386-K406 HydrophobicContact CB-CG 4.07Å; I386-K406 HydrophobicContact CD1-CG 4.25Å; I386-K406 HydrophobicContact CG1-CG 4.4Å
387	V	95.6	Very high	92.7	Very high	49 Å²	49	66 Å²	66	30%	0.297	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	146.9	-176	-69.1	0	0	0	0	108.8	A279 A282 Y372 M373	A279-V387 HydrophobicContact CB-CG2 4.33Å; A282-V387 HydrophobicContact CB-CG1 3.53Å; A282-V387 HydrophobicContact CB-CG2 4.48Å; Y372-V387 VanDerWaalsContact O-CA 3.31Å; Y372-V387 WeakPolarHBondContact O-CA 3.41Å; M373-V387 HydrophobicContact CB-CG1 4.01Å; M373-V387 HydrophobicContact CG-CG1 3.8Å; M373-V387 HydrophobicContact SD-CG1 4.37Å
388	G	94.7	Very high	92.4	Very high	20 Å²	20	67 Å²	67	21%	0.206	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	-179.1	175.2	0	0	0	0	0	112.3	E371 Y372	E371-G388 WeakPolarHBondContact CA-O 3.25Å; Y372-G388 VanDerWaalsContact CD1-C 3.47Å; Y372-G388 VanDerWaalsContact CD1-O 3.24Å; Y372-G388 WeakPolarHBondContact CD1-O 3.42Å; Y372-G388 PolarHBondContact N-O 2.82Å; Y372-G388 PolarHBondContact O-N 2.87Å; Y372-G388 VanDerWaalsContact O-N 3.12Å
389	K	94.9	Very high	92.4	Very high	140 Å²	140	66.1 Å²	66.1	61%	0.609	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.9	177.1	-61.1	-177.7	174.3	-175.6	0	108.7	I370 E371 I434	I370-K389 CarbonylContact O-C 3.46Å; I370-K389 VanDerWaalsContact O-CA 3.25Å; I370-K389 WeakPolarHBondContact O-CA 3.43Å; E371-K389 HydrophobicContact CB-CG 4.46Å; E371-K389 HydrophobicContact CG-CG 4.24Å; K389-I434 HydrophobicContact CB-CD1 3.99Å; K389-I434 HydrophobicContact CD-CD1 3.76Å; K389-I434 HydrophobicContact CG-CD1 3.78Å
390	K	93.9	Very high	92.5	Very high	33 Å²	33	63.4 Å²	63.4	14%	0.143	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	151.1	176.5	-60.3	-63	-175.5	164.7	0	109.9	I370 Y372 F392 S399 D400 E402	I370-K390 HydrophobicContact CG1-CB 4.49Å; I370-K390 PolarHBondContact N-O 3.32Å; I370-K390 PolarHBondContact O-N 3Å; Y372-K390 HydrophobicContact CD1-CG 4.16Å; Y372-K390 HydrophobicContact CE1-CD 4.47Å; Y372-K390 HydrophobicContact CE1-CG 3.8Å; K390-F392 HydrophobicContact CB-CD2 4.39Å; K390-F392 HydrophobicContact CB-CE2 3.73Å; K390-F392 HydrophobicContact CB-CZ 4.32Å; K390-S399 VanDerWaalsContact CD-OG 3.31Å; K390-S399 WeakPolarHBondContact CD-OG 3.31Å; K390-D400 WeakPolarHBondContact CE-O 3.38Å; K390-D400 PolarHBondContact NZ-O 2.8Å; K390-E402 IonicContact NZ-OE1 2.96Å; K390-E402 PolarHBondContact NZ-OE1 3.04Å
391	V	92	Very high	92.5	Very high	73 Å²	73	56.6 Å²	56.6	44%	0.442	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.9	175.8	-176.8	0	0	0	0	107.7	S367 A369	S367-V391 WeakPolarHBondContact OG-CG1 3.47Å; A369-V391 HydrophobicContact CB-CG2 4.09Å
392	F	91.5	Very high	92.2	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	135.5	178.5	-66	-96.9	0	0	0	109.7	W338 L358 L364 S367 R368 I370 K390 R396 Y397	W338-F392 AromaticContact CH2-CD2 3.95Å; W338-F392 HydrophobicContact CH2-CD2 3.95Å; W338-F392 HydrophobicContact CH2-CE2 4.27Å; W338-F392 HydrophobicContact CH2-CG 4.23Å; W338-F392 AromaticContact CZ3-CD1 3.95Å; W338-F392 HydrophobicContact CZ3-CD1 3.95Å; W338-F392 AromaticContact CZ3-CD2 3.82Å; W338-F392 HydrophobicContact CZ3-CD2 3.82Å; W338-F392 HydrophobicContact CZ3-CE1 4.04Å; W338-F392 AromaticContact CZ3-CE2 3.94Å; W338-F392 HydrophobicContact CZ3-CE2 3.94Å; W338-F392 AromaticContact CZ3-CG 3.84Å; W338-F392 HydrophobicContact CZ3-CG 3.84Å; W338-F392 HydrophobicContact CZ3-CZ 4.05Å; L358-F392 HydrophobicContact CB-CZ 4.15Å; L358-F392 HydrophobicContact CD2-CE2 4.19Å; L358-F392 HydrophobicContact CD2-CZ 3.84Å; L358-F392 HydrophobicContact CG-CZ 4.07Å; L358-F392 WeakPolarHBondContact O-CE1 3.47Å; L364-F392 HydrophobicContact CD1-CB 3.44Å; L364-F392 VanDerWaalsContact CD1-CB 3.44Å; S367-F392 CarbonylContact C-O 3.48Å; S367-F392 WeakPolarHBondContact CA-O 3.42Å; S367-F392 PolarHBondContact OG-O 2.92Å; R368-F392 HydrophobicContact CB-CB 4.49Å; R368-F392 PolarHBondContact N-O 3.4Å; R368-F392 PolarHBondContact O-N 3.27Å; I370-F392 HydrophobicContact CD1-CD2 4.15Å; I370-F392 HydrophobicContact CD1-CE2 3.49Å; I370-F392 VanDerWaalsContact CD1-CE2 3.49Å; I370-F392 HydrophobicContact CD1-CZ 4.35Å; I370-F392 HydrophobicContact CG1-CD2 4.22Å; I370-F392 HydrophobicContact CG1-CE2 3.82Å; K390-F392 HydrophobicContact CB-CD2 4.39Å; K390-F392 HydrophobicContact CB-CE2 3.73Å; K390-F392 HydrophobicContact CB-CZ 4.32Å; F392-R396 CarbonylContact C-O 3.59Å; F392-R396 VanDerWaalsContact CA-O 3.27Å; F392-R396 WeakPolarHBondContact CA-O 3.31Å; F392-Y397 WeakPolarHBondContact CD1-O 3.45Å
