A0A087XP73_POEFO Loading...

Autoimmune regulator

AlphaFold DB , UniProt , Accession A0A087XP73, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 497 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	52.7	Low	220 Å²	220	96.5 Å²	96.5	100%	1.084	50%	0.497	S	S	*	.				0	138.9	0	-73.7	155.9	154.9	0	0	108.1
2	S	39.5	Very low	55.7	Low	74 Å²	74	89 Å²	89	52%	0.517	46%	0.458	S	S	.	.			trans	-81.9	155.9	-179.5	71.4	0	0	0	0	111.2	V4 E5	S2-V4 PolarHBondContact O-N 3.34Å; S2-E5 PolarHBondContact O-N 3.38Å
3	R	48.7	Very low	58.4	Low	97 Å²	97	87.9 Å²	87.9	37%	0.366	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-7	-178.5	-157	162.8	179.4	166.2	2.5	114.2	S87 D89 M92	R3-S87 VanDerWaalsContact CD-O 3.31Å; R3-S87 WeakPolarHBondContact CD-O 3.41Å; R3-D89 IonicContact CZ-OD1 3.81Å; R3-D89 IonicContact NH1-OD1 3.56Å; R3-D89 PolarHBondContact NH1-OD1 3.16Å; R3-M92 VanDerWaalsContact CZ-CG 3.43Å; R3-M92 PolarHBondContact NH2-SD 3.39Å
4	V	44	Very low	60.6	Low	64 Å²	64	86 Å²	86	39%	0.388	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-20.2	-177.3	-173	0	0	0	0	112.8	S2 V6	S2-V4 PolarHBondContact O-N 3.34Å; V4-V6 VanDerWaalsContact C-N 3.25Å; V4-V6 PolarHBondContact O-N 2.92Å
5	E	47.5	Very low	62.6	Low	66 Å²	66	81.9 Å²	81.9	31%	0.308	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-70.8	-21.7	-174.8	-51.8	-152.6	133	0	0	113.6	S2 F7 R8	S2-E5 PolarHBondContact O-N 3.38Å; E5-F7 PolarHBondContact O-N 3.25Å; E5-F7 VanDerWaalsContact O-N 3.11Å; E5-R8 WeakPolarHBondContact O-CG 3.42Å; E5-R8 PolarHBondContact O-N 3.35Å; E5-R8 IonicContact OE1-CZ 3.39Å; E5-R8 IonicContact OE1-NH1 2.95Å; E5-R8 PolarHBondContact OE1-NH1 3.11Å; E5-R8 IonicContact OE1-NH2 2.86Å; E5-R8 PolarHBondContact OE1-NH2 3.49Å; E5-R8 IonicContact OE2-NH1 2.72Å
6	V	53.9	Low	64.4	Low	70 Å²	70	76.8 Å²	76.8	42%	0.424	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-49.2	-36.4	-179	166.9	0	0	0	0	114.3	V4 N106	V4-V6 VanDerWaalsContact C-N 3.25Å; V4-V6 PolarHBondContact O-N 2.92Å; V6-N106 WeakPolarHBondContact CG1-OD1 3.41Å
7	F	58.9	Low	66.1	Low	19 Å²	19	80.5 Å²	80.5	8%	0.083	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-100.1	8.5	-168.6	-55.5	-72.8	0	0	0	114.7	E5 D9 L12 L15 W83 L102	E5-F7 PolarHBondContact O-N 3.25Å; E5-F7 VanDerWaalsContact O-N 3.11Å; F7-D9 PolarHBondContact O-N 3.25Å; F7-L12 HydrophobicContact CB-CD2 3.68Å; F7-L12 WeakPolarHBondContact O-CD2 3.5Å; F7-L15 HydrophobicContact CD1-CD2 3.63Å; F7-L15 HydrophobicContact CE1-CD2 3.87Å; F7-W83 HydrophobicContact CD1-CE3 4.47Å; F7-W83 HydrophobicContact CD2-CB 4.32Å; F7-W83 HydrophobicContact CE1-CD2 4.49Å; F7-W83 AromaticContact CE1-CE3 3.91Å; F7-W83 HydrophobicContact CE1-CE3 3.91Å; F7-W83 HydrophobicContact CE1-CZ3 4.09Å; F7-W83 HydrophobicContact CE2-CE3 4.31Å; F7-W83 AromaticContact CZ-CE3 3.81Å; F7-W83 HydrophobicContact CZ-CE3 3.81Å; F7-W83 HydrophobicContact CZ-CZ3 4.21Å; F7-L102 HydrophobicContact CE1-CD2 4.48Å; F7-L102 HydrophobicContact CZ-CD2 4.21Å
8	R	53.9	Low	67.5	Low	148 Å²	148	82.7 Å²	82.7	56%	0.558	41%	0.413	S	S	*	.	S	Bend	trans	-62.1	-45.6	-166.8	-79.1	-178.2	174	158	7	114.5	E5	E5-R8 WeakPolarHBondContact O-CG 3.42Å; E5-R8 PolarHBondContact O-N 3.35Å; E5-R8 IonicContact OE1-CZ 3.39Å; E5-R8 IonicContact OE1-NH1 2.95Å; E5-R8 PolarHBondContact OE1-NH1 3.11Å; E5-R8 IonicContact OE1-NH2 2.86Å; E5-R8 PolarHBondContact OE1-NH2 3.49Å; E5-R8 IonicContact OE2-NH1 2.72Å
9	D	51.6	Low	68.9	Low	169 Å²	169	79 Å²	79	90%	0.904	39%	0.394	S	S	*	.	S	Bend	trans	-91.4	-13.3	-174.9	-63.9	-76.6	0	0	0	114.2	F7	F7-D9 PolarHBondContact O-N 3.25Å
10	A	63.7	Low	70.2	Confident	39 Å²	39	78.3 Å²	78.3	32%	0.322	39%	0.387	S	S	.	.	S	Bend	trans	-75.9	147.8	179.8	0	0	0	0	0	112.4	L12 L15	A10-L12 PolarHBondContact O-N 3.32Å; A10-L15 HydrophobicContact CB-CD2 4.48Å
11	N	83.6	Confident	71.4	Confident	95 Å²	95	78 Å²	78	51%	0.508	39%	0.39	S	S	.	.			trans	-73.6	94	164.7	-174.9	-13.5	0	0	0	109.1	R13 S14 L15	N11-R13 PolarHBondContact O-N 3.34Å; N11-R13 PolarHBondContact OD1-N 3.08Å; N11-S14 PolarHBondContact ND2-OG 3.04Å; N11-S14 WeakPolarHBondContact O-CA 3.49Å; N11-S14 WeakPolarHBondContact O-CB 3.44Å; N11-S14 PolarHBondContact O-N 3.1Å; N11-L15 PolarHBondContact O-N 3.29Å
12	L	87.9	Confident	74.2	Confident	7 Å²	7	71.6 Å²	71.6	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-45.3	-32.5	-178.6	-58.8	-178.2	0	0	0	114.4	F7 A10 L16 R76 L79 Q80 W83	F7-L12 HydrophobicContact CB-CD2 3.68Å; F7-L12 WeakPolarHBondContact O-CD2 3.5Å; A10-L12 PolarHBondContact O-N 3.32Å; L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 3.12Å; L12-L16 VanDerWaalsContact O-N 3.14Å; L12-R76 HydrophobicContact CD1-CG 4.5Å; L12-L79 HydrophobicContact CB-CB 4.45Å; L12-Q80 HydrophobicContact CD1-CB 3.82Å; L12-Q80 HydrophobicContact CD1-CG 4.41Å; L12-W83 HydrophobicContact CD2-CG 4.45Å; L12-W83 PolarHBondContact O-NE1 3.43Å; L12-W83 VanDerWaalsContact O-NE1 3.15Å
13	R	90.5	Very high	76.9	Confident	75 Å²	75	68.1 Å²	68.1	28%	0.283	34%	0.335	S	S	.	.	H	α-helix	trans	-79.3	-37.3	178.2	-174.3	179.3	-76.7	143.1	-13.3	112.5	N11 R17 I72 Q74 L79	N11-R13 PolarHBondContact O-N 3.34Å; N11-R13 PolarHBondContact OD1-N 3.08Å; R13-R17 VanDerWaalsContact O-CG 3.27Å; R13-R17 WeakPolarHBondContact O-CG 3.44Å; R13-R17 PolarHBondContact O-N 3.43Å; R13-I72 VanDerWaalsContact CD-O 3.27Å; R13-I72 WeakPolarHBondContact CD-O 3.39Å; R13-I72 HydrophobicContact CG-CG2 4.11Å; R13-I72 WeakPolarHBondContact CG-O 3.48Å; R13-I72 PolarHBondContact NE-O 3.3Å; R13-Q74 PolarHBondContact NH2-O 2.87Å; R13-L79 HydrophobicContact CB-CD1 3.84Å; R13-L79 HydrophobicContact CG-CD1 4.3Å
14	S	90.1	Very high	79.1	Confident	61 Å²	61	63.6 Å²	63.6	43%	0.427	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-45.8	173.4	-60.8	0	0	0	0	110.7	N11 L16 R17 E18	N11-S14 PolarHBondContact ND2-OG 3.04Å; N11-S14 WeakPolarHBondContact O-CA 3.49Å; N11-S14 WeakPolarHBondContact O-CB 3.44Å; N11-S14 PolarHBondContact O-N 3.1Å; S14-L16 VanDerWaalsContact C-N 3.29Å; S14-L16 PolarHBondContact O-N 3.45Å; S14-R17 WeakPolarHBondContact O-CB 3.4Å; S14-R17 PolarHBondContact O-N 3.26Å; S14-R17 VanDerWaalsContact O-N 3.08Å; S14-E18 PolarHBondContact O-N 2.79Å
15	L	90.4	Very high	81.6	Confident	25 Å²	25	65.1 Å²	65.1	13%	0.131	32%	0.323	C	S	.	.	H	α-helix	trans	-60.1	-40	176.9	-171.8	64.5	0	0	0	111.6	F7 A10 N11 E18 L19 W83 L105	F7-L15 HydrophobicContact CD1-CD2 3.63Å; F7-L15 HydrophobicContact CE1-CD2 3.87Å; A10-L15 HydrophobicContact CB-CD2 4.48Å; N11-L15 PolarHBondContact O-N 3.29Å; L15-E18 PolarHBondContact O-N 3.39Å; L15-L19 HydrophobicContact CD1-CD1 3.63Å; L15-L19 HydrophobicContact CD1-CG 4.35Å; L15-L19 HydrophobicContact CG-CD1 3.81Å; L15-L19 WeakPolarHBondContact O-CB 3.26Å; L15-L19 WeakPolarHBondContact O-CG 3.23Å; L15-L19 PolarHBondContact O-N 3.19Å; L15-W83 HydrophobicContact CB-CZ2 4.24Å; L15-W83 HydrophobicContact CD2-CH2 4.2Å; L15-W83 HydrophobicContact CD2-CZ2 4.11Å; L15-W83 HydrophobicContact CG-CH2 4.12Å; L15-W83 HydrophobicContact CG-CZ2 4.01Å; L15-L105 HydrophobicContact CD1-CD1 4.48Å; L15-L105 HydrophobicContact CD1-CD2 4.39Å
16	L	91.9	Very high	83.8	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69.9	-31.4	176	-168.1	58.5	0	0	0	112.6	L12 S14 R20 I23 L68 L71 I72 L79 F82 W83	L12-L16 WeakPolarHBondContact O-CB 3.49Å; L12-L16 PolarHBondContact O-N 3.12Å; L12-L16 VanDerWaalsContact O-N 3.14Å; S14-L16 VanDerWaalsContact C-N 3.29Å; S14-L16 PolarHBondContact O-N 3.45Å; L16-R20 WeakPolarHBondContact O-CA 3.49Å; L16-R20 VanDerWaalsContact O-CB 3.27Å; L16-R20 WeakPolarHBondContact O-CB 3.46Å; L16-R20 PolarHBondContact O-N 3.42Å; L16-I23 HydrophobicContact CD1-CD1 4.06Å; L16-L68 HydrophobicContact CD1-CD2 3.99Å; L16-L71 HydrophobicContact CD2-CB 4.07Å; L16-I72 HydrophobicContact CB-CG1 4.06Å; L16-I72 HydrophobicContact CD2-CG1 3.73Å; L16-I72 HydrophobicContact CG-CD1 4.22Å; L16-I72 HydrophobicContact CG-CG1 3.7Å; L16-L79 HydrophobicContact CD2-CD2 3.4Å; L16-L79 VanDerWaalsContact CD2-CD2 3.4Å; L16-F82 HydrophobicContact CD1-CD1 4.45Å; L16-F82 HydrophobicContact CD1-CE1 3.63Å; L16-F82 HydrophobicContact CD1-CZ 4.13Å; L16-F82 HydrophobicContact CD2-CD1 4.4Å; L16-F82 HydrophobicContact CD2-CE1 4.32Å; L16-W83 HydrophobicContact CB-CZ2 3.77Å; L16-W83 HydrophobicContact CD1-CH2 4.18Å; L16-W83 HydrophobicContact CD1-CZ2 3.81Å; L16-W83 HydrophobicContact CG-CZ2 4.37Å
17	R	92.9	Very high	85.7	Confident	139 Å²	139	58.8 Å²	58.8	53%	0.525	29%	0.289	S	S	.	.	H	α-helix	trans	-69.6	-40.6	174.2	-77.7	169.5	175.8	-161.2	-3.1	112.4	R13 S14 I72	R13-R17 VanDerWaalsContact O-CG 3.27Å; R13-R17 WeakPolarHBondContact O-CG 3.44Å; R13-R17 PolarHBondContact O-N 3.43Å; S14-R17 WeakPolarHBondContact O-CB 3.4Å; S14-R17 PolarHBondContact O-N 3.26Å; S14-R17 VanDerWaalsContact O-N 3.08Å; R17-I72 HydrophobicContact CB-CD1 4.48Å; R17-I72 HydrophobicContact CG-CD1 3.77Å; R17-I72 HydrophobicContact CG-CG1 4.1Å; R17-I72 HydrophobicContact CG-CG2 3.75Å; R17-I72 VanDerWaalsContact NE-CG2 3.28Å
18	E	91.8	Very high	87.3	Confident	121 Å²	121	62 Å²	62	57%	0.565	31%	0.307	S	S	*	.	H	α-helix	trans	-63.6	-51	176.3	-172.9	171.6	-179.5	0	0	110.4	S14 L15	S14-E18 PolarHBondContact O-N 2.79Å; L15-E18 PolarHBondContact O-N 3.39Å
19	L	93.2	Very high	89.2	Confident	12 Å²	12	58.4 Å²	58.4	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-91.2	2.6	-172.6	-58.4	169	0	0	0	115	L15 T21 D22 I23 W83 L101 L105	L15-L19 HydrophobicContact CD1-CD1 3.63Å; L15-L19 HydrophobicContact CD1-CG 4.35Å; L15-L19 HydrophobicContact CG-CD1 3.81Å; L15-L19 WeakPolarHBondContact O-CB 3.26Å; L15-L19 WeakPolarHBondContact O-CG 3.23Å; L15-L19 PolarHBondContact O-N 3.19Å; L19-T21 VanDerWaalsContact C-N 3.3Å; L19-T21 PolarHBondContact O-N 3.13Å; L19-D22 PolarHBondContact O-N 3.36Å; L19-D22 VanDerWaalsContact O-N 3.16Å; L19-I23 HydrophobicContact CB-CD1 3.71Å; L19-I23 HydrophobicContact CB-CG1 4.06Å; L19-I23 WeakPolarHBondContact O-CB 3.34Å; L19-I23 VanDerWaalsContact O-CG1 3.3Å; L19-I23 WeakPolarHBondContact O-CG1 3.26Å; L19-I23 PolarHBondContact O-N 3.22Å; L19-W83 HydrophobicContact CD1-CH2 4.1Å; L19-L101 HydrophobicContact CD1-CD2 4.15Å; L19-L101 HydrophobicContact CD2-CD2 4.05Å; L19-L105 HydrophobicContact CD1-CD1 3.43Å; L19-L105 VanDerWaalsContact CD1-CD1 3.43Å; L19-L105 HydrophobicContact CD1-CD2 4.29Å; L19-L105 HydrophobicContact CD1-CG 4.44Å; L19-L105 HydrophobicContact CD2-CD1 4.46Å; L19-L105 HydrophobicContact CD2-CD2 4.3Å
20	R	94.5	Very high	91.1	Very high	64 Å²	64	50.8 Å²	50.8	24%	0.242	26%	0.259	C	S	.	.	H	α-helix	trans	-53	-46.4	-173.6	173	173.4	49.9	170.6	-1.8	112.5	L16 A24 Y65 L68 S69 I72	L16-R20 WeakPolarHBondContact O-CA 3.49Å; L16-R20 VanDerWaalsContact O-CB 3.27Å; L16-R20 WeakPolarHBondContact O-CB 3.46Å; L16-R20 PolarHBondContact O-N 3.42Å; R20-A24 VanDerWaalsContact O-CB 3.3Å; R20-A24 WeakPolarHBondContact O-CB 3.48Å; R20-A24 PolarHBondContact O-N 3.37Å; R20-A24 VanDerWaalsContact O-N 3.1Å; R20-Y65 HydrophobicContact CG-CD2 3.71Å; R20-Y65 HydrophobicContact CG-CE2 3.78Å; R20-Y65 HydrophobicContact CG-CG 4.3Å; R20-Y65 VanDerWaalsContact CZ-CZ 3.45Å; R20-Y65 PolarHBondContact NH2-OH 2.99Å; R20-Y65 VanDerWaalsContact NH2-OH 3.14Å; R20-L68 HydrophobicContact CG-CB 3.95Å; R20-L68 HydrophobicContact CG-CD1 4.48Å; R20-L68 WeakPolarHBondContact O-CD1 3.39Å; R20-S69 WeakPolarHBondContact CD-OG 3.46Å; R20-S69 PolarHBondContact NH1-OG 3.47Å; R20-I72 HydrophobicContact CB-CD1 4.41Å
21	T	95.6	Very high	92.5	Very high	73 Å²	73	55 Å²	55	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-68.8	-45.8	-179.4	-49.5	0	0	0	0	110.6	L19 I23 A24 M25	L19-T21 VanDerWaalsContact C-N 3.3Å; L19-T21 PolarHBondContact O-N 3.13Å; T21-I23 PolarHBondContact O-N 3.38Å; T21-A24 PolarHBondContact O-N 3.49Å; T21-A24 VanDerWaalsContact O-N 3.15Å; T21-M25 HydrophobicContact CG2-CG 4.41Å; T21-M25 WeakPolarHBondContact O-CG 3.46Å; T21-M25 PolarHBondContact O-N 2.86Å
22	D	95.1	Very high	92.9	Very high	85 Å²	85	51.3 Å²	51.3	46%	0.455	25%	0.252	S	S	.	.	H	α-helix	trans	-67	-38.9	-175.5	-54	-29.1	0	0	0	111.6	L19 M25 A26 L101	L19-D22 PolarHBondContact O-N 3.36Å; L19-D22 VanDerWaalsContact O-N 3.16Å; D22-M25 PolarHBondContact O-N 2.85Å; D22-A26 WeakPolarHBondContact O-CB 3.43Å; D22-A26 PolarHBondContact O-N 3.4Å; D22-L101 HydrophobicContact CB-CD1 3.53Å; D22-L101 HydrophobicContact CB-CG 4.4Å