393	S	89.7	Confident	91.6	Very high	29 Å²	29	57 Å²	57	20%	0.203	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-147.5	177.2	-176.4	72.4	0	0	0	0	111.1	S395 R396	S393-S395 PolarHBondContact O-N 3.1Å; S393-S395 VanDerWaalsContact O-N 3.16Å; S393-S395 PolarHBondContact OG-N 3.34Å; S393-S395 PolarHBondContact OG-OG 2.97Å; S393-R396 PolarHBondContact N-O 3.03Å; S393-R396 CarbonylContact O-C 3.55Å; S393-R396 PolarHBondContact O-N 3.47Å; S393-R396 PolarHBondContact OG-N 2.78Å
394	K	85.3	Confident	91	Very high	138 Å²	138	56.1 Å²	56.1	60%	0.6	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-36.4	174.8	-71	-170.6	177.5	-165.7	0	113.6	L364 D365	L364-K394 WeakPolarHBondContact O-CE 3.34Å; L364-K394 WeakPolarHBondContact O-CG 3.28Å; D365-K394 VanDerWaalsContact CA-CE 3.43Å; D365-K394 WeakPolarHBondContact O-CE 3.28Å; D365-K394 IonicContact OD1-NZ 2.77Å; D365-K394 PolarHBondContact OD1-NZ 3.32Å
395	S	86	Confident	90.6	Very high	113 Å²	113	58.9 Å²	58.9	79%	0.79	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-12.9	179.7	56.1	0	0	0	0	113.8	S393	S393-S395 PolarHBondContact O-N 3.1Å; S393-S395 VanDerWaalsContact O-N 3.16Å; S393-S395 PolarHBondContact OG-N 3.34Å; S393-S395 PolarHBondContact OG-OG 2.97Å
396	R	88.2	Confident	90.1	Very high	148 Å²	148	63 Å²	63	56%	0.558	31%	0.313	S	S	*	.	B	Isolated β-bridge	trans	-138	85.7	-178.3	-175.1	-178.2	-74.2	179.3	-3.6	110.2	F392 S393	F392-R396 CarbonylContact C-O 3.59Å; F392-R396 VanDerWaalsContact CA-O 3.27Å; F392-R396 WeakPolarHBondContact CA-O 3.31Å; S393-R396 PolarHBondContact N-O 3.03Å; S393-R396 CarbonylContact O-C 3.55Å; S393-R396 PolarHBondContact O-N 3.47Å; S393-R396 PolarHBondContact OG-N 2.78Å
397	Y	88.4	Confident	89.7	Confident	143 Å²	143	62.6 Å²	62.6	56%	0.561	31%	0.311	S	S	*	.			trans	-91.7	-11.9	179.2	61.2	-86.5	0	0	0	113.3	V359 S360 F392	V359-Y397 CarbonylContact C-O 3.16Å; V359-Y397 WeakPolarHBondContact CA-O 3.32Å; V359-Y397 HydrophobicContact CG1-CD2 3.68Å; V359-Y397 HydrophobicContact CG1-CE2 4.15Å; S360-Y397 PolarHBondContact N-O 3.03Å; F392-Y397 WeakPolarHBondContact CD1-O 3.45Å
398	G	91.8	Very high	89.3	Confident	23 Å²	23	62.8 Å²	62.8	24%	0.237	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.3	177.6	0	0	0	0	0	113	L358	L358-G398 CarbonylContact O-C 3.54Å; L358-G398 WeakPolarHBondContact O-CA 3.25Å
399	S	93.5	Very high	88.9	Confident	18 Å²	18	62.5 Å²	62.5	13%	0.126	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	142.6	175.3	-151.1	0	0	0	0	113	M357 L358 K390	M357-S399 WeakPolarHBondContact CA-O 3.36Å; M357-S399 WeakPolarHBondContact CG-O 3.4Å; L358-S399 PolarHBondContact N-O 3.34Å; L358-S399 PolarHBondContact O-N 3.39Å; K390-S399 VanDerWaalsContact CD-OG 3.31Å; K390-S399 WeakPolarHBondContact CD-OG 3.31Å
400	D	93.1	Very high	88.5	Confident	35 Å²	35	62.1 Å²	62.1	19%	0.187	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	133	175.8	-166.8	-7.4	0	0	0	111.5	K355 C356 K390 E402	K355-D400 WeakPolarHBondContact CE-OD2 3.24Å; K355-D400 IonicContact NZ-OD2 3.46Å; C356-D400 VanDerWaalsContact O-OD1 3.11Å; K390-D400 WeakPolarHBondContact CE-O 3.38Å; K390-D400 PolarHBondContact NZ-O 2.8Å; D400-E402 VanDerWaalsContact C-N 3.3Å; D400-E402 PolarHBondContact OD1-N 3.45Å