23	I	94.8	Very high	93.2	Very high	1 Å²	1	51 Å²	51	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-43.9	172.1	-64.6	166.8	0	0	0	110.2	L16 L19 T21 M25 A26 V27 L68 W83 L86 L98 L101	L16-I23 HydrophobicContact CD1-CD1 4.06Å; L19-I23 HydrophobicContact CB-CD1 3.71Å; L19-I23 HydrophobicContact CB-CG1 4.06Å; L19-I23 WeakPolarHBondContact O-CB 3.34Å; L19-I23 VanDerWaalsContact O-CG1 3.3Å; L19-I23 WeakPolarHBondContact O-CG1 3.26Å; L19-I23 PolarHBondContact O-N 3.22Å; T21-I23 PolarHBondContact O-N 3.38Å; I23-M25 VanDerWaalsContact C-N 3.32Å; I23-M25 PolarHBondContact O-N 3.31Å; I23-A26 PolarHBondContact O-N 3.24Å; I23-A26 VanDerWaalsContact O-N 3.15Å; I23-V27 WeakPolarHBondContact O-CG2 3.33Å; I23-V27 PolarHBondContact O-N 3Å; I23-L68 HydrophobicContact CB-CD1 4.13Å; I23-L68 HydrophobicContact CG2-CD1 3.87Å; I23-L68 HydrophobicContact CG2-CD2 4.2Å; I23-W83 HydrophobicContact CD1-CH2 3.83Å; I23-W83 HydrophobicContact CD1-CZ3 4.17Å; I23-L86 HydrophobicContact CD1-CD2 4.14Å; I23-L86 HydrophobicContact CG2-CD1 4.4Å; I23-L98 HydrophobicContact CB-CD1 4.43Å; I23-L98 HydrophobicContact CG1-CD1 3.96Å; I23-L98 HydrophobicContact CG2-CD1 4.2Å; I23-L101 HydrophobicContact CG1-CD1 4.09Å
24	A	96.3	Very high	93.4	Very high	3 Å²	3	47.5 Å²	47.5	3%	0.025	24%	0.237	C	C	.	.	H	α-helix	trans	-63.4	-34.4	178	0	0	0	0	0	113.4	R20 T21 H61 M64 L68	R20-A24 VanDerWaalsContact O-CB 3.3Å; R20-A24 WeakPolarHBondContact O-CB 3.48Å; R20-A24 PolarHBondContact O-N 3.37Å; R20-A24 VanDerWaalsContact O-N 3.1Å; T21-A24 PolarHBondContact O-N 3.49Å; T21-A24 VanDerWaalsContact O-N 3.15Å; A24-H61 PolarHBondContact O-ND1 2.89Å; A24-M64 HydrophobicContact CB-CB 4.15Å; A24-L68 HydrophobicContact CB-CD1 4.07Å
25	M	95.5	Very high	93.6	Very high	95 Å²	95	48.7 Å²	48.7	47%	0.468	23%	0.232	S	C	.	.	H	α-helix	trans	-83.4	-13	175.2	-65	-55.8	-52.5	0	0	113.7	T21 D22 I23 H61 K97	T21-M25 HydrophobicContact CG2-CG 4.41Å; T21-M25 WeakPolarHBondContact O-CG 3.46Å; T21-M25 PolarHBondContact O-N 2.86Å; D22-M25 PolarHBondContact O-N 2.85Å; I23-M25 VanDerWaalsContact C-N 3.32Å; I23-M25 PolarHBondContact O-N 3.31Å; M25-H61 HydrophobicContact SD-CB 3.83Å; M25-K97 WeakPolarHBondContact O-CD 3.36Å; M25-K97 PolarHBondContact O-NZ 3.02Å; M25-K97 VanDerWaalsContact O-NZ 3.14Å
26	A	94.4	Very high	93.7	Very high	3 Å²	3	47.8 Å²	47.8	3%	0.025	23%	0.229	C	C	.	.	H	α-helix	trans	-89.1	-13.1	175.2	0	0	0	0	0	113.7	D22 I23 K97 L98 L101	D22-A26 WeakPolarHBondContact O-CB 3.43Å; D22-A26 PolarHBondContact O-N 3.4Å; I23-A26 PolarHBondContact O-N 3.24Å; I23-A26 VanDerWaalsContact O-N 3.15Å; A26-K97 HydrophobicContact CB-CB 3.68Å; A26-L98 HydrophobicContact CB-CB 3.94Å; A26-L98 HydrophobicContact CB-CD1 4.39Å; A26-L101 HydrophobicContact CB-CD1 4.47Å
27	V	94.1	Very high	93.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.229	C	C	.	.			trans	-104	110.9	178.2	176.6	0	0	0	0	108.7	I23 D29 I33 I60 H61 M64 Y95	I23-V27 WeakPolarHBondContact O-CG2 3.33Å; I23-V27 PolarHBondContact O-N 3Å; V27-D29 VanDerWaalsContact CG1-O 3.29Å; V27-D29 WeakPolarHBondContact CG1-O 3.42Å; V27-I33 HydrophobicContact CG1-CD1 4.44Å; V27-I33 HydrophobicContact CG2-CD1 3.46Å; V27-I33 VanDerWaalsContact CG2-CD1 3.46Å; V27-I60 HydrophobicContact CG1-CD1 4.11Å; V27-H61 PolarHBondContact O-CE1 3.45Å; V27-H61 PolarHBondContact O-ND1 3.26Å; V27-M64 HydrophobicContact CB-CG 4.31Å; V27-M64 HydrophobicContact CG1-CE 4.21Å; V27-M64 HydrophobicContact CG1-CG 3.96Å; V27-M64 HydrophobicContact CG1-SD 4.19Å; V27-M64 HydrophobicContact CG2-CE 4.48Å; V27-Y95 HydrophobicContact CB-CE1 4.33Å; V27-Y95 HydrophobicContact CG1-CE1 3.87Å; V27-Y95 HydrophobicContact CG2-CD1 4.43Å; V27-Y95 HydrophobicContact CG2-CE1 4.41Å
28	D	92.2	Very high	93.8	Very high	87 Å²	87	42 Å²	42	47%	0.465	21%	0.211	S	C	.	.	S	Bend	trans	-105.3	-11.1	-176.8	-59.7	-46	0	0	0	113.3	H61 K97	D28-H61 IonicContact OD1-CE1 2.91Å; D28-H61 PolarHBondContact OD1-CE1 2.72Å; D28-K97 IonicContact OD1-NZ 2.71Å; D28-K97 PolarHBondContact OD1-NZ 2.6Å; D28-K97 VanDerWaalsContact OD2-CE 3.24Å; D28-K97 WeakPolarHBondContact OD2-CE 3.46Å; D28-K97 IonicContact OD2-NZ 2.67Å; D28-K97 PolarHBondContact OD2-NZ 2.99Å
29	D	92.4	Very high	93.9	Very high	73 Å²	73	42.4 Å²	42.4	39%	0.39	22%	0.217	S	C	.	.			trans	-139.5	129.8	175.3	156.7	29.4	0	0	0	107	V27 F31 P32 I60 Y95	V27-D29 VanDerWaalsContact CG1-O 3.29Å; V27-D29 WeakPolarHBondContact CG1-O 3.42Å; D29-F31 WeakPolarHBondContact OD1-CB 3.36Å; D29-F31 PolarHBondContact OD1-N 3.17Å; D29-P32 WeakPolarHBondContact OD2-CD 3.42Å; D29-I60 VanDerWaalsContact C-CD1 3.43Å; D29-I60 VanDerWaalsContact N-CD1 3.31Å; D29-Y95 WeakPolarHBondContact O-CE1 3.44Å; D29-Y95 VanDerWaalsContact O-CZ 3.29Å; D29-Y95 PolarHBondContact O-OH 3.07Å
30	P	91.4	Very high	93.7	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.058	23%	0.229	C	C	.	.	S	Bend	trans	-82.3	-15.8	-177.2	13.5	-0.1	0	0	0	113.2	I33 V34 E55 I60	P30-I33 PolarHBondContact O-N 2.72Å; P30-V34 HydrophobicContact CB-CB 4.34Å; P30-V34 HydrophobicContact CB-CG2 3.63Å; P30-V34 WeakPolarHBondContact O-CB 3.4Å; P30-V34 WeakPolarHBondContact O-CG2 3.46Å; P30-V34 PolarHBondContact O-N 3.26Å; P30-E55 WeakPolarHBondContact CD-OE1 3.14Å; P30-E55 WeakPolarHBondContact CG-OE1 3.4Å; P30-E55 WeakPolarHBondContact CG-OE2 3.43Å; P30-I60 HydrophobicContact CB-CD1 4.2Å; P30-I60 HydrophobicContact CB-CG1 4.47Å; P30-I60 HydrophobicContact CG-CD1 3.83Å; P30-I60 HydrophobicContact CG-CG1 4.13Å
31	F	93.6	Very high	93.5	Very high	128 Å²	128	49.3 Å²	49.3	56%	0.561	26%	0.255	S	S	*	.	I	π-helix	trans	-57.6	-57	-165.7	171	-102.3	0	0	0	113.5	D29 I33 Y35	D29-F31 WeakPolarHBondContact OD1-CB 3.36Å; D29-F31 PolarHBondContact OD1-N 3.17Å; F31-I33 VanDerWaalsContact C-N 3.34Å; F31-I33 PolarHBondContact O-N 2.79Å; F31-Y35 HydrophobicContact CB-CD2 4.39Å; F31-Y35 HydrophobicContact CD2-CD1 4.32Å; F31-Y35 AromaticContact CD2-CD2 3.61Å; F31-Y35 HydrophobicContact CD2-CD2 3.61Å; F31-Y35 AromaticContact CD2-CE2 3.89Å; F31-Y35 HydrophobicContact CD2-CE2 3.89Å; F31-Y35 AromaticContact CD2-CG 3.84Å; F31-Y35 HydrophobicContact CD2-CG 3.84Å; F31-Y35 HydrophobicContact CE2-CD1 4.31Å; F31-Y35 HydrophobicContact CE2-CD2 4.35Å; F31-Y35 HydrophobicContact CE2-CG 4.12Å; F31-Y35 HydrophobicContact CG-CD2 4.39Å; F31-Y35 WeakPolarHBondContact O-CB 3.48Å; F31-Y35 PolarHBondContact O-N 3Å
32	P	93	Very high	93.2	Very high	17 Å²	17	46.5 Å²	46.5	11%	0.11	24%	0.237	C	C	.	.	I	π-helix	trans	-57.4	-37	-179.7	-25.1	31.1	0	0	0	115.5	D29 Y90 N91 Y95	D29-P32 WeakPolarHBondContact OD2-CD 3.42Å; P32-Y90 HydrophobicContact CB-CD2 4.38Å; P32-N91 WeakPolarHBondContact CB-OD1 3.41Å; P32-N91 PolarHBondContact O-OD1 3.49Å; P32-Y95 HydrophobicContact CB-CE2 4Å; P32-Y95 VanDerWaalsContact CD-OH 3.27Å; P32-Y95 WeakPolarHBondContact CD-OH 3.49Å; P32-Y95 HydrophobicContact CG-CE2 4.42Å
33	I	93.3	Very high	93.2	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.217	C	C	.	.	I	π-helix	trans	-84.2	-56.6	179.6	-81.8	161.5	0	0	0	112.1	V27 P30 F31 G36 L37 M64 L86 Y95 L98	V27-I33 HydrophobicContact CG1-CD1 4.44Å; V27-I33 HydrophobicContact CG2-CD1 3.46Å; V27-I33 VanDerWaalsContact CG2-CD1 3.46Å; P30-I33 PolarHBondContact O-N 2.72Å; F31-I33 VanDerWaalsContact C-N 3.34Å; F31-I33 PolarHBondContact O-N 2.79Å; I33-G36 CarbonylContact O-C 3.57Å; I33-G36 PolarHBondContact O-N 2.91Å; I33-L37 HydrophobicContact CG2-CD1 3.96Å; I33-L37 VanDerWaalsContact O-CG 3.25Å; I33-L37 WeakPolarHBondContact O-CG 3.25Å; I33-L37 PolarHBondContact O-N 2.91Å; I33-M64 HydrophobicContact CG2-CE 3.79Å; I33-L86 HydrophobicContact CD1-CD1 3.65Å; I33-L86 HydrophobicContact CG1-CD1 4.18Å; I33-Y95 HydrophobicContact CB-CE2 4.45Å; I33-Y95 HydrophobicContact CD1-CD2 3.71Å; I33-Y95 HydrophobicContact CD1-CE2 3.28Å; I33-Y95 HydrophobicContact CG1-CD2 4.39Å; I33-Y95 HydrophobicContact CG1-CE2 3.62Å; I33-Y95 PolarHBondContact N-OH 2.99Å; I33-L98 HydrophobicContact CD1-CD2 4.2Å
34	V	94.2	Very high	93.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.238	C	C	.	.	I	π-helix	trans	-71.6	-43.4	-165.4	-170.3	0	0	0	0	110.8	P30 L37 A38 I43 L48 T51 M64 L67	P30-V34 HydrophobicContact CB-CB 4.34Å; P30-V34 HydrophobicContact CB-CG2 3.63Å; P30-V34 WeakPolarHBondContact O-CB 3.4Å; P30-V34 WeakPolarHBondContact O-CG2 3.46Å; P30-V34 PolarHBondContact O-N 3.26Å; V34-L37 PolarHBondContact O-N 3.02Å; V34-A38 PolarHBondContact O-N 2.76Å; V34-A38 VanDerWaalsContact O-N 3.1Å; V34-I43 HydrophobicContact CG1-CD1 3.73Å; V34-I43 WeakPolarHBondContact O-CD1 3.46Å; V34-L48 HydrophobicContact CB-CD1 4.37Å; V34-L48 HydrophobicContact CG1-CD1 3.59Å; V34-T51 HydrophobicContact CG1-CG2 4.23Å; V34-T51 HydrophobicContact CG2-CG2 4.37Å; V34-M64 HydrophobicContact CG2-CE 4.3Å; V34-M64 HydrophobicContact CG2-SD 3.55Å; V34-M64 VanDerWaalsContact CG2-SD 3.55Å; V34-L67 HydrophobicContact CG1-CD2 4.06Å; V34-L67 HydrophobicContact CG2-CD2 3.96Å
35	Y	93.9	Very high	92.9	Very high	86 Å²	86	51.2 Å²	51.2	34%	0.337	26%	0.261	S	S	.	.	I	π-helix	trans	-66.9	-42.4	173.1	-69.3	-107.9	0	0	0	110.4	F31 L37 A38 D39 L48 L52	F31-Y35 HydrophobicContact CB-CD2 4.39Å; F31-Y35 HydrophobicContact CD2-CD1 4.32Å; F31-Y35 AromaticContact CD2-CD2 3.61Å; F31-Y35 HydrophobicContact CD2-CD2 3.61Å; F31-Y35 AromaticContact CD2-CE2 3.89Å; F31-Y35 HydrophobicContact CD2-CE2 3.89Å; F31-Y35 AromaticContact CD2-CG 3.84Å; F31-Y35 HydrophobicContact CD2-CG 3.84Å; F31-Y35 HydrophobicContact CE2-CD1 4.31Å; F31-Y35 HydrophobicContact CE2-CD2 4.35Å; F31-Y35 HydrophobicContact CE2-CG 4.12Å; F31-Y35 HydrophobicContact CG-CD2 4.39Å; F31-Y35 WeakPolarHBondContact O-CB 3.48Å; F31-Y35 PolarHBondContact O-N 3Å; Y35-L37 PolarHBondContact O-N 2.85Å; Y35-A38 WeakPolarHBondContact O-CA 3.4Å; Y35-A38 WeakPolarHBondContact O-CB 3.26Å; Y35-A38 PolarHBondContact O-N 2.92Å; Y35-D39 VanDerWaalsContact O-CG 3.24Å; Y35-D39 PolarHBondContact O-N 3.2Å; Y35-L48 HydrophobicContact CD1-CD2 4.38Å; Y35-L48 HydrophobicContact CD2-CD1 4.12Å; Y35-L48 HydrophobicContact CE1-CD2 4.31Å; Y35-L48 HydrophobicContact CE2-CD1 4.08Å; Y35-L48 HydrophobicContact CG-CD1 4.38Å; Y35-L52 HydrophobicContact CE2-CD1 4.45Å; Y35-L52 HydrophobicContact CE2-CD2 4.31Å
36	G	92.6	Very high	92.8	Very high	6 Å²	6	52 Å²	52	6%	0.062	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-10.8	174.3	0	0	0	0	0	115.4	I33 K40 N85	I33-G36 CarbonylContact O-C 3.57Å; I33-G36 PolarHBondContact O-N 2.91Å; G36-K40 WeakPolarHBondContact O-CD 3.39Å; G36-K40 WeakPolarHBondContact O-CG 3.49Å; G36-N85 PolarHBondContact O-ND2 3.1Å; G36-N85 VanDerWaalsContact O-ND2 3.17Å; G36-N85 PolarHBondContact O-OD1 3.42Å
37	L	94.1	Very high	92.7	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-92.7	-35.3	167.5	-68.1	170.8	0	0	0	111.9	I33 V34 Y35 K40 N41 I42 I43 L67 L71 F82 N85	I33-L37 HydrophobicContact CG2-CD1 3.96Å; I33-L37 VanDerWaalsContact O-CG 3.25Å; I33-L37 WeakPolarHBondContact O-CG 3.25Å; I33-L37 PolarHBondContact O-N 2.91Å; V34-L37 PolarHBondContact O-N 3.02Å; Y35-L37 PolarHBondContact O-N 2.85Å; L37-K40 PolarHBondContact O-N 3.28Å; L37-N41 PolarHBondContact O-N 2.75Å; L37-I42 HydrophobicContact CB-CB 4.32Å; L37-I42 HydrophobicContact CD2-CB 4.04Å; L37-I42 HydrophobicContact CD2-CD1 3.69Å; L37-I42 HydrophobicContact CD2-CG1 4.48Å; L37-I42 HydrophobicContact CD2-CG2 3.88Å; L37-I42 WeakPolarHBondContact O-CB 3.29Å; L37-I42 PolarHBondContact O-N 3.35Å; L37-I43 HydrophobicContact CB-CD1 4.14Å; L37-I43 HydrophobicContact CB-CG1 3.96Å; L37-I43 HydrophobicContact CB-CG2 4.06Å; L37-I43 HydrophobicContact CD1-CG2 4.36Å; L37-I43 PolarHBondContact O-N 2.85Å; L37-L67 HydrophobicContact CD1-CD2 4.4Å; L37-L71 HydrophobicContact CD1-CD1 4.44Å; L37-F82 HydrophobicContact CD1-CD2 3.94Å; L37-F82 HydrophobicContact CD1-CE2 4.26Å; L37-F82 HydrophobicContact CD2-CB 4.35Å; L37-F82 HydrophobicContact CD2-CD2 3.83Å; L37-N85 HydrophobicContact CD2-CB 3.88Å
38	A	94.7	Very high	92.7	Very high	17 Å²	17	54.2 Å²	54.2	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-68.4	-48.1	176.4	0	0	0	0	0	111.8	V34 Y35 K40 N41 I43 L48	V34-A38 PolarHBondContact O-N 2.76Å; V34-A38 VanDerWaalsContact O-N 3.1Å; Y35-A38 WeakPolarHBondContact O-CA 3.4Å; Y35-A38 WeakPolarHBondContact O-CB 3.26Å; Y35-A38 PolarHBondContact O-N 2.92Å; A38-K40 PolarHBondContact O-N 2.99Å; A38-N41 PolarHBondContact O-N 3.1Å; A38-I43 HydrophobicContact CB-CD1 4.26Å; A38-I43 HydrophobicContact CB-CG1 4Å; A38-L48 HydrophobicContact CB-CB 4.43Å; A38-L48 HydrophobicContact CB-CD2 4.04Å
39	D	93.4	Very high	92.8	Very high	129 Å²	129	53.9 Å²	53.9	69%	0.69	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-27.1	175.4	-63.1	-23	0	0	0	112.9	Y35	Y35-D39 VanDerWaalsContact O-CG 3.24Å; Y35-D39 PolarHBondContact O-N 3.2Å
40	K	88.8	Confident	92.9	Very high	74 Å²	74	53.5 Å²	53.5	32%	0.322	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	0.1	179.8	-72.8	-175.6	169	179.1	0	114.1	G36 L37 A38 I42 N85	G36-K40 WeakPolarHBondContact O-CD 3.39Å; G36-K40 WeakPolarHBondContact O-CG 3.49Å; L37-K40 PolarHBondContact O-N 3.28Å; A38-K40 PolarHBondContact O-N 2.99Å; K40-I42 HydrophobicContact CB-CD1 3.65Å; K40-I42 HydrophobicContact CB-CG1 3.76Å; K40-I42 HydrophobicContact CD-CD1 3.57Å; K40-I42 HydrophobicContact CG-CD1 4.31Å; K40-I42 PolarHBondContact O-N 2.92Å; K40-N85 HydrophobicContact CD-CB 4.39Å; K40-N85 VanDerWaalsContact CE-OD1 3.26Å; K40-N85 WeakPolarHBondContact CE-OD1 3.33Å; K40-N85 PolarHBondContact NZ-OD1 3.26Å