401	L	93.7	Very high	88.2	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.319	C	S	.	.			trans	-89.5	5.2	178.3	-56.6	-170.1	0	0	0	113.2	L340 C356 L358 Y372 L374 I386 L403 L429	L340-L401 HydrophobicContact CD1-CD1 3.81Å; C356-L401 HydrophobicContact CB-CB 4.46Å; C356-L401 WeakPolarHBondContact O-CB 3.44Å; C356-L401 PolarHBondContact O-N 3.48Å; L358-L401 HydrophobicContact CB-CD1 4.15Å; L358-L401 HydrophobicContact CB-CD2 3.86Å; L358-L401 HydrophobicContact CB-CG 4.1Å; Y372-L401 HydrophobicContact CD1-CD2 3.93Å; Y372-L401 HydrophobicContact CD2-CB 4.35Å; Y372-L401 HydrophobicContact CD2-CD1 4.28Å; Y372-L401 HydrophobicContact CD2-CD2 3.93Å; Y372-L401 HydrophobicContact CD2-CG 4.42Å; Y372-L401 HydrophobicContact CE1-CD2 3.89Å; Y372-L401 HydrophobicContact CE2-CB 3.78Å; Y372-L401 HydrophobicContact CE2-CD2 3.9Å; Y372-L401 HydrophobicContact CE2-CG 4.27Å; Y372-L401 HydrophobicContact CG-CD2 3.95Å; Y372-L401 PolarHBondContact OH-O 2.84Å; L374-L401 HydrophobicContact CD2-CD1 4.19Å; I386-L401 WeakPolarHBondContact CD1-O 3.24Å; L401-L403 PolarHBondContact O-N 3.41Å; L401-L403 VanDerWaalsContact O-N 3.15Å; L401-L429 HydrophobicContact CD1-CD1 4.07Å
402	E	88.8	Confident	87.9	Confident	56 Å²	56	59.1 Å²	59.1	26%	0.262	30%	0.298	S	S	.	.			trans	61.5	24.2	167.3	-58.9	169.7	-158.1	0	0	114.5	I386 K390 D400 E404 K405	I386-E402 HydrophobicContact CD1-CB 3.97Å; I386-E402 WeakPolarHBondContact CD1-O 3.16Å; K390-E402 IonicContact NZ-OE1 2.96Å; K390-E402 PolarHBondContact NZ-OE1 3.04Å; D400-E402 VanDerWaalsContact C-N 3.3Å; D400-E402 PolarHBondContact OD1-N 3.45Å; E402-E404 VanDerWaalsContact C-CD 3.41Å; E402-E404 WeakPolarHBondContact CA-OE1 3.34Å; E402-E404 WeakPolarHBondContact CA-OE2 3.34Å; E402-E404 PolarHBondContact O-N 2.9Å; E402-E404 VanDerWaalsContact O-N 3.14Å; E402-K405 HydrophobicContact CB-CD 3.99Å; E402-K405 HydrophobicContact CB-CG 4.35Å; E402-K405 VanDerWaalsContact O-CB 3.32Å; E402-K405 WeakPolarHBondContact O-CB 3.47Å; E402-K405 WeakPolarHBondContact O-CG 3.44Å; E402-K405 PolarHBondContact O-N 3.18Å; E402-K405 WeakPolarHBondContact OE2-CE 3.27Å; E402-K405 IonicContact OE2-NZ 3.79Å; E402-K405 PolarHBondContact OE2-NZ 2.94Å
403	L	85.4	Confident	87.6	Confident	3 Å²	3	62 Å²	62	2%	0.016	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-59.3	-27.5	-174	-173.7	65	0	0	0	112.6	F354 C356 L374 I386 L401 K405 K406 V407	F354-L403 HydrophobicContact CD1-CD2 3.85Å; F354-L403 HydrophobicContact CD1-CG 4.39Å; F354-L403 HydrophobicContact CD2-CD2 4.42Å; F354-L403 HydrophobicContact CE1-CD2 3.45Å; F354-L403 VanDerWaalsContact CE1-CD2 3.45Å; F354-L403 HydrophobicContact CE1-CG 4.38Å; F354-L403 HydrophobicContact CE2-CD2 4.07Å; F354-L403 HydrophobicContact CG-CD2 4.34Å; F354-L403 HydrophobicContact CZ-CD2 3.57Å; C356-L403 HydrophobicContact CB-CB 4.13Å; C356-L403 HydrophobicContact CB-CD2 4.28Å; L374-L403 HydrophobicContact CD2-CB 4.43Å; L374-L403 HydrophobicContact CD2-CD1 4.16Å; L374-L403 HydrophobicContact CD2-CD2 3.96Å; L374-L403 HydrophobicContact CD2-CG 4.42Å; L374-L403 HydrophobicContact CG-CD1 4.45Å; I386-L403 HydrophobicContact CB-CD1 4.48Å; I386-L403 HydrophobicContact CG2-CD1 3.7Å; L401-L403 PolarHBondContact O-N 3.41Å; L401-L403 VanDerWaalsContact O-N 3.15Å; L403-K405 PolarHBondContact O-N 2.97Å; L403-K405 VanDerWaalsContact O-N 3.11Å; L403-K406 PolarHBondContact O-N 2.89Å; L403-V407 HydrophobicContact CD1-CG2 4.21Å; L403-V407 HydrophobicContact CG-CG2 4.32Å; L403-V407 PolarHBondContact O-N 3.43Å; L403-V407 VanDerWaalsContact O-N 3.09Å
404	E	82.3	Confident	87.5	Confident	42 Å²	42	65 Å²	65	20%	0.196	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-55.7	-25.6	174.5	70.9	-72.2	163.3	0	0	112.9	E353 F354 E402 K406	E353-E404 HydrophobicContact CB-CB 3.94Å; E353-E404 HydrophobicContact CB-CG 4.41Å; E353-E404 HydrophobicContact CG-CB 4.41Å; F354-E404 PolarHBondContact O-N 3.26Å; E402-E404 VanDerWaalsContact C-CD 3.41Å; E402-E404 WeakPolarHBondContact CA-OE1 3.34Å; E402-E404 WeakPolarHBondContact CA-OE2 3.34Å; E402-E404 PolarHBondContact O-N 2.9Å; E402-E404 VanDerWaalsContact O-N 3.14Å; E404-K406 PolarHBondContact O-N 2.89Å