41	N	89.4	Confident	93	Very high	148 Å²	148	53.6 Å²	53.6	79%	0.791	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	30.1	-172.1	-57.1	-90.2	0	0	0	113.3	L37 A38	L37-N41 PolarHBondContact O-N 2.75Å; A38-N41 PolarHBondContact O-N 3.1Å
42	I	90.1	Very high	93	Very high	13 Å²	13	49 Å²	49	7%	0.067	25%	0.249	C	C	.	.	S	Bend	trans	-80.8	-32.1	173.6	-60.4	165	0	0	0	110.1	L37 K40 L71 T78 A81 F82 N85	L37-I42 HydrophobicContact CB-CB 4.32Å; L37-I42 HydrophobicContact CD2-CB 4.04Å; L37-I42 HydrophobicContact CD2-CD1 3.69Å; L37-I42 HydrophobicContact CD2-CG1 4.48Å; L37-I42 HydrophobicContact CD2-CG2 3.88Å; L37-I42 WeakPolarHBondContact O-CB 3.29Å; L37-I42 PolarHBondContact O-N 3.35Å; K40-I42 HydrophobicContact CB-CD1 3.65Å; K40-I42 HydrophobicContact CB-CG1 3.76Å; K40-I42 HydrophobicContact CD-CD1 3.57Å; K40-I42 HydrophobicContact CG-CD1 4.31Å; K40-I42 PolarHBondContact O-N 2.92Å; I42-L71 HydrophobicContact CG2-CD2 4.28Å; I42-T78 HydrophobicContact CG2-CG2 3.86Å; I42-A81 HydrophobicContact CD1-CB 3.71Å; I42-A81 WeakPolarHBondContact CD1-O 3.43Å; I42-A81 HydrophobicContact CG1-CB 3.77Å; I42-F82 HydrophobicContact CG2-CB 4.34Å; I42-N85 HydrophobicContact CD1-CB 4.4Å
43	I	94.1	Very high	93.1	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.026	27%	0.267	C	S	.	.	S	Bend	trans	-119.3	156.4	167.4	69.4	172.5	0	0	0	108.1	V34 L37 A38 Q47 L48 L67 W70	V34-I43 HydrophobicContact CG1-CD1 3.73Å; V34-I43 WeakPolarHBondContact O-CD1 3.46Å; L37-I43 HydrophobicContact CB-CD1 4.14Å; L37-I43 HydrophobicContact CB-CG1 3.96Å; L37-I43 HydrophobicContact CB-CG2 4.06Å; L37-I43 HydrophobicContact CD1-CG2 4.36Å; L37-I43 PolarHBondContact O-N 2.85Å; A38-I43 HydrophobicContact CB-CD1 4.26Å; A38-I43 HydrophobicContact CB-CG1 4Å; I43-Q47 VanDerWaalsContact CA-OE1 3.29Å; I43-Q47 HydrophobicContact CB-CB 4.14Å; I43-L48 HydrophobicContact CD1-CB 4.17Å; I43-L67 HydrophobicContact CG2-CD1 3.98Å; I43-W70 HydrophobicContact CG2-CE3 4.5Å; I43-W70 HydrophobicContact CG2-CZ3 3.85Å
44	T	93.3	Very high	93.1	Very high	73 Å²	73	56.7 Å²	56.7	45%	0.448	28%	0.281	S	S	.	.			trans	-85.4	161.2	173.4	66.3	0	0	0	0	111.5	Q46 Q47 L48	T44-Q46 PolarHBondContact O-N 3.26Å; T44-Q47 WeakPolarHBondContact O-CA 3.47Å; T44-Q47 WeakPolarHBondContact O-CB 3.33Å; T44-Q47 PolarHBondContact O-N 3.47Å; T44-Q47 WeakPolarHBondContact OG1-CG 3.34Å; T44-Q47 PolarHBondContact OG1-N 3.35Å; T44-Q47 PolarHBondContact OG1-NE2 3.25Å; T44-L48 PolarHBondContact O-N 2.99Å
45	E	91.9	Very high	93.2	Very high	110 Å²	110	59.4 Å²	59.4	51%	0.514	29%	0.293	S	S	.	.	H	α-helix	trans	-53.5	-40.9	172.7	-177.8	54.6	-144.6	0	0	112	Q47 L48 Q49	E45-Q47 VanDerWaalsContact C-N 3.26Å; E45-Q47 PolarHBondContact O-N 3.49Å; E45-L48 WeakPolarHBondContact O-CB 3.38Å; E45-L48 PolarHBondContact O-N 2.97Å; E45-Q49 HydrophobicContact CG-CG 4.47Å; E45-Q49 WeakPolarHBondContact O-CG 3.5Å; E45-Q49 PolarHBondContact O-N 3.47Å; E45-Q49 WeakPolarHBondContact OE1-CG 3.35Å; E45-Q49 PolarHBondContact OE1-NE2 3.39Å
46	Q	93.4	Very high	93.2	Very high	112 Å²	112	61.7 Å²	61.7	52%	0.523	32%	0.316	S	S	.	.	H	α-helix	trans	-57.3	-39.5	174.5	-175.8	63.6	39.3	0	0	112.2	T44 Q49 D50	T44-Q46 PolarHBondContact O-N 3.26Å; Q46-Q49 PolarHBondContact O-N 3.31Å; Q46-D50 VanDerWaalsContact NE2-CG 3.26Å; Q46-D50 PolarHBondContact NE2-OD1 3.32Å; Q46-D50 VanDerWaalsContact NE2-OD1 3.13Å; Q46-D50 PolarHBondContact NE2-OD2 3.3Å; Q46-D50 WeakPolarHBondContact O-CB 3.33Å; Q46-D50 PolarHBondContact O-N 3.3Å
47	Q	92.2	Very high	93.3	Very high	42 Å²	42	65.7 Å²	65.7	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-76.1	-31.6	179.8	-68.2	154.9	6.8	0	0	112.5	I43 T44 E45 T51 W70	I43-Q47 VanDerWaalsContact CA-OE1 3.29Å; I43-Q47 HydrophobicContact CB-CB 4.14Å; T44-Q47 WeakPolarHBondContact O-CA 3.47Å; T44-Q47 WeakPolarHBondContact O-CB 3.33Å; T44-Q47 PolarHBondContact O-N 3.47Å; T44-Q47 WeakPolarHBondContact OG1-CG 3.34Å; T44-Q47 PolarHBondContact OG1-N 3.35Å; T44-Q47 PolarHBondContact OG1-NE2 3.25Å; E45-Q47 VanDerWaalsContact C-N 3.26Å; E45-Q47 PolarHBondContact O-N 3.49Å; Q47-T51 VanDerWaalsContact O-CB 3.29Å; Q47-T51 WeakPolarHBondContact O-CB 3.46Å; Q47-T51 PolarHBondContact O-N 3.03Å; Q47-T51 PolarHBondContact O-OG1 3.38Å; Q47-W70 VanDerWaalsContact CD-CZ2 3.48Å
48	L	93.6	Very high	93.3	Very high	7 Å²	7	69.2 Å²	69.2	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-59.6	-56.1	167	172.2	63.6	0	0	0	109.5	V34 Y35 A38 I43 T44 E45 D50 T51 L52	V34-L48 HydrophobicContact CB-CD1 4.37Å; V34-L48 HydrophobicContact CG1-CD1 3.59Å; Y35-L48 HydrophobicContact CD1-CD2 4.38Å; Y35-L48 HydrophobicContact CD2-CD1 4.12Å; Y35-L48 HydrophobicContact CE1-CD2 4.31Å; Y35-L48 HydrophobicContact CE2-CD1 4.08Å; Y35-L48 HydrophobicContact CG-CD1 4.38Å; A38-L48 HydrophobicContact CB-CB 4.43Å; A38-L48 HydrophobicContact CB-CD2 4.04Å; I43-L48 HydrophobicContact CD1-CB 4.17Å; T44-L48 PolarHBondContact O-N 2.99Å; E45-L48 WeakPolarHBondContact O-CB 3.38Å; E45-L48 PolarHBondContact O-N 2.97Å; L48-D50 PolarHBondContact O-N 3.46Å; L48-T51 WeakPolarHBondContact O-CB 3.38Å; L48-T51 PolarHBondContact O-N 3.1Å; L48-T51 VanDerWaalsContact O-N 3.14Å; L48-L52 HydrophobicContact CD1-CD1 3.89Å; L48-L52 HydrophobicContact CD1-CG 4.22Å; L48-L52 HydrophobicContact CG-CD1 4.06Å; L48-L52 WeakPolarHBondContact O-CG 3.44Å; L48-L52 PolarHBondContact O-N 2.94Å
49	Q	94.7	Very high	93.3	Very high	80 Å²	80	70 Å²	70	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-59.1	-42.3	-179.2	-66.2	-61.1	-30.5	0	0	112.8	E45 Q46 L52 K53	E45-Q49 HydrophobicContact CG-CG 4.47Å; E45-Q49 WeakPolarHBondContact O-CG 3.5Å; E45-Q49 PolarHBondContact O-N 3.47Å; E45-Q49 WeakPolarHBondContact OE1-CG 3.35Å; E45-Q49 PolarHBondContact OE1-NE2 3.39Å; Q46-Q49 PolarHBondContact O-N 3.31Å; Q49-L52 PolarHBondContact O-N 3.26Å; Q49-K53 VanDerWaalsContact O-CG 3.22Å; Q49-K53 WeakPolarHBondContact O-CG 3.38Å; Q49-K53 PolarHBondContact O-N 3.46Å
50	D	94.4	Very high	93.4	Very high	66 Å²	66	65 Å²	65	35%	0.353	34%	0.342	S	S	.	.	H	α-helix	trans	-74.4	-25.8	179.2	-67.1	-19.1	0	0	0	112.9	Q46 L48 K53 K54	Q46-D50 VanDerWaalsContact NE2-CG 3.26Å; Q46-D50 PolarHBondContact NE2-OD1 3.32Å; Q46-D50 VanDerWaalsContact NE2-OD1 3.13Å; Q46-D50 PolarHBondContact NE2-OD2 3.3Å; Q46-D50 WeakPolarHBondContact O-CB 3.33Å; Q46-D50 PolarHBondContact O-N 3.3Å; L48-D50 PolarHBondContact O-N 3.46Å; D50-K53 IonicContact OD1-NZ 3.08Å; D50-K53 PolarHBondContact OD1-NZ 2.91Å; D50-K54 WeakPolarHBondContact O-CB 3.4Å; D50-K54 PolarHBondContact O-N 3.25Å; D50-K54 VanDerWaalsContact O-N 3.16Å
51	T	94.3	Very high	93.7	Very high	10 Å²	10	64.4 Å²	64.4	6%	0.061	34%	0.341	C	S	.	.	H	α-helix	trans	-68.7	-47.2	169.1	-58.1	0	0	0	0	110.7	V34 Q47 L48 K53 K54 E55 A63 L67	V34-T51 HydrophobicContact CG1-CG2 4.23Å; V34-T51 HydrophobicContact CG2-CG2 4.37Å; Q47-T51 VanDerWaalsContact O-CB 3.29Å; Q47-T51 WeakPolarHBondContact O-CB 3.46Å; Q47-T51 PolarHBondContact O-N 3.03Å; Q47-T51 PolarHBondContact O-OG1 3.38Å; L48-T51 WeakPolarHBondContact O-CB 3.38Å; L48-T51 PolarHBondContact O-N 3.1Å; L48-T51 VanDerWaalsContact O-N 3.14Å; T51-K53 PolarHBondContact O-N 2.94Å; T51-K54 CarbonylContact O-C 3.59Å; T51-K54 WeakPolarHBondContact O-CA 3.03Å; T51-K54 WeakPolarHBondContact O-CB 3.5Å; T51-K54 PolarHBondContact O-N 2.85Å; T51-K54 VanDerWaalsContact O-N 3.1Å; T51-E55 PolarHBondContact O-N 3.23Å; T51-A63 HydrophobicContact CG2-CB 4.03Å; T51-A63 WeakPolarHBondContact O-CB 3.33Å; T51-L67 HydrophobicContact CG2-CB 4.39Å; T51-L67 HydrophobicContact CG2-CD2 4.22Å
52	L	94.2	Very high	94	Very high	32 Å²	32	62.9 Å²	62.9	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-39.3	178.9	-64.5	171.8	0	0	0	112.1	Y35 L48 Q49 K54 E55 V56	Y35-L52 HydrophobicContact CE2-CD1 4.45Å; Y35-L52 HydrophobicContact CE2-CD2 4.31Å; L48-L52 HydrophobicContact CD1-CD1 3.89Å; L48-L52 HydrophobicContact CD1-CG 4.22Å; L48-L52 HydrophobicContact CG-CD1 4.06Å; L48-L52 WeakPolarHBondContact O-CG 3.44Å; L48-L52 PolarHBondContact O-N 2.94Å; Q49-L52 PolarHBondContact O-N 3.26Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 2.71Å; L52-E55 WeakPolarHBondContact O-CB 3.14Å; L52-E55 PolarHBondContact O-N 3.45Å; L52-V56 PolarHBondContact O-N 2.83Å
53	K	94.7	Very high	94.3	Very high	112 Å²	112	62.3 Å²	62.3	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-38.2	171.4	-69	165.3	-153.7	159.9	0	112.3	Q49 D50 T51 S57	Q49-K53 VanDerWaalsContact O-CG 3.22Å; Q49-K53 WeakPolarHBondContact O-CG 3.38Å; Q49-K53 PolarHBondContact O-N 3.46Å; D50-K53 IonicContact OD1-NZ 3.08Å; D50-K53 PolarHBondContact OD1-NZ 2.91Å; T51-K53 PolarHBondContact O-N 2.94Å; K53-S57 PolarHBondContact O-N 3.33Å; K53-S57 PolarHBondContact O-OG 3.2Å
54	K	93.8	Very high	94.4	Very high	68 Å²	68	62.2 Å²	62.2	30%	0.296	32%	0.323	S	S	.	.	H	α-helix	trans	-70.9	-31.1	174.9	-95.4	180	166.6	-97.6	0	112.9	D50 T51 L52 S57 E58 G59 A63 S66	D50-K54 WeakPolarHBondContact O-CB 3.4Å; D50-K54 PolarHBondContact O-N 3.25Å; D50-K54 VanDerWaalsContact O-N 3.16Å; T51-K54 CarbonylContact O-C 3.59Å; T51-K54 WeakPolarHBondContact O-CA 3.03Å; T51-K54 WeakPolarHBondContact O-CB 3.5Å; T51-K54 PolarHBondContact O-N 2.85Å; T51-K54 VanDerWaalsContact O-N 3.1Å; L52-K54 VanDerWaalsContact C-N 3.31Å; L52-K54 PolarHBondContact O-N 2.71Å; K54-S57 WeakPolarHBondContact CA-OG 3.27Å; K54-E58 WeakPolarHBondContact CE-OE1 3.33Å; K54-E58 IonicContact NZ-OE1 3.46Å; K54-E58 PolarHBondContact NZ-OE1 3.48Å; K54-E58 IonicContact NZ-OE2 3.72Å; K54-E58 WeakPolarHBondContact O-CA 3.31Å; K54-E58 WeakPolarHBondContact O-CB 3.4Å; K54-E58 PolarHBondContact O-N 3.36Å; K54-G59 PolarHBondContact O-N 3.48Å; K54-A63 HydrophobicContact CB-CB 3.86Å; K54-S66 PolarHBondContact NZ-OG 2.94Å
55	E	95.1	Very high	94.6	Very high	57 Å²	57	63 Å²	63	27%	0.266	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-49.5	173.6	173.3	179.7	-157.2	0	0	110.4	P30 T51 L52 S57 G59 I60 A63	P30-E55 WeakPolarHBondContact CD-OE1 3.14Å; P30-E55 WeakPolarHBondContact CG-OE1 3.4Å; P30-E55 WeakPolarHBondContact CG-OE2 3.43Å; T51-E55 PolarHBondContact O-N 3.23Å; L52-E55 WeakPolarHBondContact O-CB 3.14Å; L52-E55 PolarHBondContact O-N 3.45Å; E55-S57 VanDerWaalsContact C-N 3.33Å; E55-S57 PolarHBondContact O-N 3.11Å; E55-G59 WeakPolarHBondContact O-CA 3.21Å; E55-G59 PolarHBondContact O-N 3.08Å; E55-I60 HydrophobicContact CG-CB 4.17Å; E55-A63 HydrophobicContact CB-CB 4.05Å
56	V	94	Very high	94.8	Very high	134 Å²	134	59.4 Å²	59.4	81%	0.812	31%	0.306	S	S	*	.	H	α-helix	trans	-63.7	-34.9	179.8	176.6	0	0	0	0	112.8	L52	L52-V56 PolarHBondContact O-N 2.83Å
57	S	94.8	Very high	94.9	Very high	90 Å²	90	54.4 Å²	54.4	63%	0.629	28%	0.283	S	S	*	.	H	α-helix	trans	-95.1	-34	-175.4	54	0	0	0	0	115.2	K53 K54 E55	K53-S57 PolarHBondContact O-N 3.33Å; K53-S57 PolarHBondContact O-OG 3.2Å; K54-S57 WeakPolarHBondContact CA-OG 3.27Å; E55-S57 VanDerWaalsContact C-N 3.33Å; E55-S57 PolarHBondContact O-N 3.11Å
58	E	94.8	Very high	95.1	Very high	75 Å²	75	52.4 Å²	52.4	35%	0.35	27%	0.274	S	S	.	.	H	α-helix	trans	-115.9	-13.7	-174.8	-69.2	-176	-131.4	0	0	114.2	K54 K62	K54-E58 WeakPolarHBondContact CE-OE1 3.33Å; K54-E58 IonicContact NZ-OE1 3.46Å; K54-E58 PolarHBondContact NZ-OE1 3.48Å; K54-E58 IonicContact NZ-OE2 3.72Å; K54-E58 WeakPolarHBondContact O-CA 3.31Å; K54-E58 WeakPolarHBondContact O-CB 3.4Å; K54-E58 PolarHBondContact O-N 3.36Å; E58-K62 HydrophobicContact CB-CB 3.8Å; E58-K62 HydrophobicContact CB-CD 4.13Å; E58-K62 HydrophobicContact CB-CG 4.35Å; E58-K62 PolarHBondContact O-NZ 2.95Å
59	G	94.7	Very high	95.2	Very high	34 Å²	34	53.5 Å²	53.5	35%	0.351	28%	0.282	S	S	.	.			trans	89.9	146.2	-172.7	0	0	0	0	0	113.2	K54 E55 H61 K62 A63	K54-G59 PolarHBondContact O-N 3.48Å; E55-G59 WeakPolarHBondContact O-CA 3.21Å; E55-G59 PolarHBondContact O-N 3.08Å; G59-H61 VanDerWaalsContact C-N 3.34Å; G59-H61 PolarHBondContact O-N 2.94Å; G59-H61 VanDerWaalsContact O-N 3.16Å; G59-K62 PolarHBondContact O-N 3.32Å; G59-A63 PolarHBondContact O-N 3.5Å
60	I	94.9	Very high	95.2	Very high	23 Å²	23	53 Å²	53	12%	0.118	28%	0.277	C	S	.	.	H	α-helix	trans	-47.8	-47.5	-172.2	-172.5	-178.2	0	0	0	114	V27 D29 P30 E55 K62 A63 M64	V27-I60 HydrophobicContact CG1-CD1 4.11Å; D29-I60 VanDerWaalsContact C-CD1 3.43Å; D29-I60 VanDerWaalsContact N-CD1 3.31Å; P30-I60 HydrophobicContact CB-CD1 4.2Å; P30-I60 HydrophobicContact CB-CG1 4.47Å; P30-I60 HydrophobicContact CG-CD1 3.83Å; P30-I60 HydrophobicContact CG-CG1 4.13Å; E55-I60 HydrophobicContact CG-CB 4.17Å; I60-K62 PolarHBondContact O-N 2.91Å; I60-A63 WeakPolarHBondContact O-CB 3.36Å; I60-A63 PolarHBondContact O-N 2.96Å; I60-A63 VanDerWaalsContact O-N 3.07Å; I60-M64 HydrophobicContact CG1-CG 3.98Å; I60-M64 WeakPolarHBondContact O-CB 3.49Å; I60-M64 WeakPolarHBondContact O-CG 3.1Å; I60-M64 PolarHBondContact O-N 3Å