405	K	84.4	Confident	87.3	Confident	139 Å²	139	65.7 Å²	65.7	60%	0.604	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-68.8	-15.2	174.7	-62.6	-176.6	-178.8	177.4	0	113.8	I386 E402 L403	I386-K405 HydrophobicContact CD1-CB 4.35Å; E402-K405 HydrophobicContact CB-CD 3.99Å; E402-K405 HydrophobicContact CB-CG 4.35Å; E402-K405 VanDerWaalsContact O-CB 3.32Å; E402-K405 WeakPolarHBondContact O-CB 3.47Å; E402-K405 WeakPolarHBondContact O-CG 3.44Å; E402-K405 PolarHBondContact O-N 3.18Å; E402-K405 WeakPolarHBondContact OE2-CE 3.27Å; E402-K405 IonicContact OE2-NZ 3.79Å; E402-K405 PolarHBondContact OE2-NZ 2.94Å; L403-K405 PolarHBondContact O-N 2.97Å; L403-K405 VanDerWaalsContact O-N 3.11Å
406	K	84.9	Confident	87.2	Confident	112 Å²	112	68.1 Å²	68.1	49%	0.487	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-18.2	-178.5	-70	-60.8	-172.2	-176.9	0	113.4	R384 I386 L403 E404	R384-K406 WeakPolarHBondContact CD-O 3.2Å; R384-K406 PolarHBondContact NH1-O 3.39Å; I386-K406 HydrophobicContact CB-CG 4.07Å; I386-K406 HydrophobicContact CD1-CG 4.25Å; I386-K406 HydrophobicContact CG1-CG 4.4Å; L403-K406 PolarHBondContact O-N 2.89Å; E404-K406 PolarHBondContact O-N 2.89Å
407	V	86.6	Confident	87.3	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	32%	0.315	C	S	.	.			trans	-141.9	114.7	-171.6	-172.5	0	0	0	0	109.1	F354 I376 L403 V412 L419	F354-V407 HydrophobicContact CD1-CB 3.97Å; F354-V407 HydrophobicContact CD1-CG1 3.69Å; F354-V407 HydrophobicContact CE1-CG1 4.24Å; I376-V407 HydrophobicContact CD1-CB 4.44Å; I376-V407 HydrophobicContact CD1-CG1 4.15Å; I376-V407 HydrophobicContact CD1-CG2 3.6Å; I376-V407 HydrophobicContact CG1-CG2 4.39Å; L403-V407 HydrophobicContact CD1-CG2 4.21Å; L403-V407 HydrophobicContact CG-CG2 4.32Å; L403-V407 PolarHBondContact O-N 3.43Å; L403-V407 VanDerWaalsContact O-N 3.09Å; V407-V412 HydrophobicContact CG1-CG2 3.45Å; V407-V412 VanDerWaalsContact CG1-CG2 3.45Å; V407-L419 HydrophobicContact CG1-CD1 3.61Å
408	A	87.3	Confident	87.4	Confident	53 Å²	53	58.2 Å²	58.2	44%	0.438	31%	0.312	S	S	.	.			trans	-83	144.7	172.7	0	0	0	0	0	110	D410 E411 V412	A408-D410 VanDerWaalsContact C-N 3.33Å; A408-D410 PolarHBondContact O-N 3.16Å; A408-E411 HydrophobicContact CB-CB 4.27Å; A408-E411 VanDerWaalsContact O-CB 3.29Å; A408-E411 WeakPolarHBondContact O-CB 3.41Å; A408-E411 PolarHBondContact O-N 3.39Å; A408-E411 VanDerWaalsContact O-N 3.11Å; A408-V412 PolarHBondContact O-N 2.83Å
409	V	84.7	Confident	87.4	Confident	14 Å²	14	57.2 Å²	57.2	9%	0.085	30%	0.302	C	S	.	.	H	α-helix	trans	-60.6	-43.9	178.2	173.2	0	0	0	0	111	E352 F354 E411 V412 L413	E352-V409 WeakPolarHBondContact O-CG2 3.37Å; F354-V409 HydrophobicContact CB-CG2 3.84Å; V409-E411 PolarHBondContact O-N 2.76Å; V409-E411 VanDerWaalsContact O-N 3.13Å; V409-V412 PolarHBondContact O-N 2.85Å; V409-L413 HydrophobicContact CG1-CD1 3.61Å; V409-L413 HydrophobicContact CG1-CG 4.05Å; V409-L413 WeakPolarHBondContact O-CG 3.43Å; V409-L413 PolarHBondContact O-N 2.92Å
410	D	86.6	Confident	87.4	Confident	132 Å²	132	58 Å²	58	71%	0.706	30%	0.304	S	S	*	.	H	α-helix	trans	-56	-31.8	177	-65.8	-22.4	0	0	0	112.5	A408 L413 M414	A408-D410 VanDerWaalsContact C-N 3.33Å; A408-D410 PolarHBondContact O-N 3.16Å; D410-L413 PolarHBondContact O-N 2.77Å; D410-M414 PolarHBondContact O-N 3.26Å; D410-M414 VanDerWaalsContact O-N 3.15Å
411	E	88	Confident	87.3	Confident	40 Å²	40	58.4 Å²	58.4	19%	0.187	31%	0.306	C	S	.	.	H	α-helix	trans	-72.5	-35.6	179	-162.8	-172.3	170	0	0	112.6	R384 A408 V409 L413 M414 S417 L419	R384-E411 IonicContact CZ-OE1 3.75Å; R384-E411 VanDerWaalsContact CZ-OE1 3.25Å; R384-E411 IonicContact CZ-OE2 3.85Å; R384-E411 IonicContact NH1-OE1 3.8Å; R384-E411 PolarHBondContact NH1-OE1 3.05Å; R384-E411 IonicContact NH1-OE2 3.8Å; R384-E411 PolarHBondContact NH1-OE2 3.13Å; R384-E411 IonicContact NH2-OE1 3.62Å; R384-E411 PolarHBondContact NH2-OE1 3.26Å; R384-E411 IonicContact NH2-OE2 2.64Å; R384-E411 PolarHBondContact NH2-OE2 3.38Å; A408-E411 HydrophobicContact CB-CB 4.27Å; A408-E411 VanDerWaalsContact O-CB 3.29Å; A408-E411 WeakPolarHBondContact O-CB 3.41Å; A408-E411 PolarHBondContact O-N 3.39Å; A408-E411 VanDerWaalsContact O-N 3.11Å; V409-E411 PolarHBondContact O-N 2.76Å; V409-E411 VanDerWaalsContact O-N 3.13Å; E411-L413 VanDerWaalsContact C-N 3.34Å; E411-M414 HydrophobicContact CB-CE 4.09Å; E411-M414 HydrophobicContact CG-CE 3.45Å; E411-M414 VanDerWaalsContact CG-CE 3.45Å; E411-M414 WeakPolarHBondContact O-CE 3.37Å; E411-M414 WeakPolarHBondContact O-CG 3.45Å; E411-S417 VanDerWaalsContact O-CB 3.32Å; E411-S417 WeakPolarHBondContact O-CB 3.12Å; E411-S417 PolarHBondContact O-OG 3.13Å; E411-L419 HydrophobicContact CG-CD1 4.38Å
412	V	85.3	Confident	87	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-74.2	-32.3	176.2	-171.5	0	0	0	0	110.6	F311 F354 V407 A408 V409 S417 L419 L420 M425	F311-V412 HydrophobicContact CD1-CG1 4.12Å; F311-V412 HydrophobicContact CE1-CB 4.39Å; F311-V412 HydrophobicContact CE1-CG1 3.32Å; F311-V412 HydrophobicContact CE2-CG1 4.15Å; F311-V412 HydrophobicContact CZ-CB 4.42Å; F311-V412 HydrophobicContact CZ-CG1 3.32Å; F354-V412 HydrophobicContact CD1-CG2 4.36Å; V407-V412 HydrophobicContact CG1-CG2 3.45Å; V407-V412 VanDerWaalsContact CG1-CG2 3.45Å; A408-V412 PolarHBondContact O-N 2.83Å; V409-V412 PolarHBondContact O-N 2.85Å; V412-S417 WeakPolarHBondContact O-CB 3.33Å; V412-L419 HydrophobicContact CG2-CD1 4Å; V412-L420 HydrophobicContact CG1-CD1 4.36Å; V412-L420 HydrophobicContact CG1-CD2 4.1Å; V412-L420 HydrophobicContact CG1-CG 4.33Å; V412-L420 WeakPolarHBondContact O-CD1 3.25Å; V412-M425 HydrophobicContact CB-CE 4.35Å; V412-M425 HydrophobicContact CG1-CE 3.35Å; V412-M425 HydrophobicContact CG2-CE 3.96Å
413	L	85.2	Confident	87.2	Confident	62 Å²	62	64.9 Å²	64.9	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-83	-10.1	-177.6	-67.1	-179.1	0	0	0	114.7	F311 K345 V409 D410 E411	F311-L413 HydrophobicContact CE1-CD2 4.42Å; K345-L413 HydrophobicContact CD-CD2 3.9Å; K345-L413 HydrophobicContact CG-CD2 4.03Å; V409-L413 HydrophobicContact CG1-CD1 3.61Å; V409-L413 HydrophobicContact CG1-CG 4.05Å; V409-L413 WeakPolarHBondContact O-CG 3.43Å; V409-L413 PolarHBondContact O-N 2.92Å; D410-L413 PolarHBondContact O-N 2.77Å; E411-L413 VanDerWaalsContact C-N 3.34Å
414	M	87.4	Confident	87.7	Confident	90 Å²	90	66.2 Å²	66.2	44%	0.443	35%	0.35	S	S	.	.	S	Bend	trans	-64.8	148.7	178.8	79	175.4	67.8	0	0	111.9	D410 E411 N416 S417	D410-M414 PolarHBondContact O-N 3.26Å; D410-M414 VanDerWaalsContact O-N 3.15Å; E411-M414 HydrophobicContact CB-CE 4.09Å; E411-M414 HydrophobicContact CG-CE 3.45Å; E411-M414 VanDerWaalsContact CG-CE 3.45Å; E411-M414 WeakPolarHBondContact O-CE 3.37Å; E411-M414 WeakPolarHBondContact O-CG 3.45Å; M414-N416 PolarHBondContact O-N 3.25Å; M414-S417 PolarHBondContact O-N 2.99Å; M414-S417 VanDerWaalsContact O-N 3.11Å
415	D	82.1	Confident	88.3	Confident	154 Å²	154	64.2 Å²	64.2	82%	0.824	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	127.4	171.3	-66.4	-30.1	0	0	0	110	S417	D415-S417 VanDerWaalsContact C-N 3.34Å; D415-S417 PolarHBondContact O-N 3.35Å
416	N	84.6	Confident	88.9	Confident	164 Å²	164	57.9 Å²	57.9	88%	0.877	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	38.9	-176	-56.4	-45.2	0	0	0	114.4	M414	M414-N416 PolarHBondContact O-N 3.25Å
417	S	90.1	Very high	89.4	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.042	29%	0.291	C	S	.	.			trans	-47.8	128.9	173.4	-176.5	0	0	0	0	111.7	E411 V412 M414 D415 L419 L420	E411-S417 VanDerWaalsContact O-CB 3.32Å; E411-S417 WeakPolarHBondContact O-CB 3.12Å; E411-S417 PolarHBondContact O-OG 3.13Å; V412-S417 WeakPolarHBondContact O-CB 3.33Å; M414-S417 PolarHBondContact O-N 2.99Å; M414-S417 VanDerWaalsContact O-N 3.11Å; D415-S417 VanDerWaalsContact C-N 3.34Å; D415-S417 PolarHBondContact O-N 3.35Å; S417-L419 PolarHBondContact O-N 3.3Å; S417-L419 VanDerWaalsContact O-N 3.08Å; S417-L419 PolarHBondContact OG-N 3.44Å; S417-L420 PolarHBondContact O-N 3.4Å; S417-L420 VanDerWaalsContact O-N 3.11Å
418	P	89.6	Confident	89.9	Confident	76 Å²	76	53 Å²	53	49%	0.494	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.3	179.2	29.9	-36.2	0	0	0	112.9	L383	L383-P418 WeakPolarHBondContact CD1-O 3.42Å
419	L	92	Very high	90.3	Very high	3 Å²	3	50.6 Å²	50.6	2%	0.016	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-9.1	177.9	-58.1	178.1	0	0	0	112.7	I376 L383 V407 E411 V412 S417	I376-L419 HydrophobicContact CG2-CB 4.3Å; I376-L419 HydrophobicContact CG2-CD2 4.19Å; L383-L419 HydrophobicContact CB-CD2 4.42Å; L383-L419 HydrophobicContact CD1-CD2 4.03Å; V407-L419 HydrophobicContact CG1-CD1 3.61Å; E411-L419 HydrophobicContact CG-CD1 4.38Å; V412-L419 HydrophobicContact CG2-CD1 4Å; S417-L419 PolarHBondContact O-N 3.3Å; S417-L419 VanDerWaalsContact O-N 3.08Å; S417-L419 PolarHBondContact OG-N 3.44Å