61	H	95.7	Very high	95.2	Very high	62 Å²	62	49.9 Å²	49.9	29%	0.287	26%	0.26	S	S	.	.	H	α-helix	trans	-61.9	-31.5	-177.2	-50.6	-49.3	0	0	0	112.6	A24 M25 V27 D28 G59 Y65	A24-H61 PolarHBondContact O-ND1 2.89Å; M25-H61 HydrophobicContact SD-CB 3.83Å; V27-H61 PolarHBondContact O-CE1 3.45Å; V27-H61 PolarHBondContact O-ND1 3.26Å; D28-H61 IonicContact OD1-CE1 2.91Å; D28-H61 PolarHBondContact OD1-CE1 2.72Å; G59-H61 VanDerWaalsContact C-N 3.34Å; G59-H61 PolarHBondContact O-N 2.94Å; G59-H61 VanDerWaalsContact O-N 3.16Å; H61-Y65 WeakPolarHBondContact O-CB 3.11Å; H61-Y65 PolarHBondContact O-N 3.13Å
62	K	95.3	Very high	95.2	Very high	116 Å²	116	49.8 Å²	49.8	50%	0.504	26%	0.259	S	S	.	.	H	α-helix	trans	-78.3	-34.5	174.7	-57.6	-150.5	-152.6	91.4	0	112.4	E58 G59 I60 Y65 S66	E58-K62 HydrophobicContact CB-CB 3.8Å; E58-K62 HydrophobicContact CB-CD 4.13Å; E58-K62 HydrophobicContact CB-CG 4.35Å; E58-K62 PolarHBondContact O-NZ 2.95Å; G59-K62 PolarHBondContact O-N 3.32Å; I60-K62 PolarHBondContact O-N 2.91Å; K62-Y65 PolarHBondContact O-N 2.77Å; K62-S66 WeakPolarHBondContact O-CB 3.43Å; K62-S66 PolarHBondContact O-N 3.07Å; K62-S66 PolarHBondContact O-OG 3.36Å
63	A	96.6	Very high	95.1	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.008	28%	0.284	C	S	.	.	H	α-helix	trans	-61.6	-50.9	171.4	0	0	0	0	0	110.8	T51 K54 E55 G59 I60 Y65 S66 L67	T51-A63 HydrophobicContact CG2-CB 4.03Å; T51-A63 WeakPolarHBondContact O-CB 3.33Å; K54-A63 HydrophobicContact CB-CB 3.86Å; E55-A63 HydrophobicContact CB-CB 4.05Å; G59-A63 PolarHBondContact O-N 3.5Å; I60-A63 WeakPolarHBondContact O-CB 3.36Å; I60-A63 PolarHBondContact O-N 2.96Å; I60-A63 VanDerWaalsContact O-N 3.07Å; A63-Y65 PolarHBondContact O-N 2.88Å; A63-S66 WeakPolarHBondContact O-CB 3.42Å; A63-S66 PolarHBondContact O-N 3.14Å; A63-S66 VanDerWaalsContact O-N 3.12Å; A63-L67 PolarHBondContact O-N 3.36Å
64	M	96.1	Very high	95	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-43.9	174.7	-69.1	-54.1	-58.7	0	0	112.1	A24 V27 I33 V34 I60 S66 L67 L68	A24-M64 HydrophobicContact CB-CB 4.15Å; V27-M64 HydrophobicContact CB-CG 4.31Å; V27-M64 HydrophobicContact CG1-CE 4.21Å; V27-M64 HydrophobicContact CG1-CG 3.96Å; V27-M64 HydrophobicContact CG1-SD 4.19Å; V27-M64 HydrophobicContact CG2-CE 4.48Å; I33-M64 HydrophobicContact CG2-CE 3.79Å; V34-M64 HydrophobicContact CG2-CE 4.3Å; V34-M64 HydrophobicContact CG2-SD 3.55Å; V34-M64 VanDerWaalsContact CG2-SD 3.55Å; I60-M64 HydrophobicContact CG1-CG 3.98Å; I60-M64 WeakPolarHBondContact O-CB 3.49Å; I60-M64 WeakPolarHBondContact O-CG 3.1Å; I60-M64 PolarHBondContact O-N 3Å; M64-S66 VanDerWaalsContact C-N 3.28Å; M64-S66 PolarHBondContact O-N 2.67Å; M64-L67 HydrophobicContact CE-CD2 4.36Å; M64-L67 PolarHBondContact O-N 2.77Å; M64-L67 HydrophobicContact SD-CD2 4.37Å; M64-L68 VanDerWaalsContact O-CB 3.31Å; M64-L68 WeakPolarHBondContact O-CB 3.47Å; M64-L68 WeakPolarHBondContact O-CD1 3.24Å; M64-L68 WeakPolarHBondContact O-CG 3.48Å; M64-L68 PolarHBondContact O-N 2.76Å
65	Y	96.5	Very high	94.9	Very high	89 Å²	89	51.7 Å²	51.7	35%	0.349	28%	0.276	S	S	.	.	H	α-helix	trans	-60.8	-37.1	174.4	-172.2	-83.8	0	0	0	112.4	R20 H61 K62 A63 S69	R20-Y65 HydrophobicContact CG-CD2 3.71Å; R20-Y65 HydrophobicContact CG-CE2 3.78Å; R20-Y65 HydrophobicContact CG-CG 4.3Å; R20-Y65 VanDerWaalsContact CZ-CZ 3.45Å; R20-Y65 PolarHBondContact NH2-OH 2.99Å; R20-Y65 VanDerWaalsContact NH2-OH 3.14Å; H61-Y65 WeakPolarHBondContact O-CB 3.11Å; H61-Y65 PolarHBondContact O-N 3.13Å; K62-Y65 PolarHBondContact O-N 2.77Å; A63-Y65 PolarHBondContact O-N 2.88Å; Y65-S69 WeakPolarHBondContact O-CB 3.33Å; Y65-S69 PolarHBondContact O-N 2.91Å; Y65-S69 PolarHBondContact O-OG 3.3Å
66	S	96.2	Very high	94.6	Very high	36 Å²	36	55.7 Å²	55.7	25%	0.252	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-48	174.9	-57.8	0	0	0	0	111.1	K54 K62 A63 M64 S69 W70	K54-S66 PolarHBondContact NZ-OG 2.94Å; K62-S66 WeakPolarHBondContact O-CB 3.43Å; K62-S66 PolarHBondContact O-N 3.07Å; K62-S66 PolarHBondContact O-OG 3.36Å; A63-S66 WeakPolarHBondContact O-CB 3.42Å; A63-S66 PolarHBondContact O-N 3.14Å; A63-S66 VanDerWaalsContact O-N 3.12Å; M64-S66 VanDerWaalsContact C-N 3.28Å; M64-S66 PolarHBondContact O-N 2.67Å; S66-S69 WeakPolarHBondContact O-CB 3.22Å; S66-S69 PolarHBondContact O-N 3.13Å; S66-S69 VanDerWaalsContact O-N 3.16Å; S66-W70 PolarHBondContact O-N 2.99Å
67	L	96.2	Very high	94.4	Very high	6 Å²	6	53.3 Å²	53.3	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-45.4	177.5	-178.1	61.7	0	0	0	112.3	V34 L37 I43 T51 A63 M64 S69 W70 L71	V34-L67 HydrophobicContact CG1-CD2 4.06Å; V34-L67 HydrophobicContact CG2-CD2 3.96Å; L37-L67 HydrophobicContact CD1-CD2 4.4Å; I43-L67 HydrophobicContact CG2-CD1 3.98Å; T51-L67 HydrophobicContact CG2-CB 4.39Å; T51-L67 HydrophobicContact CG2-CD2 4.22Å; A63-L67 PolarHBondContact O-N 3.36Å; M64-L67 HydrophobicContact CE-CD2 4.36Å; M64-L67 PolarHBondContact O-N 2.77Å; M64-L67 HydrophobicContact SD-CD2 4.37Å; L67-S69 VanDerWaalsContact C-N 3.28Å; L67-S69 PolarHBondContact O-N 2.69Å; L67-W70 HydrophobicContact CD1-CE3 4.46Å; L67-W70 PolarHBondContact O-N 3.06Å; L67-L71 HydrophobicContact CG-CD1 4.27Å; L67-L71 WeakPolarHBondContact O-CB 3.47Å; L67-L71 WeakPolarHBondContact O-CG 3.47Å; L67-L71 PolarHBondContact O-N 3.2Å
68	L	95.9	Very high	94.3	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-65.3	-32.1	175.9	-66	165.2	0	0	0	111.7	L16 R20 I23 A24 M64 L71 I72 F82	L16-L68 HydrophobicContact CD1-CD2 3.99Å; R20-L68 HydrophobicContact CG-CB 3.95Å; R20-L68 HydrophobicContact CG-CD1 4.48Å; R20-L68 WeakPolarHBondContact O-CD1 3.39Å; I23-L68 HydrophobicContact CB-CD1 4.13Å; I23-L68 HydrophobicContact CG2-CD1 3.87Å; I23-L68 HydrophobicContact CG2-CD2 4.2Å; A24-L68 HydrophobicContact CB-CD1 4.07Å; M64-L68 VanDerWaalsContact O-CB 3.31Å; M64-L68 WeakPolarHBondContact O-CB 3.47Å; M64-L68 WeakPolarHBondContact O-CD1 3.24Å; M64-L68 WeakPolarHBondContact O-CG 3.48Å; M64-L68 PolarHBondContact O-N 2.76Å; L68-L71 HydrophobicContact CD2-CD1 4.22Å; L68-L71 PolarHBondContact O-N 2.94Å; L68-I72 WeakPolarHBondContact O-CD1 3.49Å; L68-I72 VanDerWaalsContact O-CG1 3.24Å; L68-I72 WeakPolarHBondContact O-CG1 3.46Å; L68-I72 PolarHBondContact O-N 2.74Å; L68-F82 HydrophobicContact CD2-CE1 4.38Å; L68-F82 HydrophobicContact CD2-CE2 3.84Å; L68-F82 HydrophobicContact CD2-CZ 3.5Å; L68-F82 VanDerWaalsContact CD2-CZ 3.5Å
69	S	95.4	Very high	94.1	Very high	29 Å²	29	47.1 Å²	47.1	20%	0.203	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-43.5	173.3	-59.6	0	0	0	0	111.9	R20 Y65 S66 L67 I72	R20-S69 WeakPolarHBondContact CD-OG 3.46Å; R20-S69 PolarHBondContact NH1-OG 3.47Å; Y65-S69 WeakPolarHBondContact O-CB 3.33Å; Y65-S69 PolarHBondContact O-N 2.91Å; Y65-S69 PolarHBondContact O-OG 3.3Å; S66-S69 WeakPolarHBondContact O-CB 3.22Å; S66-S69 PolarHBondContact O-N 3.13Å; S66-S69 VanDerWaalsContact O-N 3.16Å; L67-S69 VanDerWaalsContact C-N 3.28Å; L67-S69 PolarHBondContact O-N 2.69Å; S69-I72 WeakPolarHBondContact O-CB 3.27Å; S69-I72 PolarHBondContact O-N 2.93Å
70	W	95.8	Very high	93.9	Very high	71 Å²	71	50.6 Å²	50.6	27%	0.269	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-42.8	172.5	175.3	84.8	0	0	0	111.9	I43 Q47 S66 L67 I72 E73 Q74	I43-W70 HydrophobicContact CG2-CE3 4.5Å; I43-W70 HydrophobicContact CG2-CZ3 3.85Å; Q47-W70 VanDerWaalsContact CD-CZ2 3.48Å; S66-W70 PolarHBondContact O-N 2.99Å; L67-W70 HydrophobicContact CD1-CE3 4.46Å; L67-W70 PolarHBondContact O-N 3.06Å; W70-I72 VanDerWaalsContact C-N 3.3Å; W70-I72 PolarHBondContact O-N 3.37Å; W70-E73 PolarHBondContact O-N 2.67Å; W70-E73 VanDerWaalsContact O-N 3.07Å; W70-Q74 HydrophobicContact CD2-CG 4.07Å; W70-Q74 VanDerWaalsContact CE2-CD 3.41Å; W70-Q74 HydrophobicContact CE3-CG 3.92Å; W70-Q74 HydrophobicContact CH2-CG 3.46Å; W70-Q74 VanDerWaalsContact CH2-CG 3.46Å; W70-Q74 HydrophobicContact CZ2-CG 3.6Å; W70-Q74 HydrophobicContact CZ3-CG 3.62Å; W70-Q74 WeakPolarHBondContact O-CG 3.48Å; W70-Q74 PolarHBondContact O-NE2 3.41Å
71	L	94.4	Very high	93.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-38.4	176.5	-80	165.3	0	0	0	112.7	L16 L37 I42 L67 L68 E73 Q74 T78 L79 F82	L16-L71 HydrophobicContact CD2-CB 4.07Å; L37-L71 HydrophobicContact CD1-CD1 4.44Å; I42-L71 HydrophobicContact CG2-CD2 4.28Å; L67-L71 HydrophobicContact CG-CD1 4.27Å; L67-L71 WeakPolarHBondContact O-CB 3.47Å; L67-L71 WeakPolarHBondContact O-CG 3.47Å; L67-L71 PolarHBondContact O-N 3.2Å; L68-L71 HydrophobicContact CD2-CD1 4.22Å; L68-L71 PolarHBondContact O-N 2.94Å; L71-E73 PolarHBondContact O-N 3.32Å; L71-Q74 WeakPolarHBondContact O-CB 3.27Å; L71-Q74 PolarHBondContact O-N 3.15Å; L71-T78 HydrophobicContact CD2-CG2 4.46Å; L71-L79 VanDerWaalsContact O-CD2 3.26Å; L71-L79 WeakPolarHBondContact O-CD2 3.14Å; L71-F82 HydrophobicContact CD1-CD2 3.44Å; L71-F82 VanDerWaalsContact CD1-CD2 3.44Å; L71-F82 HydrophobicContact CD1-CE2 3.66Å; L71-F82 HydrophobicContact CD1-CG 4.07Å; L71-F82 HydrophobicContact CD1-CZ 4.45Å; L71-F82 HydrophobicContact CD2-CB 4.27Å; L71-F82 HydrophobicContact CD2-CD2 4.39Å; L71-F82 HydrophobicContact CD2-CG 4.47Å
72	I	93.5	Very high	93.7	Very high	8 Å²	8	48.3 Å²	48.3	4%	0.041	24%	0.243	C	C	.	.	H	α-helix	trans	-58.3	-28.9	176.3	-77.1	161.2	0	0	0	112.2	R13 L16 R17 R20 L68 S69 W70	R13-I72 VanDerWaalsContact CD-O 3.27Å; R13-I72 WeakPolarHBondContact CD-O 3.39Å; R13-I72 HydrophobicContact CG-CG2 4.11Å; R13-I72 WeakPolarHBondContact CG-O 3.48Å; R13-I72 PolarHBondContact NE-O 3.3Å; L16-I72 HydrophobicContact CB-CG1 4.06Å; L16-I72 HydrophobicContact CD2-CG1 3.73Å; L16-I72 HydrophobicContact CG-CD1 4.22Å; L16-I72 HydrophobicContact CG-CG1 3.7Å; R17-I72 HydrophobicContact CB-CD1 4.48Å; R17-I72 HydrophobicContact CG-CD1 3.77Å; R17-I72 HydrophobicContact CG-CG1 4.1Å; R17-I72 HydrophobicContact CG-CG2 3.75Å; R17-I72 VanDerWaalsContact NE-CG2 3.28Å; R20-I72 HydrophobicContact CB-CD1 4.41Å; L68-I72 WeakPolarHBondContact O-CD1 3.49Å; L68-I72 VanDerWaalsContact O-CG1 3.24Å; L68-I72 WeakPolarHBondContact O-CG1 3.46Å; L68-I72 PolarHBondContact O-N 2.74Å; S69-I72 WeakPolarHBondContact O-CB 3.27Å; S69-I72 PolarHBondContact O-N 2.93Å; W70-I72 VanDerWaalsContact C-N 3.3Å; W70-I72 PolarHBondContact O-N 3.37Å
73	E	92.8	Very high	93.5	Very high	149 Å²	149	43 Å²	43	70%	0.696	22%	0.22	S	C	*	.	H	α-helix	trans	-83.2	-20.1	179.2	-61.6	-177.6	170.2	0	0	112.7	W70 L71	W70-E73 PolarHBondContact O-N 2.67Å; W70-E73 VanDerWaalsContact O-N 3.07Å; L71-E73 PolarHBondContact O-N 3.32Å
74	Q	93	Very high	93.2	Very high	48 Å²	48	45 Å²	45	22%	0.224	23%	0.234	C	C	.	.	S	Bend	trans	-72.4	169.3	-175.4	-56	-42.1	-58.8	0	0	114.4	R13 W70 L71 T78	R13-Q74 PolarHBondContact NH2-O 2.87Å; W70-Q74 HydrophobicContact CD2-CG 4.07Å; W70-Q74 VanDerWaalsContact CE2-CD 3.41Å; W70-Q74 HydrophobicContact CE3-CG 3.92Å; W70-Q74 HydrophobicContact CH2-CG 3.46Å; W70-Q74 VanDerWaalsContact CH2-CG 3.46Å; W70-Q74 HydrophobicContact CZ2-CG 3.6Å; W70-Q74 HydrophobicContact CZ3-CG 3.62Å; W70-Q74 WeakPolarHBondContact O-CG 3.48Å; W70-Q74 PolarHBondContact O-NE2 3.41Å; L71-Q74 WeakPolarHBondContact O-CB 3.27Å; L71-Q74 PolarHBondContact O-N 3.15Å; Q74-T78 HydrophobicContact CB-CG2 3.72Å; Q74-T78 HydrophobicContact CG-CG2 4.11Å
75	S	92.1	Very high	93	Very high	55 Å²	55	45 Å²	45	39%	0.385	23%	0.234	S	C	.	.			trans	-59.5	162	-177.9	82.8	0	0	0	0	113.7	S77 T78 L79	S75-S77 VanDerWaalsContact C-N 3.28Å; S75-S77 PolarHBondContact O-N 2.97Å; S75-S77 PolarHBondContact OG-N 3.08Å; S75-S77 PolarHBondContact OG-OG 2.67Å; S75-T78 PolarHBondContact O-N 2.87Å; S75-T78 PolarHBondContact OG-N 2.81Å; S75-T78 VanDerWaalsContact OG-N 3.1Å; S75-T78 PolarHBondContact OG-OG1 3.35Å; S75-L79 PolarHBondContact O-N 3.22Å
76	R	88.8	Confident	92.8	Very high	140 Å²	140	40.8 Å²	40.8	53%	0.528	22%	0.218	S	C	.	.	H	α-helix	trans	-61.5	-35.3	176.8	-177.6	174.2	170.2	105.1	0.5	112	L12 Q80	L12-R76 HydrophobicContact CD1-CG 4.5Å; R76-Q80 VanDerWaalsContact O-CB 3.26Å; R76-Q80 WeakPolarHBondContact O-CB 2.99Å; R76-Q80 PolarHBondContact O-N 3.46Å
77	S	90	Very high	92.5	Very high	85 Å²	85	39.4 Å²	39.4	59%	0.594	21%	0.208	S	C	*	.	H	α-helix	trans	-69.6	-41.8	176.2	43.1	0	0	0	0	111.8	S75 L79 Q80 A81	S75-S77 VanDerWaalsContact C-N 3.28Å; S75-S77 PolarHBondContact O-N 2.97Å; S75-S77 PolarHBondContact OG-N 3.08Å; S75-S77 PolarHBondContact OG-OG 2.67Å; S77-L79 PolarHBondContact O-N 2.71Å; S77-Q80 PolarHBondContact O-N 2.61Å; S77-A81 WeakPolarHBondContact O-CB 3.41Å; S77-A81 PolarHBondContact O-N 3.15Å