420	L	92.9	Very high	90.8	Very high	33 Å²	33	50.2 Å²	50.2	17%	0.173	27%	0.27	C	S	.	.			trans	-114	143.1	178	-58.1	179.7	0	0	0	110.1	F311 V412 S417 T424 M425	F311-L420 HydrophobicContact CB-CD1 4.4Å; F311-L420 HydrophobicContact CB-CD2 4.18Å; F311-L420 HydrophobicContact CD1-CD1 3.99Å; F311-L420 HydrophobicContact CD1-CD2 4.19Å; F311-L420 HydrophobicContact CD2-CD2 4.11Å; F311-L420 HydrophobicContact CG-CD1 4.31Å; F311-L420 HydrophobicContact CG-CD2 3.89Å; V412-L420 HydrophobicContact CG1-CD1 4.36Å; V412-L420 HydrophobicContact CG1-CD2 4.1Å; V412-L420 HydrophobicContact CG1-CG 4.33Å; V412-L420 WeakPolarHBondContact O-CD1 3.25Å; S417-L420 PolarHBondContact O-N 3.4Å; S417-L420 VanDerWaalsContact O-N 3.11Å; L420-T424 CarbonylContact C-O 3.56Å; L420-T424 WeakPolarHBondContact CA-O 3.37Å; L420-M425 HydrophobicContact CD2-CB 3.61Å; L420-M425 HydrophobicContact CD2-CE 4.08Å; L420-M425 HydrophobicContact CD2-CG 4.39Å
421	I	90.9	Very high	91.2	Very high	44 Å²	44	44 Å²	44	23%	0.226	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-115.3	114.9	170.2	-41.8	170.7	0	0	0	107	N378 D379 D423 T424 V426	N378-I421 VanDerWaalsContact CA-CD1 3.45Å; N378-I421 HydrophobicContact CB-CD1 3.85Å; N378-I421 HydrophobicContact CB-CG1 3.83Å; D379-I421 HydrophobicContact CB-CD1 4.16Å; D379-I421 VanDerWaalsContact N-CD1 3.3Å; I421-D423 VanDerWaalsContact C-N 3.3Å; I421-D423 PolarHBondContact O-N 2.8Å; I421-T424 PolarHBondContact N-O 3.01Å; I421-T424 WeakPolarHBondContact O-CA 3.41Å; I421-T424 WeakPolarHBondContact O-CB 3.39Å; I421-T424 PolarHBondContact O-N 3.46Å; I421-V426 HydrophobicContact CD1-CG2 4.35Å
422	N	88.8	Confident	91.2	Very high	146 Å²	146	46.5 Å²	46.5	78%	0.781	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	53.1	179.2	-56.8	-22.2	0	0	0	112.2	T424	N422-T424 PolarHBondContact O-N 3.21Å; N422-T424 VanDerWaalsContact O-N 3.15Å; N422-T424 PolarHBondContact O-OG1 2.85Å
423	D	92.7	Very high	91.3	Very high	46 Å²	46	48.2 Å²	48.2	25%	0.246	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	22.3	-176	-159.8	35.3	0	0	0	115.3	D310 F311 S312 I421	D310-D423 VanDerWaalsContact C-OD2 3.25Å; D310-D423 WeakPolarHBondContact CA-OD2 3.36Å; D310-D423 PolarHBondContact N-O 2.87Å; F311-D423 VanDerWaalsContact CB-O 3.26Å; F311-D423 WeakPolarHBondContact CB-O 3.3Å; F311-D423 PolarHBondContact N-O 3.48Å; F311-D423 PolarHBondContact N-OD2 3.36Å; S312-D423 VanDerWaalsContact CB-OD1 3.24Å; S312-D423 WeakPolarHBondContact CB-OD1 3.48Å; S312-D423 VanDerWaalsContact CB-OD2 3.28Å; S312-D423 WeakPolarHBondContact CB-OD2 3.45Å; S312-D423 VanDerWaalsContact N-CG 3.33Å; S312-D423 PolarHBondContact N-OD1 2.97Å; S312-D423 PolarHBondContact N-OD2 3.01Å; S312-D423 VanDerWaalsContact N-OD2 3.11Å; S312-D423 VanDerWaalsContact OG-CG 3.32Å; S312-D423 PolarHBondContact OG-OD1 3.24Å; S312-D423 PolarHBondContact OG-OD2 3.26Å; I421-D423 VanDerWaalsContact C-N 3.3Å; I421-D423 PolarHBondContact O-N 2.8Å
424	T	94.6	Very high	91.3	Very high	31 Å²	31	48.1 Å²	48.1	19%	0.19	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-119.5	127	179.8	-58.3	0	0	0	0	111	V307 I308 L420 I421 N422 V426	V307-T424 HydrophobicContact CG1-CG2 3.4Å; V307-T424 VanDerWaalsContact CG1-CG2 3.4Å; I308-T424 CarbonylContact O-C 3.54Å; I308-T424 WeakPolarHBondContact O-CA 3.47Å; L420-T424 CarbonylContact C-O 3.56Å; L420-T424 WeakPolarHBondContact CA-O 3.37Å; I421-T424 PolarHBondContact N-O 3.01Å; I421-T424 WeakPolarHBondContact O-CA 3.41Å; I421-T424 WeakPolarHBondContact O-CB 3.39Å; I421-T424 PolarHBondContact O-N 3.46Å; N422-T424 PolarHBondContact O-N 3.21Å; N422-T424 VanDerWaalsContact O-N 3.15Å; N422-T424 PolarHBondContact O-OG1 2.85Å; T424-V426 HydrophobicContact CG2-CG2 4.24Å