78	T	91.4	Very high	92.2	Very high	31 Å²	31	42.7 Å²	42.7	19%	0.19	22%	0.222	C	C	.	.	H	α-helix	trans	-58.6	-46.6	173.1	-44.5	0	0	0	0	111.1	I42 L71 Q74 S75 A81 F82	I42-T78 HydrophobicContact CG2-CG2 3.86Å; L71-T78 HydrophobicContact CD2-CG2 4.46Å; Q74-T78 HydrophobicContact CB-CG2 3.72Å; Q74-T78 HydrophobicContact CG-CG2 4.11Å; S75-T78 PolarHBondContact O-N 2.87Å; S75-T78 PolarHBondContact OG-N 2.81Å; S75-T78 VanDerWaalsContact OG-N 3.1Å; S75-T78 PolarHBondContact OG-OG1 3.35Å; T78-A81 PolarHBondContact O-N 2.97Å; T78-F82 PolarHBondContact O-N 2.97Å
79	L	91.6	Very high	91.8	Very high	3 Å²	3	47 Å²	47	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-43.2	175.4	-77.4	167.9	0	0	0	112.5	L12 R13 L16 L71 S75 S77 F82 W83	L12-L79 HydrophobicContact CB-CB 4.45Å; R13-L79 HydrophobicContact CB-CD1 3.84Å; R13-L79 HydrophobicContact CG-CD1 4.3Å; L16-L79 HydrophobicContact CD2-CD2 3.4Å; L16-L79 VanDerWaalsContact CD2-CD2 3.4Å; L71-L79 VanDerWaalsContact O-CD2 3.26Å; L71-L79 WeakPolarHBondContact O-CD2 3.14Å; S75-L79 PolarHBondContact O-N 3.22Å; S77-L79 PolarHBondContact O-N 2.71Å; L79-F82 WeakPolarHBondContact O-CB 3.5Å; L79-F82 PolarHBondContact O-N 3.48Å; L79-W83 PolarHBondContact O-N 3.18Å
80	Q	90.8	Very high	91.6	Very high	108 Å²	108	50.3 Å²	50.3	51%	0.505	25%	0.254	S	S	.	.	H	α-helix	trans	-65.7	-38	177.6	-176.2	173.8	-24.1	0	0	111.9	L12 R76 S77 W83 S84	L12-Q80 HydrophobicContact CD1-CB 3.82Å; L12-Q80 HydrophobicContact CD1-CG 4.41Å; R76-Q80 VanDerWaalsContact O-CB 3.26Å; R76-Q80 WeakPolarHBondContact O-CB 2.99Å; R76-Q80 PolarHBondContact O-N 3.46Å; S77-Q80 PolarHBondContact O-N 2.61Å; Q80-W83 PolarHBondContact O-N 3.42Å; Q80-S84 VanDerWaalsContact O-CB 3.23Å; Q80-S84 WeakPolarHBondContact O-CB 3.41Å; Q80-S84 PolarHBondContact O-N 2.87Å
81	A	91.3	Very high	91.3	Very high	35 Å²	35	47 Å²	47	29%	0.289	24%	0.241	S	C	.	.	H	α-helix	trans	-67.3	-38.8	174.1	0	0	0	0	0	111.9	I42 S77 T78 S84 N85	I42-A81 HydrophobicContact CD1-CB 3.71Å; I42-A81 WeakPolarHBondContact CD1-O 3.43Å; I42-A81 HydrophobicContact CG1-CB 3.77Å; S77-A81 WeakPolarHBondContact O-CB 3.41Å; S77-A81 PolarHBondContact O-N 3.15Å; T78-A81 PolarHBondContact O-N 2.97Å; A81-S84 PolarHBondContact O-N 3.1Å; A81-N85 PolarHBondContact O-N 3.05Å
82	F	94.1	Very high	91.1	Very high	2 Å²	2	47 Å²	47	1%	0.009	24%	0.241	C	C	.	.	H	α-helix	trans	-59.5	-52.4	170.6	165.2	-93.6	0	0	0	111.7	L16 L37 I42 L68 L71 T78 L79 S84 N85 L86	L16-F82 HydrophobicContact CD1-CD1 4.45Å; L16-F82 HydrophobicContact CD1-CE1 3.63Å; L16-F82 HydrophobicContact CD1-CZ 4.13Å; L16-F82 HydrophobicContact CD2-CD1 4.4Å; L16-F82 HydrophobicContact CD2-CE1 4.32Å; L37-F82 HydrophobicContact CD1-CD2 3.94Å; L37-F82 HydrophobicContact CD1-CE2 4.26Å; L37-F82 HydrophobicContact CD2-CB 4.35Å; L37-F82 HydrophobicContact CD2-CD2 3.83Å; I42-F82 HydrophobicContact CG2-CB 4.34Å; L68-F82 HydrophobicContact CD2-CE1 4.38Å; L68-F82 HydrophobicContact CD2-CE2 3.84Å; L68-F82 HydrophobicContact CD2-CZ 3.5Å; L68-F82 VanDerWaalsContact CD2-CZ 3.5Å; L71-F82 HydrophobicContact CD1-CD2 3.44Å; L71-F82 VanDerWaalsContact CD1-CD2 3.44Å; L71-F82 HydrophobicContact CD1-CE2 3.66Å; L71-F82 HydrophobicContact CD1-CG 4.07Å; L71-F82 HydrophobicContact CD1-CZ 4.45Å; L71-F82 HydrophobicContact CD2-CB 4.27Å; L71-F82 HydrophobicContact CD2-CD2 4.39Å; L71-F82 HydrophobicContact CD2-CG 4.47Å; T78-F82 PolarHBondContact O-N 2.97Å; L79-F82 WeakPolarHBondContact O-CB 3.5Å; L79-F82 PolarHBondContact O-N 3.48Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 3.48Å; F82-N85 CarbonylContact O-C 3.55Å; F82-N85 WeakPolarHBondContact O-CA 3.3Å; F82-N85 WeakPolarHBondContact O-CB 3.3Å; F82-N85 PolarHBondContact O-N 2.83Å; F82-L86 HydrophobicContact CE1-CB 4.48Å; F82-L86 HydrophobicContact CE1-CD2 3.95Å; F82-L86 HydrophobicContact CE2-CD1 4.34Å; F82-L86 HydrophobicContact CZ-CB 4.37Å; F82-L86 HydrophobicContact CZ-CD1 4Å; F82-L86 HydrophobicContact CZ-CD2 3.88Å; F82-L86 HydrophobicContact CZ-CG 4.32Å; F82-L86 WeakPolarHBondContact O-CB 3.49Å; F82-L86 PolarHBondContact O-N 3.42Å
83	W	91.6	Very high	90.9	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-37.1	179.3	-75.3	114.7	0	0	0	112.4	F7 L12 L15 L16 L19 I23 L79 Q80 N85 L86 S87 L102	F7-W83 HydrophobicContact CD1-CE3 4.47Å; F7-W83 HydrophobicContact CD2-CB 4.32Å; F7-W83 HydrophobicContact CE1-CD2 4.49Å; F7-W83 AromaticContact CE1-CE3 3.91Å; F7-W83 HydrophobicContact CE1-CE3 3.91Å; F7-W83 HydrophobicContact CE1-CZ3 4.09Å; F7-W83 HydrophobicContact CE2-CE3 4.31Å; F7-W83 AromaticContact CZ-CE3 3.81Å; F7-W83 HydrophobicContact CZ-CE3 3.81Å; F7-W83 HydrophobicContact CZ-CZ3 4.21Å; L12-W83 HydrophobicContact CD2-CG 4.45Å; L12-W83 PolarHBondContact O-NE1 3.43Å; L12-W83 VanDerWaalsContact O-NE1 3.15Å; L15-W83 HydrophobicContact CB-CZ2 4.24Å; L15-W83 HydrophobicContact CD2-CH2 4.2Å; L15-W83 HydrophobicContact CD2-CZ2 4.11Å; L15-W83 HydrophobicContact CG-CH2 4.12Å; L15-W83 HydrophobicContact CG-CZ2 4.01Å; L16-W83 HydrophobicContact CB-CZ2 3.77Å; L16-W83 HydrophobicContact CD1-CH2 4.18Å; L16-W83 HydrophobicContact CD1-CZ2 3.81Å; L16-W83 HydrophobicContact CG-CZ2 4.37Å; L19-W83 HydrophobicContact CD1-CH2 4.1Å; I23-W83 HydrophobicContact CD1-CH2 3.83Å; I23-W83 HydrophobicContact CD1-CZ3 4.17Å; L79-W83 PolarHBondContact O-N 3.18Å; Q80-W83 PolarHBondContact O-N 3.42Å; W83-N85 VanDerWaalsContact C-N 3.29Å; W83-N85 PolarHBondContact O-N 2.88Å; W83-L86 HydrophobicContact CE3-CD2 3.73Å; W83-L86 HydrophobicContact CZ3-CD2 3.56Å; W83-L86 PolarHBondContact O-N 2.85Å; W83-S87 WeakPolarHBondContact O-CB 3.38Å; W83-S87 PolarHBondContact O-N 3.21Å; W83-S87 VanDerWaalsContact O-N 3.08Å; W83-S87 PolarHBondContact O-OG 3.05Å; W83-L102 HydrophobicContact CZ3-CD2 4.18Å
84	S	90.6	Very high	90.8	Very high	43 Å²	43	47.3 Å²	47.3	30%	0.301	25%	0.253	S	S	.	.	H	α-helix	trans	-65.9	-27.2	171.2	179.1	0	0	0	0	113.1	Q80 A81 F82	Q80-S84 VanDerWaalsContact O-CB 3.23Å; Q80-S84 WeakPolarHBondContact O-CB 3.41Å; Q80-S84 PolarHBondContact O-N 2.87Å; A81-S84 PolarHBondContact O-N 3.1Å; F82-S84 VanDerWaalsContact C-N 3.3Å; F82-S84 PolarHBondContact O-N 3.48Å
85	N	91.5	Very high	90.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-76.9	-50.2	170.4	-160.8	51.6	0	0	0	112.1	G36 L37 K40 I42 A81 F82 W83 S87 K88 Y90 N91	G36-N85 PolarHBondContact O-ND2 3.1Å; G36-N85 VanDerWaalsContact O-ND2 3.17Å; G36-N85 PolarHBondContact O-OD1 3.42Å; L37-N85 HydrophobicContact CD2-CB 3.88Å; K40-N85 HydrophobicContact CD-CB 4.39Å; K40-N85 VanDerWaalsContact CE-OD1 3.26Å; K40-N85 WeakPolarHBondContact CE-OD1 3.33Å; K40-N85 PolarHBondContact NZ-OD1 3.26Å; I42-N85 HydrophobicContact CD1-CB 4.4Å; A81-N85 PolarHBondContact O-N 3.05Å; F82-N85 CarbonylContact O-C 3.55Å; F82-N85 WeakPolarHBondContact O-CA 3.3Å; F82-N85 WeakPolarHBondContact O-CB 3.3Å; F82-N85 PolarHBondContact O-N 2.83Å; W83-N85 VanDerWaalsContact C-N 3.29Å; W83-N85 PolarHBondContact O-N 2.88Å; N85-S87 PolarHBondContact O-N 3.27Å; N85-K88 WeakPolarHBondContact O-CB 3.36Å; N85-K88 PolarHBondContact O-N 3.3Å; N85-K88 VanDerWaalsContact O-N 3.1Å; N85-Y90 PolarHBondContact OD1-OH 2.97Å; N85-N91 PolarHBondContact O-ND2 3.09Å
86	L	91.6	Very high	90.8	Very high	2 Å²	2	47 Å²	47	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-34.8	-176.1	-164.9	74.5	0	0	0	112.2	I23 I33 F82 W83 M92 L98	I23-L86 HydrophobicContact CD1-CD2 4.14Å; I23-L86 HydrophobicContact CG2-CD1 4.4Å; I33-L86 HydrophobicContact CD1-CD1 3.65Å; I33-L86 HydrophobicContact CG1-CD1 4.18Å; F82-L86 HydrophobicContact CE1-CB 4.48Å; F82-L86 HydrophobicContact CE1-CD2 3.95Å; F82-L86 HydrophobicContact CE2-CD1 4.34Å; F82-L86 HydrophobicContact CZ-CB 4.37Å; F82-L86 HydrophobicContact CZ-CD1 4Å; F82-L86 HydrophobicContact CZ-CD2 3.88Å; F82-L86 HydrophobicContact CZ-CG 4.32Å; F82-L86 WeakPolarHBondContact O-CB 3.49Å; F82-L86 PolarHBondContact O-N 3.42Å; W83-L86 HydrophobicContact CE3-CD2 3.73Å; W83-L86 HydrophobicContact CZ3-CD2 3.56Å; W83-L86 PolarHBondContact O-N 2.85Å; L86-M92 WeakPolarHBondContact O-CE 3.29Å; L86-L98 HydrophobicContact CD1-CD2 3.69Å; L86-L98 HydrophobicContact CD2-CD1 4.34Å; L86-L98 HydrophobicContact CG-CD2 4Å
87	S	90.3	Very high	90.9	Very high	6 Å²	6	45.2 Å²	45.2	4%	0.042	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.3	-179.6	55.3	0	0	0	0	115.4	R3 W83 N85	R3-S87 VanDerWaalsContact CD-O 3.31Å; R3-S87 WeakPolarHBondContact CD-O 3.41Å; W83-S87 WeakPolarHBondContact O-CB 3.38Å; W83-S87 PolarHBondContact O-N 3.21Å; W83-S87 VanDerWaalsContact O-N 3.08Å; W83-S87 PolarHBondContact O-OG 3.05Å; N85-S87 PolarHBondContact O-N 3.27Å
88	K	89.9	Confident	91	Very high	76 Å²	76	41.2 Å²	41.2	33%	0.33	22%	0.221	S	C	.	.	S	Bend	trans	-63.1	144.9	173.2	-77.7	-169.2	-179.1	174.7	0	111.6	N85 Y90 N91 M92	N85-K88 WeakPolarHBondContact O-CB 3.36Å; N85-K88 PolarHBondContact O-N 3.3Å; N85-K88 VanDerWaalsContact O-N 3.1Å; K88-Y90 VanDerWaalsContact C-N 3.34Å; K88-Y90 HydrophobicContact CB-CD1 4.27Å; K88-Y90 HydrophobicContact CB-CE1 4.15Å; K88-Y90 HydrophobicContact CD-CD1 4.03Å; K88-Y90 HydrophobicContact CD-CE1 3.21Å; K88-Y90 WeakPolarHBondContact CD-OH 3.48Å; K88-Y90 HydrophobicContact CG-CE1 4.37Å; K88-Y90 PolarHBondContact NZ-OH 2.95Å; K88-Y90 PolarHBondContact O-N 2.98Å; K88-N91 WeakPolarHBondContact O-CB 3.07Å; K88-N91 PolarHBondContact O-N 3.27Å; K88-N91 VanDerWaalsContact O-N 3.08Å; K88-M92 WeakPolarHBondContact O-CG 3.33Å; K88-M92 PolarHBondContact O-N 3.43Å
89	D	88.1	Confident	90.9	Very high	92 Å²	92	43.7 Å²	43.7	49%	0.492	23%	0.229	S	C	.	.	H	α-helix	trans	-61.9	-35.1	-171.7	-53.1	-73.4	0	0	0	114	R3 N91 M92 D93	R3-D89 IonicContact CZ-OD1 3.81Å; R3-D89 IonicContact NH1-OD1 3.56Å; R3-D89 PolarHBondContact NH1-OD1 3.16Å; D89-N91 VanDerWaalsContact C-N 3.35Å; D89-N91 PolarHBondContact O-N 3.14Å; D89-M92 CarbonylContact O-C 3.48Å; D89-M92 WeakPolarHBondContact O-CA 3.46Å; D89-M92 WeakPolarHBondContact O-CB 3.38Å; D89-M92 PolarHBondContact O-N 2.98Å; D89-D93 PolarHBondContact O-N 3.23Å
90	Y	89.8	Confident	90.8	Very high	98 Å²	98	46 Å²	46	38%	0.384	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-40.7	174.8	64.1	-110.5	0	0	0	113	P32 N85 K88 M92 D93 S94	P32-Y90 HydrophobicContact CB-CD2 4.38Å; N85-Y90 PolarHBondContact OD1-OH 2.97Å; K88-Y90 VanDerWaalsContact C-N 3.34Å; K88-Y90 HydrophobicContact CB-CD1 4.27Å; K88-Y90 HydrophobicContact CB-CE1 4.15Å; K88-Y90 HydrophobicContact CD-CD1 4.03Å; K88-Y90 HydrophobicContact CD-CE1 3.21Å; K88-Y90 WeakPolarHBondContact CD-OH 3.48Å; K88-Y90 HydrophobicContact CG-CE1 4.37Å; K88-Y90 PolarHBondContact NZ-OH 2.95Å; K88-Y90 PolarHBondContact O-N 2.98Å; Y90-M92 VanDerWaalsContact C-N 3.26Å; Y90-M92 PolarHBondContact O-N 3.37Å; Y90-D93 PolarHBondContact O-N 3.1Å; Y90-S94 WeakPolarHBondContact O-CB 3.39Å; Y90-S94 PolarHBondContact O-N 3.16Å; Y90-S94 PolarHBondContact O-OG 3.06Å
91	N	90	Very high	90.7	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-66.1	-33.9	174.4	-74.4	-34.3	0	0	0	110.9	P32 N85 K88 D89 D93 Y95	P32-N91 WeakPolarHBondContact CB-OD1 3.41Å; P32-N91 PolarHBondContact O-OD1 3.49Å; N85-N91 PolarHBondContact O-ND2 3.09Å; K88-N91 WeakPolarHBondContact O-CB 3.07Å; K88-N91 PolarHBondContact O-N 3.27Å; K88-N91 VanDerWaalsContact O-N 3.08Å; D89-N91 VanDerWaalsContact C-N 3.35Å; D89-N91 PolarHBondContact O-N 3.14Å; N91-D93 VanDerWaalsContact C-N 3.3Å; N91-D93 PolarHBondContact O-N 3.22Å; N91-Y95 HydrophobicContact CB-CD2 4.22Å; N91-Y95 HydrophobicContact CB-CE2 4.33Å; N91-Y95 WeakPolarHBondContact O-CB 3.5Å; N91-Y95 WeakPolarHBondContact O-CD2 3.19Å; N91-Y95 PolarHBondContact O-N 2.7Å
92	M	90.4	Very high	90.5	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-71.9	-27.8	179.7	-57.2	-76.1	85.5	0	0	112.2	R3 L86 K88 D89 Y90 L98 K99 L102	R3-M92 VanDerWaalsContact CZ-CG 3.43Å; R3-M92 PolarHBondContact NH2-SD 3.39Å; L86-M92 WeakPolarHBondContact O-CE 3.29Å; K88-M92 WeakPolarHBondContact O-CG 3.33Å; K88-M92 PolarHBondContact O-N 3.43Å; D89-M92 CarbonylContact O-C 3.48Å; D89-M92 WeakPolarHBondContact O-CA 3.46Å; D89-M92 WeakPolarHBondContact O-CB 3.38Å; D89-M92 PolarHBondContact O-N 2.98Å; Y90-M92 VanDerWaalsContact C-N 3.26Å; Y90-M92 PolarHBondContact O-N 3.37Å; M92-L98 HydrophobicContact CE-CB 4.23Å; M92-L98 HydrophobicContact CE-CD2 3.51Å; M92-L98 HydrophobicContact CE-CG 3.6Å; M92-K99 HydrophobicContact CB-CB 4.5Å; M92-K99 HydrophobicContact CB-CD 4.48Å; M92-K99 HydrophobicContact CB-CG 4.23Å; M92-K99 WeakPolarHBondContact O-CB 3.32Å; M92-K99 WeakPolarHBondContact O-CD 3.21Å; M92-L102 HydrophobicContact CE-CD1 3.79Å; M92-L102 HydrophobicContact SD-CD1 3.82Å