425	M	95.1	Very high	90.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	132.5	169.4	-176.9	177	-78.2	0	0	110.1	I308 F311 F354 I376 V412 L420 L427	I308-M425 HydrophobicContact CB-CB 4.28Å; I308-M425 HydrophobicContact CD1-SD 4.47Å; I308-M425 PolarHBondContact N-O 2.84Å; I308-M425 PolarHBondContact O-N 2.79Å; F311-M425 HydrophobicContact CD2-CB 3.84Å; F311-M425 HydrophobicContact CD2-CE 4.49Å; F311-M425 HydrophobicContact CE2-CB 4.14Å; F311-M425 HydrophobicContact CE2-CE 3.76Å; F311-M425 HydrophobicContact CE2-SD 4.01Å; F311-M425 HydrophobicContact CZ-CE 4.01Å; F354-M425 HydrophobicContact CE1-CE 3.83Å; F354-M425 HydrophobicContact CE1-SD 3.8Å; F354-M425 HydrophobicContact CZ-CE 4.19Å; F354-M425 HydrophobicContact CZ-SD 3.63Å; I376-M425 HydrophobicContact CD1-CE 4.36Å; I376-M425 HydrophobicContact CD1-SD 4.48Å; V412-M425 HydrophobicContact CB-CE 4.35Å; V412-M425 HydrophobicContact CG1-CE 3.35Å; V412-M425 HydrophobicContact CG2-CE 3.96Å; L420-M425 HydrophobicContact CD2-CB 3.61Å; L420-M425 HydrophobicContact CD2-CE 4.08Å; L420-M425 HydrophobicContact CD2-CG 4.39Å; M425-L427 HydrophobicContact CG-CD2 4.19Å; M425-L427 HydrophobicContact CG-CG 4.27Å; M425-L427 HydrophobicContact SD-CD1 4.45Å; M425-L427 HydrophobicContact SD-CD2 4.08Å; M425-L427 HydrophobicContact SD-CG 4.36Å
426	V	96.9	Very high	90.8	Very high	6 Å²	6	50.2 Å²	50.2	4%	0.036	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.1	176.6	-172.4	0	0	0	0	110.1	R305 F306 V377 I421 T424	R305-V426 HydrophobicContact CG-CG1 4.21Å; F306-V426 WeakPolarHBondContact O-CA 3.46Å; V377-V426 HydrophobicContact CG2-CB 3.75Å; V377-V426 HydrophobicContact CG2-CG1 3.45Å; V377-V426 VanDerWaalsContact CG2-CG1 3.45Å; V377-V426 PolarHBondContact N-O 3.44Å; I421-V426 HydrophobicContact CD1-CG2 4.35Å; T424-V426 HydrophobicContact CG2-CG2 4.24Å
427	L	96.6	Very high	91.1	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.9	-179.4	-57.9	173.3	0	0	0	111.1	R305 F306 I308 L342 L374 S375 I376 M425	R305-L427 CarbonylContact C-O 3.56Å; R305-L427 WeakPolarHBondContact CA-O 3.33Å; F306-L427 HydrophobicContact CB-CB 4.29Å; F306-L427 HydrophobicContact CD2-CB 4.33Å; F306-L427 PolarHBondContact N-O 3.45Å; F306-L427 PolarHBondContact O-N 2.94Å; I308-L427 HydrophobicContact CD1-CD1 4.23Å; L342-L427 HydrophobicContact CD2-CD1 3.21Å; L374-L427 HydrophobicContact CD1-CB 4.31Å; S375-L427 CarbonylContact O-C 3.5Å; S375-L427 VanDerWaalsContact O-CA 3.28Å; S375-L427 WeakPolarHBondContact O-CA 3.28Å; I376-L427 HydrophobicContact CB-CD2 4.26Å; I376-L427 HydrophobicContact CD1-CD2 4.17Å; I376-L427 HydrophobicContact CG1-CD2 3.61Å; M425-L427 HydrophobicContact CG-CD2 4.19Å; M425-L427 HydrophobicContact CG-CG 4.27Å; M425-L427 HydrophobicContact SD-CD1 4.45Å; M425-L427 HydrophobicContact SD-CD2 4.08Å; M425-L427 HydrophobicContact SD-CG 4.36Å
428	Q	96.8	Very high	91.1	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.056	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	120.3	172.1	-65	178.1	-155.9	0	0	109.2	F292 L293 L294 K304 L374 S375 V377	F292-Q428 PolarHBondContact O-NE2 3.02Å; L293-Q428 VanDerWaalsContact CA-OE1 3.25Å; L294-Q428 HydrophobicContact CB-CG 4.14Å; L294-Q428 HydrophobicContact CD1-CB 3.85Å; L294-Q428 HydrophobicContact CD1-CG 3.83Å; L294-Q428 HydrophobicContact CG-CB 4.45Å; L294-Q428 HydrophobicContact CG-CG 4.04Å; L294-Q428 VanDerWaalsContact N-CD 3.3Å; K304-Q428 WeakPolarHBondContact O-CA 3.22Å; L374-Q428 WeakPolarHBondContact CA-O 2.92Å; S375-Q428 PolarHBondContact N-O 3.5Å; S375-Q428 PolarHBondContact O-N 3.16Å; V377-Q428 HydrophobicContact CG1-CG 4.05Å; V377-Q428 HydrophobicContact CG2-CG 4.24Å