93	D	89.6	Confident	90.1	Very high	103 Å²	103	43 Å²	43	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-90.6	-31.9	177.7	-63.5	-26.3	0	0	0	112.2	D89 Y90 N91 K99	D89-D93 PolarHBondContact O-N 3.23Å; Y90-D93 PolarHBondContact O-N 3.1Å; N91-D93 VanDerWaalsContact C-N 3.3Å; N91-D93 PolarHBondContact O-N 3.22Å; D93-K99 IonicContact OD1-NZ 2.77Å; D93-K99 PolarHBondContact OD1-NZ 3.48Å
94	S	91.6	Very high	89.6	Confident	61 Å²	61	48 Å²	48	43%	0.427	26%	0.264	S	S	.	.	H	α-helix	trans	-65.6	-33.6	167.1	-68.3	0	0	0	0	113.3	Y90 P96	Y90-S94 WeakPolarHBondContact O-CB 3.39Å; Y90-S94 PolarHBondContact O-N 3.16Å; Y90-S94 PolarHBondContact O-OG 3.06Å; S94-P96 WeakPolarHBondContact O-CD 3.37Å
95	Y	94.2	Very high	89	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.016	26%	0.262	C	S	.	.			trans	-123.7	80.3	-175.1	-48.5	-64	0	0	0	112.5	V27 D29 P32 I33 N91 K97 L98 K99	V27-Y95 HydrophobicContact CB-CE1 4.33Å; V27-Y95 HydrophobicContact CG1-CE1 3.87Å; V27-Y95 HydrophobicContact CG2-CD1 4.43Å; V27-Y95 HydrophobicContact CG2-CE1 4.41Å; D29-Y95 WeakPolarHBondContact O-CE1 3.44Å; D29-Y95 VanDerWaalsContact O-CZ 3.29Å; D29-Y95 PolarHBondContact O-OH 3.07Å; P32-Y95 HydrophobicContact CB-CE2 4Å; P32-Y95 VanDerWaalsContact CD-OH 3.27Å; P32-Y95 WeakPolarHBondContact CD-OH 3.49Å; P32-Y95 HydrophobicContact CG-CE2 4.42Å; I33-Y95 HydrophobicContact CB-CE2 4.45Å; I33-Y95 HydrophobicContact CD1-CD2 3.71Å; I33-Y95 HydrophobicContact CD1-CE2 3.28Å; I33-Y95 HydrophobicContact CG1-CD2 4.39Å; I33-Y95 HydrophobicContact CG1-CE2 3.62Å; I33-Y95 PolarHBondContact N-OH 2.99Å; N91-Y95 HydrophobicContact CB-CD2 4.22Å; N91-Y95 HydrophobicContact CB-CE2 4.33Å; N91-Y95 WeakPolarHBondContact O-CB 3.5Å; N91-Y95 WeakPolarHBondContact O-CD2 3.19Å; N91-Y95 PolarHBondContact O-N 2.7Å; Y95-K97 PolarHBondContact O-N 2.05Å; Y95-L98 HydrophobicContact CD2-CD2 4.05Å; Y95-L98 HydrophobicContact CG-CD2 4.44Å; Y95-L98 WeakPolarHBondContact O-CB 3.37Å; Y95-L98 PolarHBondContact O-N 3.48Å; Y95-K99 PolarHBondContact O-N 2.85Å
96	P	90.6	Very high	87.9	Confident	92 Å²	92	52.5 Å²	52.5	60%	0.597	28%	0.284	S	S	*	.	H	α-helix	trans	-57.1	-34.1	178.9	-27.1	35.5	0	0	0	114.1	S94 K99 A100	S94-P96 WeakPolarHBondContact O-CD 3.37Å; P96-K99 WeakPolarHBondContact O-CB 3.43Å; P96-K99 PolarHBondContact O-N 3.36Å; P96-A100 PolarHBondContact O-N 3.41Å
97	K	91.3	Very high	86.5	Confident	103 Å²	103	57.1 Å²	57.1	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-57.5	-47.2	172.7	-63.9	172.3	179.7	172.6	0	111.4	M25 A26 D28 Y95 A100 L101	M25-K97 WeakPolarHBondContact O-CD 3.36Å; M25-K97 PolarHBondContact O-NZ 3.02Å; M25-K97 VanDerWaalsContact O-NZ 3.14Å; A26-K97 HydrophobicContact CB-CB 3.68Å; D28-K97 IonicContact OD1-NZ 2.71Å; D28-K97 PolarHBondContact OD1-NZ 2.6Å; D28-K97 VanDerWaalsContact OD2-CE 3.24Å; D28-K97 WeakPolarHBondContact OD2-CE 3.46Å; D28-K97 IonicContact OD2-NZ 2.67Å; D28-K97 PolarHBondContact OD2-NZ 2.99Å; Y95-K97 PolarHBondContact O-N 2.05Å; K97-A100 PolarHBondContact O-N 2.93Å; K97-L101 WeakPolarHBondContact O-CB 3.48Å; K97-L101 PolarHBondContact O-N 3.17Å
98	L	91.2	Very high	84.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-68.8	-37.4	-179.6	-174.4	64.6	0	0	0	111.5	I23 A26 I33 L86 M92 Y95 A100 L101 L102	I23-L98 HydrophobicContact CB-CD1 4.43Å; I23-L98 HydrophobicContact CG1-CD1 3.96Å; I23-L98 HydrophobicContact CG2-CD1 4.2Å; A26-L98 HydrophobicContact CB-CB 3.94Å; A26-L98 HydrophobicContact CB-CD1 4.39Å; I33-L98 HydrophobicContact CD1-CD2 4.2Å; L86-L98 HydrophobicContact CD1-CD2 3.69Å; L86-L98 HydrophobicContact CD2-CD1 4.34Å; L86-L98 HydrophobicContact CG-CD2 4Å; M92-L98 HydrophobicContact CE-CB 4.23Å; M92-L98 HydrophobicContact CE-CD2 3.51Å; M92-L98 HydrophobicContact CE-CG 3.6Å; Y95-L98 HydrophobicContact CD2-CD2 4.05Å; Y95-L98 HydrophobicContact CG-CD2 4.44Å; Y95-L98 WeakPolarHBondContact O-CB 3.37Å; Y95-L98 PolarHBondContact O-N 3.48Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 3.2Å; L98-L101 HydrophobicContact CD1-CD1 4.29Å; L98-L101 PolarHBondContact O-N 3Å; L98-L102 HydrophobicContact CD1-CD1 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.42Å; L98-L102 HydrophobicContact CG-CD1 4.32Å; L98-L102 WeakPolarHBondContact O-CB 3.44Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.05Å
99	K	89.3	Confident	82.4	Confident	84 Å²	84	67.6 Å²	67.6	37%	0.365	36%	0.364	S	S	.	.	H	α-helix	trans	-59.3	-43.2	173.4	-165.5	-178.2	-160.1	159.3	0	111.6	M92 D93 Y95 P96 A103	M92-K99 HydrophobicContact CB-CB 4.5Å; M92-K99 HydrophobicContact CB-CD 4.48Å; M92-K99 HydrophobicContact CB-CG 4.23Å; M92-K99 WeakPolarHBondContact O-CB 3.32Å; M92-K99 WeakPolarHBondContact O-CD 3.21Å; D93-K99 IonicContact OD1-NZ 2.77Å; D93-K99 PolarHBondContact OD1-NZ 3.48Å; Y95-K99 PolarHBondContact O-N 2.85Å; P96-K99 WeakPolarHBondContact O-CB 3.43Å; P96-K99 PolarHBondContact O-N 3.36Å; K99-A103 WeakPolarHBondContact O-CB 3.39Å; K99-A103 PolarHBondContact O-N 3.41Å
100	A	89.4	Confident	80.1	Confident	51 Å²	51	70.9 Å²	70.9	42%	0.421	38%	0.382	S	S	.	.	H	α-helix	trans	-69.7	-45.1	176.2	0	0	0	0	0	112.5	P96 K97 L98 L102 A103 N104	P96-A100 PolarHBondContact O-N 3.41Å; K97-A100 PolarHBondContact O-N 2.93Å; L98-A100 VanDerWaalsContact C-N 3.34Å; L98-A100 PolarHBondContact O-N 3.2Å; A100-L102 PolarHBondContact O-N 3.36Å; A100-A103 PolarHBondContact O-N 3.05Å; A100-N104 VanDerWaalsContact O-CG 3.24Å; A100-N104 PolarHBondContact O-N 3.35Å; A100-N104 PolarHBondContact O-ND2 3.22Å
101	L	88.8	Confident	77.4	Confident	25 Å²	25	70.3 Å²	70.3	13%	0.131	40%	0.397	C	S	.	.	H	α-helix	trans	-52.6	-52.3	174.2	-179	172.8	0	0	0	111.1	L19 D22 I23 A26 K97 L98 N104 L105	L19-L101 HydrophobicContact CD1-CD2 4.15Å; L19-L101 HydrophobicContact CD2-CD2 4.05Å; D22-L101 HydrophobicContact CB-CD1 3.53Å; D22-L101 HydrophobicContact CB-CG 4.4Å; I23-L101 HydrophobicContact CG1-CD1 4.09Å; A26-L101 HydrophobicContact CB-CD1 4.47Å; K97-L101 WeakPolarHBondContact O-CB 3.48Å; K97-L101 PolarHBondContact O-N 3.17Å; L98-L101 HydrophobicContact CD1-CD1 4.29Å; L98-L101 PolarHBondContact O-N 3Å; L101-N104 PolarHBondContact O-N 3.15Å; L101-L105 HydrophobicContact CD2-CD1 4.11Å; L101-L105 PolarHBondContact O-N 3.1Å
102	L	86.9	Confident	75	Confident	10 Å²	10	76.3 Å²	76.3	5%	0.052	44%	0.436	C	S	.	.	H	α-helix	trans	-70.4	-31	-179.8	-65.5	-179.7	0	0	0	112.9	F7 W83 M92 L98 A100 L105 N106	F7-L102 HydrophobicContact CE1-CD2 4.48Å; F7-L102 HydrophobicContact CZ-CD2 4.21Å; W83-L102 HydrophobicContact CZ3-CD2 4.18Å; M92-L102 HydrophobicContact CE-CD1 3.79Å; M92-L102 HydrophobicContact SD-CD1 3.82Å; L98-L102 HydrophobicContact CD1-CD1 4.47Å; L98-L102 HydrophobicContact CD1-CG 4.42Å; L98-L102 HydrophobicContact CG-CD1 4.32Å; L98-L102 WeakPolarHBondContact O-CB 3.44Å; L98-L102 WeakPolarHBondContact O-CG 3.3Å; L98-L102 PolarHBondContact O-N 3.05Å; A100-L102 PolarHBondContact O-N 3.36Å; L102-L105 HydrophobicContact CD2-CD1 3.88Å; L102-N106 PolarHBondContact O-N 3.41Å; L102-N106 PolarHBondContact O-ND2 2.86Å; L102-N106 PolarHBondContact O-OD1 3.09Å
103	A	85.7	Confident	72.4	Confident	46 Å²	46	87.5 Å²	87.5	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-64.8	-42.7	172.8	0	0	0	0	0	112	K99 A100 L105 N106 T107	K99-A103 WeakPolarHBondContact O-CB 3.39Å; K99-A103 PolarHBondContact O-N 3.41Å; A100-A103 PolarHBondContact O-N 3.05Å; A103-L105 VanDerWaalsContact C-N 3.3Å; A103-L105 PolarHBondContact O-N 2.75Å; A103-N106 WeakPolarHBondContact O-CB 3.34Å; A103-N106 PolarHBondContact O-N 3.4Å; A103-N106 VanDerWaalsContact O-N 3.09Å; A103-T107 PolarHBondContact O-N 2.94Å; A103-T107 PolarHBondContact O-OG1 2.99Å
104	N	82.2	Confident	69.8	Low	111 Å²	111	88 Å²	88	59%	0.594	49%	0.49	S	S	*	.	H	α-helix	trans	-60.6	-38.2	-179.2	-70.7	-18.8	0	0	0	112.5	A100 L101 T107 R108	A100-N104 VanDerWaalsContact O-CG 3.24Å; A100-N104 PolarHBondContact O-N 3.35Å; A100-N104 PolarHBondContact O-ND2 3.22Å; L101-N104 PolarHBondContact O-N 3.15Å; N104-T107 WeakPolarHBondContact CA-OG1 3.17Å; N104-T107 PolarHBondContact O-N 3.16Å; N104-T107 PolarHBondContact O-OG1 3.39Å; N104-R108 PolarHBondContact O-N 3.18Å
105	L	77.5	Confident	67.2	Low	47 Å²	47	92.2 Å²	92.2	25%	0.246	50%	0.501	C	S	.	.	H	α-helix	trans	-60.4	-46.9	173.4	-63.8	167.4	0	0	0	111.5	L15 L19 L101 L102 A103 T107 R108	L15-L105 HydrophobicContact CD1-CD1 4.48Å; L15-L105 HydrophobicContact CD1-CD2 4.39Å; L19-L105 HydrophobicContact CD1-CD1 3.43Å; L19-L105 VanDerWaalsContact CD1-CD1 3.43Å; L19-L105 HydrophobicContact CD1-CD2 4.29Å; L19-L105 HydrophobicContact CD1-CG 4.44Å; L19-L105 HydrophobicContact CD2-CD1 4.46Å; L19-L105 HydrophobicContact CD2-CD2 4.3Å; L101-L105 HydrophobicContact CD2-CD1 4.11Å; L101-L105 PolarHBondContact O-N 3.1Å; L102-L105 HydrophobicContact CD2-CD1 3.88Å; A103-L105 VanDerWaalsContact C-N 3.3Å; A103-L105 PolarHBondContact O-N 2.75Å; L105-T107 PolarHBondContact O-N 3.24Å; L105-R108 WeakPolarHBondContact O-CB 3.39Å; L105-R108 PolarHBondContact O-N 2.92Å; L105-R108 VanDerWaalsContact O-N 3.15Å
106	N	67.8	Low	64.7	Low	90 Å²	90	98.5 Å²	98.5	48%	0.481	54%	0.539	S	S	.	.	H	α-helix	trans	-68.2	-24.5	-178.2	-57.8	-7.9	0	0	0	112.5	V6 L102 A103	V6-N106 WeakPolarHBondContact CG1-OD1 3.41Å; L102-N106 PolarHBondContact O-N 3.41Å; L102-N106 PolarHBondContact O-ND2 2.86Å; L102-N106 PolarHBondContact O-OD1 3.09Å; A103-N106 WeakPolarHBondContact O-CB 3.34Å; A103-N106 PolarHBondContact O-N 3.4Å; A103-N106 VanDerWaalsContact O-N 3.09Å
107	T	62.4	Low	62.1	Low	100 Å²	100	100.4 Å²	100.4	61%	0.613	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-7.1	175.3	53.7	0	0	0	0	114.4	A103 N104 L105 P109	A103-T107 PolarHBondContact O-N 2.94Å; A103-T107 PolarHBondContact O-OG1 2.99Å; N104-T107 WeakPolarHBondContact CA-OG1 3.17Å; N104-T107 PolarHBondContact O-N 3.16Å; N104-T107 PolarHBondContact O-OG1 3.39Å; L105-T107 PolarHBondContact O-N 3.24Å; T107-P109 WeakPolarHBondContact O-CD 3.36Å
108	R	47.1	Very low	59.3	Low	189 Å²	189	102.9 Å²	102.9	71%	0.713	56%	0.558	S	S	*	*	S	Bend	trans	-76.7	104.5	176	-170.4	-178.8	-168.8	175.3	5	108.4	N104 L105	N104-R108 PolarHBondContact O-N 3.18Å; L105-R108 WeakPolarHBondContact O-CB 3.39Å; L105-R108 PolarHBondContact O-N 2.92Å; L105-R108 VanDerWaalsContact O-N 3.15Å
109	P	45.8	Very low	56.6	Low	113 Å²	113	114.8 Å²	114.8	73%	0.734	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-70.4	144.7	-177.4	-11.1	29.5	0	0	0	109	T107 A111	T107-P109 WeakPolarHBondContact O-CD 3.36Å; P109-A111 PolarHBondContact O-N 3.44Å
110	D	40.6	Very low	53.8	Low	161 Å²	161	116.3 Å²	116.3	86%	0.861	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-53.1	124.1	170.3	-81.5	-63.8	0	0	0	110.1
111	A	33.2	Very low	51.3	Low	86 Å²	86	120 Å²	120	71%	0.711	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-57.1	133.4	167.9	0	0	0	0	0	107.9	P109 R113	P109-A111 PolarHBondContact O-N 3.44Å; A111-R113 PolarHBondContact O-N 3.48Å
112	P	40.3	Very low	48.5	Very low	125 Å²	125	122.7 Å²	122.7	81%	0.812	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-60.7	116.9	-161.3	21.7	-33.6	0	0	0	111.4	S114	P112-S114 PolarHBondContact O-N 2.8Å
113	R	35.3	Very low	45.8	Very low	236 Å²	236	126.2 Å²	126.2	89%	0.891	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-51.5	129	164.8	-77.5	-171.4	176.3	-161.3	2.2	107.9	A111 K115	A111-R113 PolarHBondContact O-N 3.48Å; R113-K115 PolarHBondContact O-N 2.91Å
114	S	34.9	Very low	43.4	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	74%	0.742	S	S	*	*			trans	-68.4	76	177.7	41.7	0	0	0	0	111.1	P112 V116	P112-S114 PolarHBondContact O-N 2.8Å; S114-V116 PolarHBondContact O-N 3.12Å
115	K	37.3	Very low	41.1	Very low	150 Å²	150	135.5 Å²	135.5	65%	0.652	76%	0.758	S	S	*	*			trans	-70.4	97.2	175	-161.9	-176.8	-179.8	-146.5	0	108.4	R113 E117	R113-K115 PolarHBondContact O-N 2.91Å; K115-E117 VanDerWaalsContact C-N 3.32Å; K115-E117 HydrophobicContact CD-CG 4.41Å; K115-E117 VanDerWaalsContact CD-OE2 3.32Å; K115-E117 WeakPolarHBondContact CD-OE2 3.47Å; K115-E117 WeakPolarHBondContact CE-OE1 3.41Å; K115-E117 WeakPolarHBondContact CE-OE2 3.13Å; K115-E117 HydrophobicContact CG-CG 4.23Å; K115-E117 IonicContact NZ-OE1 3.8Å; K115-E117 PolarHBondContact NZ-OE1 3.49Å; K115-E117 IonicContact NZ-OE2 2.72Å; K115-E117 PolarHBondContact NZ-OE2 2.8Å; K115-E117 PolarHBondContact O-N 2.88Å
116	V	42.3	Very low	38.8	Very low	135 Å²	135	137.5 Å²	137.5	82%	0.818	78%	0.781	S	S	*	*			trans	-71	89	175.4	-178.8	0	0	0	0	108.6	S114	S114-V116 PolarHBondContact O-N 3.12Å
117	E	34.4	Very low	37	Very low	133 Å²	133	137.9 Å²	137.9	62%	0.621	79%	0.791	S	S	*	*			trans	-111	121.2	169.3	-82.2	177.9	144.1	0	0	109.9	K115 R119	K115-E117 VanDerWaalsContact C-N 3.32Å; K115-E117 HydrophobicContact CD-CG 4.41Å; K115-E117 VanDerWaalsContact CD-OE2 3.32Å; K115-E117 WeakPolarHBondContact CD-OE2 3.47Å; K115-E117 WeakPolarHBondContact CE-OE1 3.41Å; K115-E117 WeakPolarHBondContact CE-OE2 3.13Å; K115-E117 HydrophobicContact CG-CG 4.23Å; K115-E117 IonicContact NZ-OE1 3.8Å; K115-E117 PolarHBondContact NZ-OE1 3.49Å; K115-E117 IonicContact NZ-OE2 2.72Å; K115-E117 PolarHBondContact NZ-OE2 2.8Å; K115-E117 PolarHBondContact O-N 2.88Å; E117-R119 PolarHBondContact O-N 3.07Å
118	N	33.1	Very low	35.7	Very low	155 Å²	155	141.2 Å²	141.2	83%	0.829	80%	0.799	S	S	*	*			trans	-60.4	126.5	-179	-84.9	-25.9	0	0	0	111.3
119	R	34	Very low	34.8	Very low	249 Å²	249	136.9 Å²	136.9	94%	0.94	80%	0.798	S	S	*	*			trans	-92	112	164.7	-87.3	-174.5	159.7	-166.6	-5.6	110.3	E117	E117-R119 PolarHBondContact O-N 3.07Å
120	S	31.5	Very low	34.1	Very low	117 Å²	117	141.3 Å²	141.3	82%	0.818	81%	0.805	S	S	*	*			trans	-97.5	110	165.8	-65.9	0	0	0	0	110.6
121	S	36.5	Very low	33.6	Very low	127 Å²	127	141.4 Å²	141.4	89%	0.888	80%	0.798	S	S	*	*			trans	-4.5	138.2	159.7	-49.1	0	0	0	0	120.4
122	G	30.5	Very low	33.4	Very low	83 Å²	83	148.3 Å²	148.3	86%	0.856	81%	0.806	S	S	*	*			trans	164.2	133.7	149.9	0	0	0	0	0	117.6
123	G	30.8	Very low	32.9	Very low	83 Å²	83	147.5 Å²	147.5	86%	0.856	80%	0.803	S	S	*	*			trans	97.8	93.2	147.6	0	0	0	0	0	119
124	V	34.8	Very low	32.9	Very low	141 Å²	141	143.3 Å²	143.3	86%	0.855	79%	0.793	S	S	*	*			trans	-102.1	134.5	163.2	174.4	0	0	0	0	110.1
125	K	32.6	Very low	32.6	Very low	212 Å²	212	146.6 Å²	146.6	92%	0.922	80%	0.796	S	S	*	*			trans	-176.4	170.9	140.7	-102.1	158.3	-172.5	-179.9	0	112.1
126	A	30.9	Very low	32.3	Very low	89 Å²	89	144.7 Å²	144.7	74%	0.736	79%	0.793	S	S	*	*			trans	-146.9	168.9	-159.3	0	0	0	0	0	115.1
127	S	29.5	Very low	31.7	Very low	98 Å²	98	147.6 Å²	147.6	69%	0.685	80%	0.795	S	S	*	*			trans	89.5	142.5	150	-54.6	0	0	0	0	121.6
128	H	34.8	Very low	31.4	Very low	170 Å²	170	146.8 Å²	146.8	79%	0.787	80%	0.798	S	S	*	*			trans	103.2	93.2	147.4	-62.1	-49.5	0	0	0	123
129	S	28.7	Very low	31.3	Very low	98 Å²	98	147 Å²	147	69%	0.685	79%	0.794	S	S	*	*				88.8	137.5	108.9	-59.1	0	0	0	0	122.7
130	K	30.6	Very low	31	Very low	206 Å²	206	142.3 Å²	142.3	90%	0.896	78%	0.783	S	S	*	*			trans	77.6	146.5	152.9	-95.3	165.9	-173.8	169.6	0	116.6
131	K	29.3	Very low	30.7	Very low	162 Å²	162	142 Å²	142	70%	0.704	78%	0.78	S	S	*	*			cis	-166.5	125.7	12.5	176.7	-176.1	177.8	-170.1	0	115.1
132	R	29.5	Very low	30.3	Very low	232 Å²	232	142.6 Å²	142.6	88%	0.875	77%	0.769	S	S	*	*			trans	61	165.1	156.4	-64.6	179.7	178.4	177.6	-3.4	117.9
133	S	29.4	Very low	30.1	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	77%	0.766	S	S	*	*			cis	-128.9	149.6	-1.1	40.4	0	0	0	0	109.6
134	H	36.3	Very low	29.9	Very low	148 Å²	148	153.4 Å²	153.4	69%	0.685	77%	0.768	S	S	*	*				69.4	97.1	57.9	-166.1	-64.2	0	0	0	115.8	D136	H134-D136 IonicContact CE1-OD2 2.66Å
135	E	27.8	Very low	29.7	Very low	183 Å²	183	150.8 Å²	150.8	86%	0.855	76%	0.761	S	S	*	*				-179	159.1	126.5	-95.5	-174	121.4	0	0	108.2
136	D	30.4	Very low	29.4	Very low	110 Å²	110	150.6 Å²	150.6	59%	0.588	76%	0.76	S	S	*	*				-161.9	124	-51.3	-159.4	-28	0	0	0	108.4	H134	H134-D136 IonicContact CE1-OD2 2.66Å
137	K	31.2	Very low	29.4	Very low	196 Å²	196	152.6 Å²	152.6	85%	0.852	76%	0.763	S	S	*	*			trans	172.7	99.9	148.5	-100.2	167.5	-178.5	176	0	113.8
138	V	27.2	Very low	29.4	Very low	115 Å²	115	153.2 Å²	153.2	70%	0.697	77%	0.768	S	S	*	*			trans	27.6	101	131.7	-173.3	0	0	0	0	115.9
139	Q	31	Very low	29.1	Very low	160 Å²	160	153.3 Å²	153.3	75%	0.748	77%	0.774	S	S	*	*				72.8	121.2	81.3	-81.7	-174.7	-74.1	0	0	115
140	H	27.9	Very low	29.1	Very low	151 Å²	151	151.8 Å²	151.8	70%	0.699	77%	0.774	S	S	*	*				65.7	148.5	106.3	-87.2	-118	0	0	0	114.4	E142	H140-E142 IonicContact CE1-OE2 3.47Å; H140-E142 PolarHBondContact CE1-OE2 3.2Å; H140-E142 IonicContact ND1-OE2 3.83Å; H140-E142 PolarHBondContact ND1-OE2 3.18Å
141	S	26	Very low	29.1	Very low	109 Å²	109	148.1 Å²	148.1	76%	0.762	77%	0.769	S	S	*	*			cis	-150.8	-179.6	25.2	43.3	0	0	0	0	109.8
142	E	27	Very low	29.1	Very low	141 Å²	141	147.2 Å²	147.2	66%	0.659	78%	0.777	S	S	*	*			cis	-173.6	-178.6	-32.9	-170.3	157.9	151.4	0	0	106.3	H140	H140-E142 IonicContact CE1-OE2 3.47Å; H140-E142 PolarHBondContact CE1-OE2 3.2Å; H140-E142 IonicContact ND1-OE2 3.83Å; H140-E142 PolarHBondContact ND1-OE2 3.18Å
143	Y	26	Very low	29	Very low	202 Å²	202	141.2 Å²	141.2	79%	0.792	77%	0.77	S	S	*	*			trans	-69.9	155.6	-170.4	-48.2	-86.6	0	0	0	114.9
144	H	27.2	Very low	29	Very low	190 Å²	190	146.3 Å²	146.3	88%	0.88	78%	0.779	S	S	*	*				-167	156.2	116.4	-113.2	-74.9	0	0	0	113.5
145	A	30.5	Very low	28.5	Very low	86 Å²	86	145.1 Å²	145.1	71%	0.711	78%	0.781	S	S	*	*			trans	-126.4	145.8	167.9	0	0	0	0	0	110.5
146	K	26.9	Very low	28.4	Very low	209 Å²	209	145.3 Å²	145.3	91%	0.909	78%	0.779	S	S	*	*			trans	-169	168.9	160	-113	166.3	-174.1	179	0	112.2
147	T	31.1	Very low	28.1	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	79%	0.79	S	S	*	*			trans	-109.5	145.9	-168	50.6	0	0	0	0	113.3
148	S	28.3	Very low	27.8	Very low	112 Å²	112	148 Å²	148	78%	0.783	79%	0.788	S	S	*	*			trans	177	126.3	136	54.4	0	0	0	0	113.4
149	D	28.1	Very low	27.8	Very low	172 Å²	172	153.8 Å²	153.8	92%	0.92	80%	0.797	S	S	*	*				41.9	161	128.6	-142.5	-8.8	0	0	0	122.9
150	G	28.9	Very low	27.7	Very low	66 Å²	66	152.3 Å²	152.3	68%	0.68	80%	0.799	S	S	*	*			trans	119.5	87.8	159.3	0	0	0	0	0	117.9
151	T	30.3	Very low	27.6	Very low	129 Å²	129	152.5 Å²	152.5	79%	0.791	80%	0.798	S	S	*	*			trans	-39.7	151.5	167.7	53.3	0	0	0	0	118.6
152	V	29.5	Very low	27.7	Very low	143 Å²	143	152.4 Å²	152.4	87%	0.867	80%	0.797	S	S	*	*				-171.5	148.3	113.5	142.6	0	0	0	0	112.5
153	S	28.7	Very low	27.8	Very low	105 Å²	105	153.1 Å²	153.1	73%	0.734	80%	0.8	S	S	*	*			trans	-81.8	155.9	-166.4	-40.6	0	0	0	0	116.8
154	K	28.5	Very low	28	Very low	216 Å²	216	148.8 Å²	148.8	94%	0.939	81%	0.806	S	S	*	*			trans	-155	117.9	132	-117.7	163.1	-171.8	168.7	0	113.5
155	V	26	Very low	28	Very low	122 Å²	122	143.7 Å²	143.7	74%	0.739	81%	0.806	S	S	*	*			trans	-88	147.6	173.8	173.5	0	0	0	0	109.8	L157	V155-L157 HydrophobicContact CG1-CD1 4.34Å; V155-L157 HydrophobicContact CG1-CG 4.01Å
156	K	25.1	Very low	27.9	Very low	188 Å²	188	143.9 Å²	143.9	82%	0.817	81%	0.807	S	S	*	*			trans	-138.7	107.1	162.2	-163.8	173.2	-174.9	-179.5	0	111.1
157	L	24.6	Very low	28	Very low	155 Å²	155	141.9 Å²	141.9	81%	0.812	81%	0.805	S	S	*	*			trans	-96	148.2	175.3	-74.4	164.1	0	0	0	111.2	V155	V155-L157 HydrophobicContact CG1-CD1 4.34Å; V155-L157 HydrophobicContact CG1-CG 4.01Å
158	Y	25.9	Very low	27.8	Very low	206 Å²	206	144.1 Å²	144.1	81%	0.808	81%	0.807	S	S	*	*			trans	-146	90.7	159.2	42.5	-87.3	0	0	0	106.7
159	R	25.7	Very low	27.9	Very low	238 Å²	238	146 Å²	146	90%	0.898	81%	0.807	S	S	*	*				66.4	99	87.3	-170	169.7	-168.1	145	6	112.6
160	V	29.8	Very low	28.2	Very low	128 Å²	128	143.6 Å²	143.6	78%	0.776	80%	0.801	S	S	*	*			trans	-60.6	145	164.7	176.2	0	0	0	0	110.2
161	K	25.6	Very low	28.3	Very low	156 Å²	156	146.1 Å²	146.1	68%	0.678	81%	0.808	S	S	*	*			trans	-130.9	119.6	156.6	-164.1	-168.1	-173.6	-154.6	0	108.5	E163	K161-E163 WeakPolarHBondContact CE-OE1 3.31Å; K161-E163 VanDerWaalsContact CE-OE2 3.31Å; K161-E163 WeakPolarHBondContact CE-OE2 3.2Å; K161-E163 IonicContact NZ-OE1 3.37Å; K161-E163 PolarHBondContact NZ-OE1 3.36Å; K161-E163 IonicContact NZ-OE2 2.67Å; K161-E163 PolarHBondContact NZ-OE2 3.27Å
162	S	28.1	Very low	28.1	Very low	107 Å²	107	142.8 Å²	142.8	75%	0.748	80%	0.799	S	S	*	*			trans	-109.4	134.1	169.4	41.1	0	0	0	0	108.6
163	E	28.3	Very low	28.2	Very low	155 Å²	155	143.8 Å²	143.8	72%	0.724	80%	0.8	S	S	*	*			trans	-134.8	137	171.1	-77.7	176.2	143.9	0	0	108.3	K161	K161-E163 WeakPolarHBondContact CE-OE1 3.31Å; K161-E163 VanDerWaalsContact CE-OE2 3.31Å; K161-E163 WeakPolarHBondContact CE-OE2 3.2Å; K161-E163 IonicContact NZ-OE1 3.37Å; K161-E163 PolarHBondContact NZ-OE1 3.36Å; K161-E163 IonicContact NZ-OE2 2.67Å; K161-E163 PolarHBondContact NZ-OE2 3.27Å
164	A	30.1	Very low	28.2	Very low	111 Å²	111	143.6 Å²	143.6	92%	0.917	80%	0.799	S	S	*	*			trans	-115.5	139.4	177.6	0	0	0	0	0	109.2
165	G	27.6	Very low	28.3	Very low	84 Å²	84	140.4 Å²	140.4	87%	0.866	79%	0.791	S	S	*	*			trans	-133.5	144.9	170.7	0	0	0	0	0	108.8
166	A	28.5	Very low	28.6	Very low	89 Å²	89	142.8 Å²	142.8	74%	0.736	79%	0.794	S	S	*	*			trans	-133.6	161.7	-170.4	0	0	0	0	0	112.2
167	L	28.2	Very low	28.9	Very low	167 Å²	167	139.4 Å²	139.4	87%	0.874	79%	0.789	S	S	*	*			trans	72.5	154.3	-179.5	-45.5	178.4	0	0	0	112.8
168	Q	28.4	Very low	29.2	Very low	178 Å²	178	139 Å²	139	83%	0.832	79%	0.793	S	S	*	*			cis	-148.1	159.9	19.6	-157.8	166.5	32.8	0	0	113.2
169	L	29	Very low	29.4	Very low	151 Å²	151	134.6 Å²	134.6	79%	0.791	79%	0.792	S	S	*	*			trans	-77	165.6	170.8	-96.1	139.1	0	0	0	112.4
170	P	35.5	Very low	29.7	Very low	122 Å²	122	128.9 Å²	128.9	79%	0.792	79%	0.788	S	S	*	*				-122.9	154.8	115.8	-3	23.3	0	0	0	115.4
171	S	30.3	Very low	29.9	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	79%	0.792	S	S	*	*			trans	-85.8	163.9	166.4	-162.4	0	0	0	0	109.8
172	G	27.7	Very low	30.2	Very low	59 Å²	59	127.1 Å²	127.1	61%	0.608	80%	0.796	S	S	*	*			cis	163.6	-161	1.9	0	0	0	0	0	110.5
173	N	31	Very low	30.3	Very low	165 Å²	165	130 Å²	130	88%	0.882	80%	0.797	S	S	*	*			trans	67.9	145.7	178	-70	-0.9	0	0	0	116.4
174	S	28.4	Very low	30.5	Very low	101 Å²	101	134.5 Å²	134.5	71%	0.706	81%	0.808	S	S	*	*			cis	-155.4	165.6	-13.7	-165.1	0	0	0	0	111.8
175	L	30.7	Very low	30.7	Very low	149 Å²	149	132.5 Å²	132.5	78%	0.78	80%	0.798	S	S	*	*			trans	-18.4	142.3	168.2	-57.9	167.1	0	0	0	118.6
176	Q	32.5	Very low	30.9	Very low	171 Å²	171	135.5 Å²	135.5	80%	0.799	80%	0.799	S	S	*	*				-167	160	103.2	-99.1	-56.4	-9.1	0	0	113.2
177	V	31.1	Very low	31	Very low	118 Å²	118	134.8 Å²	134.8	72%	0.715	80%	0.801	S	S	*	*			trans	-120.3	135.3	174.8	168.2	0	0	0	0	109.4
178	V	31.2	Very low	31.2	Very low	147 Å²	147	134.5 Å²	134.5	89%	0.891	80%	0.799	S	S	*	*			trans	-154.1	146.2	155.7	-99.7	0	0	0	0	110.9
179	S	29.7	Very low	31.2	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	80%	0.8	S	S	*	*			trans	-104.4	149.7	-179.2	-54.4	0	0	0	0	112.5
180	S	31.7	Very low	31.3	Very low	119 Å²	119	130 Å²	130	83%	0.832	80%	0.801	S	S	*	*			trans	-158.9	146.7	160.2	-74.8	0	0	0	0	106.9
181	S	34.3	Very low	31.2	Very low	122 Å²	122	130 Å²	130	85%	0.853	80%	0.803	S	S	*	*			cis	-136	-179.4	26.3	-76.6	0	0	0	0	114.4
182	V	32.8	Very low	31.3	Very low	124 Å²	124	130 Å²	130	75%	0.752	80%	0.803	S	S	*	*			trans	-100.9	134.1	-164.6	167.7	0	0	0	0	114
183	Q	30	Very low	31.6	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	81%	0.806	S	S	*	*			trans	20	126.9	146.4	-53.2	166.7	-10.1	0	0	120.4
184	R	32.6	Very low	31.5	Very low	249 Å²	249	129.4 Å²	129.4	94%	0.94	80%	0.802	S	S	*	*				179.2	155.9	118.2	-94.6	173.8	-154.5	109.1	-3.3	108
185	G	32.7	Very low	31.6	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	80%	0.804	S	S	*	*			cis	175.6	127	-6.2	0	0	0	0	0	108.2
186	V	31.8	Very low	31.4	Very low	146 Å²	146	127.6 Å²	127.6	89%	0.885	80%	0.802	S	S	*	*			trans	-80.6	128	-170.6	-174.5	0	0	0	0	110.8
187	G	31.5	Very low	31.4	Very low	75 Å²	75	124 Å²	124	77%	0.773	80%	0.796	S	S	*	*			trans	-125.2	117.5	172.2	0	0	0	0	0	110.7
188	L	33.3	Very low	31.3	Very low	160 Å²	160	125.8 Å²	125.8	84%	0.838	80%	0.802	S	S	*	*			trans	-93.1	137.3	174.3	-67.9	167.5	0	0	0	110.1
189	S	28.6	Very low	31.4	Very low	122 Å²	122	126.4 Å²	126.4	85%	0.853	80%	0.799	S	S	*	*				161.5	146.2	126.5	-73.2	0	0	0	0	111.6
190	S	30.5	Very low	31.9	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	80%	0.804	S	S	*	*			trans	-121.1	148	172.6	-65.3	0	0	0	0	111.5
191	S	34	Very low	31.6	Very low	122 Å²	122	131.1 Å²	131.1	85%	0.853	81%	0.805	S	S	*	*			trans	59.2	102	149	57.8	0	0	0	0	120.5
192	S	31.3	Very low	31.3	Very low	118 Å²	118	130 Å²	130	83%	0.825	80%	0.797	S	S	*	*			trans	-156.9	146.2	136.4	50.6	0	0	0	0	106.5
193	S	33.4	Very low	31.2	Very low	94 Å²	94	132.5 Å²	132.5	66%	0.657	80%	0.801	S	S	*	*			cis	171.9	151.1	-16.2	45.7	0	0	0	0	105.3
194	S	29.8	Very low	31.2	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	80%	0.796	S	S	*	*			trans	61.2	155	176	39.7	0	0	0	0	117.2
195	S	29.3	Very low	31.1	Very low	105 Å²	105	129.1 Å²	129.1	73%	0.734	80%	0.796	S	S	*	*			cis	-170.3	160.6	-16.9	48.2	0	0	0	0	112.1
196	S	28.3	Very low	31.1	Very low	107 Å²	107	135 Å²	135	75%	0.748	80%	0.802	S	S	*	*			trans	74.7	142.1	159.6	-68.6	0	0	0	0	121.5
197	S	32.1	Very low	31.3	Very low	97 Å²	97	137.8 Å²	137.8	68%	0.678	81%	0.805	S	S	*	*			trans	33.2	133.5	139	-40.5	0	0	0	0	119.9
198	D	28.5	Very low	31.1	Very low	154 Å²	154	140.3 Å²	140.3	82%	0.824	80%	0.801	S	S	*	*				-166.8	173.1	51.4	-97	-51.7	0	0	0	113.2