429	L	96.2	Very high	91.2	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.7	174.2	-176	64.6	0	0	0	109.4	D303 K304 F306 L340 L358 M373 L374 L401 L431	D303-L429 CarbonylContact C-O 3.57Å; D303-L429 WeakPolarHBondContact CA-O 3.09Å; D303-L429 WeakPolarHBondContact CB-O 3.07Å; K304-L429 PolarHBondContact N-O 3.5Å; K304-L429 PolarHBondContact O-N 3.45Å; F306-L429 HydrophobicContact CE2-CB 3.65Å; F306-L429 HydrophobicContact CE2-CD2 4.44Å; F306-L429 HydrophobicContact CZ-CB 4.45Å; L340-L429 HydrophobicContact CD1-CD2 4.08Å; L340-L429 HydrophobicContact CD2-CD2 4.37Å; L358-L429 HydrophobicContact CD1-CD2 4.23Å; M373-L429 CarbonylContact O-C 3.57Å; M373-L429 WeakPolarHBondContact O-CA 3.28Å; L374-L429 HydrophobicContact CB-CD1 4.06Å; L374-L429 HydrophobicContact CD1-CB 4.28Å; L374-L429 HydrophobicContact CD1-CD1 4.19Å; L401-L429 HydrophobicContact CD1-CD1 4.07Å; L429-L431 HydrophobicContact CD1-CD2 3.74Å; L429-L431 HydrophobicContact CD2-CD1 4.15Å; L429-L431 HydrophobicContact CD2-CD2 3.93Å; L429-L431 HydrophobicContact CD2-CG 3.99Å; L429-L431 HydrophobicContact CG-CD2 3.77Å; L429-L431 HydrophobicContact CG-CG 3.99Å
430	T	95.2	Very high	91.2	Very high	5 Å²	5	47.2 Å²	47.2	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.8	167.4	-64.8	0	0	0	0	108.8	L278 W302 Y372 M373 R432	L278-T430 HydrophobicContact CD1-CG2 3.9Å; L278-T430 HydrophobicContact CD2-CG2 3.69Å; L278-T430 HydrophobicContact CG-CG2 4.47Å; W302-T430 CarbonylContact O-C 3.54Å; W302-T430 WeakPolarHBondContact O-CA 3.21Å; Y372-T430 CarbonylContact C-O 3.58Å; Y372-T430 VanDerWaalsContact CA-O 3.25Å; Y372-T430 WeakPolarHBondContact CA-O 3.12Å; M373-T430 PolarHBondContact N-O 2.9Å; M373-T430 PolarHBondContact O-N 2.85Å; T430-R432 HydrophobicContact CG2-CG 4.36Å
431	L	93.4	Very high	91.1	Very high	3 Å²	3	48.1 Å²	48.1	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	118.9	176	-55.5	-174.6	0	0	0	109.4	W302 T326 W338 L358 I370 L429	W302-L431 VanDerWaalsContact CB-O 3.24Å; W302-L431 WeakPolarHBondContact CB-O 3.32Å; W302-L431 PolarHBondContact O-N 2.78Å; T326-L431 HydrophobicContact CG2-CB 4.27Å; T326-L431 HydrophobicContact CG2-CD1 3.99Å; T326-L431 HydrophobicContact CG2-CG 4.35Å; W338-L431 HydrophobicContact CD2-CD1 4.13Å; W338-L431 HydrophobicContact CG-CD1 4.01Å; L358-L431 HydrophobicContact CD1-CD1 4.24Å; L358-L431 HydrophobicContact CD2-CD1 3.82Å; L358-L431 HydrophobicContact CD2-CD2 3.86Å; I370-L431 HydrophobicContact CD1-CD1 4.44Å; I370-L431 HydrophobicContact CD1-CD2 4Å; L429-L431 HydrophobicContact CD1-CD2 3.74Å; L429-L431 HydrophobicContact CD2-CD1 4.15Å; L429-L431 HydrophobicContact CD2-CD2 3.93Å; L429-L431 HydrophobicContact CD2-CG 3.99Å; L429-L431 HydrophobicContact CG-CD2 3.77Å; L429-L431 HydrophobicContact CG-CG 3.99Å
432	R	89.6	Confident	91.1	Very high	91 Å²	91	48.4 Å²	48.4	34%	0.343	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.7	172.6	-68.7	-173.7	77.9	169.4	4.4	109.7	R274 L278 I370 E371 T430 I434	R274-R432 PolarHBondContact O-NH1 3.1Å; L278-R432 HydrophobicContact CD1-CB 4.41Å; L278-R432 HydrophobicContact CD1-CG 4.16Å; L278-R432 HydrophobicContact CD2-CG 4.32Å; L278-R432 HydrophobicContact CG-CG 4.33Å; I370-R432 CarbonylContact C-O 3.16Å; I370-R432 VanDerWaalsContact CA-O 3.28Å; I370-R432 WeakPolarHBondContact CA-O 3.28Å; E371-R432 PolarHBondContact N-O 2.99Å; E371-R432 PolarHBondContact O-N 3.48Å; T430-R432 HydrophobicContact CG2-CG 4.36Å; R432-I434 PolarHBondContact O-N 2.96Å
433	P	87.4	Confident	91.3	Very high	38 Å²	38	40.9 Å²	40.9	25%	0.247	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	137.5	166.2	-22.9	33.3	0	0	0	110.8	W336	W336-P433 HydrophobicContact CE3-CG 4.37Å; W336-P433 HydrophobicContact CH2-CB 3.93Å; W336-P433 HydrophobicContact CH2-CG 4.03Å; W336-P433 HydrophobicContact CZ3-CB 3.97Å; W336-P433 HydrophobicContact CZ3-CG 3.75Å
434	I	84.2	Confident	91.1	Very high	60 Å²	60	40.5 Å²	40.5	31%	0.308	20%	0.196	S	C	.	.			trans	-98.5	120	168.5	-59.4	168.9	0	0	0	105.8	A369 I370 E371 K389 R432	A369-I434 HydrophobicContact CB-CB 4.02Å; A369-I434 PolarHBondContact O-N 2.97Å; I370-I434 WeakPolarHBondContact O-CD1 3.4Å; E371-I434 HydrophobicContact CB-CD1 4.03Å; E371-I434 HydrophobicContact CB-CG1 3.96Å; K389-I434 HydrophobicContact CB-CD1 3.99Å; K389-I434 HydrophobicContact CD-CD1 3.76Å; K389-I434 HydrophobicContact CG-CD1 3.78Å; R432-I434 PolarHBondContact O-N 2.96Å
435	E	67.6	Low	90.8	Very high	238 Å²	238	41.4 Å²	41.4	100%	1.112	20%	0.196	S	C	*	.			trans	-69.9	0	171.5	-69.9	-179.1	178.1	0	0	112.2

Retrieved 435 of 435 residues in 164.6 ms (Link to these results)

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