199	L	32.8	Very low	31	Very low	161 Å²	161	139 Å²	139	84%	0.843	79%	0.793	S	S	*	*			trans	-106.4	149.3	162.1	-70	173.5	0	0	0	110.3
200	P	40.4	Very low	30.9	Very low	135 Å²	135	141 Å²	141	88%	0.877	79%	0.789	S	S	*	*				-138.7	-165.4	116.3	37.4	-24.3	0	0	0	114
201	F	24.8	Very low	31	Very low	194 Å²	194	142.8 Å²	142.8	85%	0.851	79%	0.788	S	S	*	*			trans	-126.5	169.5	-153.4	-168.8	-100.2	0	0	0	113
202	S	29.8	Very low	30.7	Very low	98 Å²	98	146.8 Å²	146.8	69%	0.685	79%	0.79	S	S	*	*			trans	68.8	158.6	179.3	-68.3	0	0	0	0	115.5
203	Q	30.8	Very low	30.9	Very low	178 Å²	178	148.4 Å²	148.4	83%	0.832	79%	0.785	S	S	*	*			cis	-143.4	166	19.7	-165.5	168.9	-6.8	0	0	113.9
204	D	28.5	Very low	30.6	Very low	130 Å²	130	152.3 Å²	152.3	70%	0.695	79%	0.793	S	S	*	*			trans	-49.5	148.8	-178.9	-52.3	-111.8	0	0	0	117
205	K	31.8	Very low	30.7	Very low	215 Å²	215	157.3 Å²	157.3	94%	0.935	79%	0.794	S	S	*	*				-144.1	142	128.7	-114.6	164.8	-176.3	173.6	0	110.7
206	K	32.4	Very low	30.6	Very low	195 Å²	195	158.2 Å²	158.2	85%	0.848	80%	0.795	S	S	*	*			trans	-134.1	112.4	-164.8	178.4	-177.6	-176.8	176.9	0	109.2
207	E	34.5	Very low	30.9	Very low	203 Å²	203	157.6 Å²	157.6	95%	0.949	80%	0.796	S	S	*	*			trans	-146.2	159.2	171.6	-139	160.5	-144.3	0	0	109.9
208	N	29.2	Very low	30.8	Very low	128 Å²	128	160.9 Å²	160.9	68%	0.684	81%	0.805	S	S	*	*			trans	-148.7	120.5	-139.4	-177.5	57.2	0	0	0	113.3
209	I	29.3	Very low	30.9	Very low	132 Å²	132	161.1 Å²	161.1	68%	0.677	81%	0.807	S	S	*	*			trans	65.4	130	160.5	-66.4	169.4	0	0	0	113.7
210	Q	27.1	Very low	31	Very low	166 Å²	166	156.6 Å²	156.6	78%	0.776	80%	0.799	S	S	*	*			cis	-158.8	153.3	48.7	-159.7	146.7	-35.4	0	0	115.4
211	I	32.5	Very low	30.4	Very low	150 Å²	150	155.1 Å²	155.1	77%	0.769	79%	0.792	S	S	*	*			trans	-25.7	130.8	161.6	-55.7	155.4	0	0	0	115.5
212	K	27.7	Very low	31.1	Very low	207 Å²	207	153.6 Å²	153.6	90%	0.9	79%	0.791	S	S	*	*			trans	-134.9	132.3	135.2	-160	176.4	-177.2	-172.7	0	110.7
213	Q	35.9	Very low	31.7	Very low	151 Å²	151	158.1 Å²	158.1	71%	0.706	79%	0.793	S	S	*	*			trans	-86.4	130.7	179.9	174.1	-174.7	3	0	0	110.1
214	E	26.2	Very low	32.2	Very low	176 Å²	176	158.7 Å²	158.7	82%	0.822	79%	0.792	S	S	*	*			trans	-137.4	131	168.1	-169.5	148.6	-140.4	0	0	110.5	T216	E214-T216 HydrophobicContact CG-CG2 4.38Å
215	R	33.3	Very low	32.7	Very low	222 Å²	222	154.8 Å²	154.8	84%	0.838	78%	0.775	S	S	*	*			trans	-108	97.7	174.8	-78.4	177.5	169.9	162.5	-5.5	108
216	T	27.6	Very low	33.8	Very low	124 Å²	124	148.2 Å²	148.2	76%	0.761	75%	0.749	S	S	*	*			trans	-89.9	106.9	167.8	45.3	0	0	0	0	109.9	E214	E214-T216 HydrophobicContact CG-CG2 4.38Å
217	A	33.1	Very low	34.4	Very low	94 Å²	94	145.3 Å²	145.3	78%	0.777	74%	0.737	S	S	*	*			trans	-85.3	134.5	164.7	0	0	0	0	0	109.6
218	L	31.6	Very low	34.5	Very low	165 Å²	165	139.4 Å²	139.4	86%	0.864	73%	0.73	S	S	*	*			trans	-133.4	93.3	162.3	-66.8	172.1	0	0	0	103.8
219	D	28.8	Very low	35	Very low	160 Å²	160	137.6 Å²	137.6	86%	0.856	73%	0.733	S	S	*	*				72.4	136.1	75.9	-164.2	26.5	0	0	0	112.6
220	G	35.4	Very low	35.1	Very low	66 Å²	66	140.7 Å²	140.7	68%	0.68	74%	0.744	S	S	*	*			trans	-92.4	122.8	-155.7	0	0	0	0	0	114.1
221	S	28.7	Very low	35.3	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	74%	0.739	S	S	*	*			trans	-95.2	117.8	166.1	-170.4	0	0	0	0	110.6	R223	S221-R223 PolarHBondContact O-N 3.04Å
222	I	39.1	Very low	35.2	Very low	162 Å²	162	138.5 Å²	138.5	83%	0.831	75%	0.745	S	S	*	*			trans	-71.3	97.2	177.4	-59.6	174.3	0	0	0	108.6
223	R	41.5	Very low	35.6	Very low	193 Å²	193	134.3 Å²	134.3	73%	0.728	74%	0.739	S	S	*	*			trans	-68.3	146.9	172.5	-69.8	-172.9	-81.3	-110.3	5.8	110.1	S221	S221-R223 PolarHBondContact O-N 3.04Å
224	K	41.6	Very low	35.1	Very low	190 Å²	190	132.9 Å²	132.9	83%	0.826	75%	0.746	S	S	*	*			trans	-139.6	94	-156.9	-160	175.6	-171.4	178.9	0	111.5	I226	K224-I226 PolarHBondContact O-N 3.02Å
225	C	40.3	Very low	35.2	Very low	49 Å²	49	134.7 Å²	134.7	33%	0.331	75%	0.747	S	S	.	*			trans	-62.8	133.2	179.1	-55.9	0	0	0	0	111.3	K227	C225-K227 PolarHBondContact O-N 3.46Å
226	I	53.7	Low	35	Very low	77 Å²	77	129.6 Å²	129.6	40%	0.395	75%	0.745	S	S	.	*			trans	-83.7	101.9	-177	-55.6	177.5	0	0	0	109	K224 E278 I301	K224-I226 PolarHBondContact O-N 3.02Å; I226-E278 HydrophobicContact CD1-CG 3.89Å; I226-E278 VanDerWaalsContact CD1-OE1 3.31Å; I226-E278 WeakPolarHBondContact CD1-OE1 3.5Å; I226-I301 HydrophobicContact CB-CD1 4.42Å; I226-I301 HydrophobicContact CD1-CD1 4.33Å; I226-I301 HydrophobicContact CG2-CD1 3.75Å
227	K	45.3	Very low	35.1	Very low	134 Å²	134	132 Å²	132	58%	0.583	75%	0.752	S	S	*	*			trans	-96.5	121.7	165.5	-68.3	-171.6	175.7	-173.3	0	109.1	C225 A229	C225-K227 PolarHBondContact O-N 3.46Å; K227-A229 PolarHBondContact O-N 2.94Å
228	G	36.9	Very low	35	Very low	78 Å²	78	131.4 Å²	131.4	80%	0.804	75%	0.748	S	S	*	*			trans	-68.9	112.6	166.4	0	0	0	0	0	109.4
229	A	40	Very low	34.9	Very low	90 Å²	90	132.2 Å²	132.2	74%	0.744	75%	0.747	S	S	*	*			trans	-151.5	140.5	-179.3	0	0	0	0	0	111.2	K227	K227-A229 PolarHBondContact O-N 2.94Å
230	E	30.4	Very low	34.9	Very low	197 Å²	197	134.1 Å²	134.1	92%	0.921	75%	0.747	S	S	*	*			trans	-92.9	152.2	173.3	-61.7	178.3	-141.3	0	0	109.6
231	G	32	Very low	34.5	Very low	64 Å²	64	135.4 Å²	135.4	66%	0.66	75%	0.746	S	S	*	*			trans	-68.3	175.5	-168.5	0	0	0	0	0	115.2
232	F	29.3	Very low	34.5	Very low	207 Å²	207	139 Å²	139	91%	0.908	75%	0.751	S	S	*	*			cis	-154.2	-163	21.1	-74.9	-99.6	0	0	0	109.8
233	P	36.5	Very low	33.9	Very low	118 Å²	118	138 Å²	138	77%	0.766	74%	0.743	S	S	*	*				-118.8	157	-74	36.3	-22.9	0	0	0	112.4
234	S	27	Very low	33.3	Very low	122 Å²	122	136.7 Å²	136.7	85%	0.853	74%	0.743	S	S	*	*			trans	-92.2	141.8	169.6	-174.5	0	0	0	0	111.4
235	Y	26.8	Very low	32.9	Very low	214 Å²	214	132.6 Å²	132.6	84%	0.839	74%	0.738	S	S	*	*			trans	-109.1	142.6	162.2	69.1	-88.4	0	0	0	109.2
236	S	30.3	Very low	32.3	Very low	115 Å²	115	139.8 Å²	139.8	80%	0.804	76%	0.763	S	S	*	*			trans	-125.5	140.1	174.9	54.2	0	0	0	0	109.9
237	L	29.1	Very low	31.2	Very low	174 Å²	174	142 Å²	142	91%	0.911	79%	0.786	S	S	*	*			trans	-148.3	157.6	166.3	-110.6	172.9	0	0	0	109.2
238	A	30.2	Very low	30.5	Very low	82 Å²	82	140.4 Å²	140.4	68%	0.678	80%	0.797	S	S	*	*			trans	-103.2	155.6	-146.1	0	0	0	0	0	116.4
239	E	30.6	Very low	30.4	Very low	181 Å²	181	141.7 Å²	141.7	85%	0.846	79%	0.794	S	S	*	*			trans	26.6	126.3	148.2	-58.7	-173.8	143.5	0	0	121.1
240	K	28.2	Very low	30	Very low	200 Å²	200	141.7 Å²	141.7	87%	0.87	79%	0.794	S	S	*	*				-166.4	126.3	117.8	-111.6	164.2	-174.4	171.7	0	116.7
241	S	28	Very low	30.3	Very low	93 Å²	93	142.6 Å²	142.6	65%	0.65	79%	0.789	S	S	*	*			trans	43.9	124.7	137.7	62.3	0	0	0	0	123.5
242	H	28	Very low	30	Very low	178 Å²	178	149.2 Å²	149.2	82%	0.824	80%	0.8	S	S	*	*			trans	91.1	132.1	133.7	-86	-120.4	0	0	0	123.6
243	E	26.9	Very low	30.3	Very low	142 Å²	142	146.2 Å²	146.2	66%	0.664	79%	0.792	S	S	*	*			trans	65.7	103.5	149.7	-65.8	-146.3	98	0	0	124.3
244	K	27.6	Very low	30	Very low	166 Å²	166	149.3 Å²	149.3	72%	0.722	80%	0.796	S	S	*	*				63.5	98	110.4	-166.6	-162.8	-100.8	147.8	0	119.4
245	S	32.8	Very low	30.7	Very low	103 Å²	103	152.4 Å²	152.4	72%	0.72	80%	0.797	S	S	*	*				157.5	137.6	122.6	-74.4	0	0	0	0	116.9
246	K	29.4	Very low	30.8	Very low	200 Å²	200	145.8 Å²	145.8	87%	0.87	79%	0.794	S	S	*	*			trans	41.6	112.4	142	-61.5	178.8	179.5	177.6	0	121.6
247	S	30.8	Very low	31.4	Very low	125 Å²	125	150.3 Å²	150.3	87%	0.874	80%	0.802	S	S	*	*				33.8	119.2	129.4	-168.3	0	0	0	0	121.3
248	A	30	Very low	31.6	Very low	99 Å²	99	146.2 Å²	146.2	82%	0.818	79%	0.793	S	S	*	*			trans	-158.5	155.6	133.8	0	0	0	0	0	111.9
249	S	35.2	Very low	32.1	Very low	106 Å²	106	150.4 Å²	150.4	74%	0.741	81%	0.805	S	S	*	*			trans	-84.6	142.5	173.2	172.3	0	0	0	0	111.6
250	A	30.5	Very low	32.2	Very low	89 Å²	89	147.6 Å²	147.6	74%	0.736	80%	0.8	S	S	*	*			trans	-114.2	118.9	156.6	0	0	0	0	0	109.1
251	R	36.4	Very low	33	Very low	217 Å²	217	145 Å²	145	82%	0.819	79%	0.794	S	S	*	*			trans	-92.1	138.8	170.2	-69.9	174	170.2	144.1	-6.8	109.1
252	F	26.8	Very low	34	Very low	203 Å²	203	146 Å²	146	89%	0.89	79%	0.791	S	S	*	*			trans	-132.1	124.6	150.3	-76.2	-76.9	0	0	0	109.6
253	I	36	Very low	34.9	Very low	144 Å²	144	144.8 Å²	144.8	74%	0.738	79%	0.789	S	S	*	*			trans	-107.6	129.7	162.2	-68.2	173	0	0	0	105.1
254	H	29.8	Very low	36.3	Very low	183 Å²	183	142.1 Å²	142.1	85%	0.847	78%	0.776	S	S	*	*			trans	-158.5	156.4	136.7	-110.4	-73.4	0	0	0	110.3
255	Q	41.4	Very low	38.5	Very low	186 Å²	186	139.2 Å²	139.2	87%	0.869	78%	0.777	S	S	*	*			trans	-82.6	144.1	-178.1	-63.8	145.8	-23.6	0	0	110.5
256	G	27.9	Very low	40.9	Very low	76 Å²	76	135.7 Å²	135.7	78%	0.784	75%	0.75	S	S	*	*			trans	165.9	134	174	0	0	0	0	0	111.1	A258	G256-A258 PolarHBondContact O-N 3.08Å
257	E	44.7	Very low	43.7	Very low	209 Å²	209	129.6 Å²	129.6	98%	0.977	73%	0.727	S	S	*	*			trans	-80.7	116.4	-177.7	-67.2	163.2	112.5	0	0	111
258	A	31.6	Very low	46.4	Very low	88 Å²	88	128.5 Å²	128.5	73%	0.727	71%	0.711	S	S	*	*			trans	-152.7	139.2	168.4	0	0	0	0	0	110.6	G256 T260	G256-A258 PolarHBondContact O-N 3.08Å; A258-T260 PolarHBondContact O-N 3.38Å
259	N	42.3	Very low	49.4	Very low	170 Å²	170	129.2 Å²	129.2	91%	0.909	70%	0.698	S	S	*	*			trans	-65	104.3	177	-85.2	-32.3	0	0	0	110.9	I261	N259-I261 PolarHBondContact O-N 2.77Å
260	T	31.3	Very low	52.1	Low	122 Å²	122	124.2 Å²	124.2	75%	0.748	66%	0.662	S	S	*	*			trans	-75	108.7	167.7	-59.1	0	0	0	0	108.5	A258 I262	A258-T260 PolarHBondContact O-N 3.38Å; T260-I262 PolarHBondContact O-N 2.69Å
261	I	44.8	Very low	54.9	Low	147 Å²	147	121 Å²	121	75%	0.754	64%	0.636	S	S	*	*			trans	-67	101.1	169.4	-61.8	174.9	0	0	0	107.3	N259 I263	N259-I261 PolarHBondContact O-N 2.77Å; I261-I263 PolarHBondContact O-N 3.04Å; I261-I263 VanDerWaalsContact O-N 3.13Å
262	I	48.8	Very low	57.5	Low	114 Å²	114	114.6 Å²	114.6	59%	0.585	62%	0.621	S	S	*	*			trans	-69.2	110.1	171	-53.6	177.5	0	0	0	106.8	T260 H264	T260-I262 PolarHBondContact O-N 2.69Å; I262-H264 WeakPolarHBondContact CG2-NE2 3.3Å; I262-H264 PolarHBondContact O-N 2.91Å
263	I	48.2	Very low	60.6	Low	152 Å²	152	107.4 Å²	107.4	78%	0.779	60%	0.595	S	S	*	*			trans	-73	81.3	171.5	-54.6	178.7	0	0	0	107.3	I261 S265	I261-I263 PolarHBondContact O-N 3.04Å; I261-I263 VanDerWaalsContact O-N 3.13Å; I263-S265 PolarHBondContact O-N 2.75Å
264	H	55.4	Low	63.1	Low	86 Å²	86	106.7 Å²	106.7	40%	0.398	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-63.4	122.2	170	-77.7	-77.8	0	0	0	109.1	I262	I262-H264 WeakPolarHBondContact CG2-NE2 3.3Å; I262-H264 PolarHBondContact O-N 2.91Å
265	S	73.6	Confident	65.8	Low	104 Å²	104	102.9 Å²	102.9	73%	0.727	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-60.4	132.9	151.6	49.6	0	0	0	0	107.9	I263 P286	I263-S265 PolarHBondContact O-N 2.75Å; S265-P286 WeakPolarHBondContact O-CB 3.27Å
266	N	83.9	Confident	68	Low	30 Å²	30	95.8 Å²	95.8	16%	0.16	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-101.8	153.5	175	-58.8	-46.9	0	0	0	109.7	C281 P286	N266-C281 HydrophobicContact CB-CB 4.27Å; N266-C281 WeakPolarHBondContact ND2-CB 3.47Å; N266-C281 PolarHBondContact ND2-SG 2.65Å; N266-P286 CarbonylContact C-O 3.56Å; N266-P286 WeakPolarHBondContact CA-O 3.4Å; N266-P286 WeakPolarHBondContact CB-O 3.43Å; N266-P286 WeakPolarHBondContact OD1-CA 3.39Å
267	D	87.6	Confident	70.9	Confident	71 Å²	71	94.9 Å²	94.9	38%	0.38	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-61.3	138.4	-178.8	-53.8	-31.6	0	0	0	110.9	E269 P286 R287 A288	D267-E269 PolarHBondContact O-N 2.83Å; D267-P286 PolarHBondContact N-O 2.83Å; D267-R287 WeakPolarHBondContact OD2-CA 3.37Å; D267-A288 WeakPolarHBondContact O-CB 3.38Å
268	D	88.8	Confident	73	Confident	102 Å²	102	90.8 Å²	90.8	55%	0.545	52%	0.521	S	S	.	.	S	Bend	trans	-80	0.5	175.2	-76	-48.4	0	0	0	113.2	G276 L279	D268-G276 WeakPolarHBondContact O-CA 3.34Å; D268-L279 WeakPolarHBondContact O-CD1 3.32Å
269	E	92.2	Very high	75.9	Confident	115 Å²	115	87 Å²	87	54%	0.537	49%	0.489	S	S	.	.	S	Bend	trans	-122.6	145.5	-176.1	-67.5	175.1	-174.1	0	0	110.7	D267 A271	D267-E269 PolarHBondContact O-N 2.83Å; E269-A271 PolarHBondContact O-N 3.06Å
270	C	92.4	Very high	78.1	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	45%	0.449	C	S	.	.	B	Isolated β-bridge	trans	-65.6	123.1	173.6	177.7	0	0	0	0	110.6	V272 K274 D275 L279 A288 H290	C270-V272 PolarHBondContact O-N 2.9Å; C270-V272 PolarHBondContact SG-N 3.24Å; C270-V272 VanDerWaalsContact SG-N 3.4Å; C270-K274 VanDerWaalsContact O-CA 3.24Å; C270-K274 WeakPolarHBondContact O-CA 3.21Å; C270-K274 PolarHBondContact O-N 2.97Å; C270-D275 VanDerWaalsContact CB-O 3.3Å; C270-D275 WeakPolarHBondContact CB-O 3.28Å; C270-D275 PolarHBondContact N-O 3.24Å; C270-L279 HydrophobicContact CB-CD2 3.72Å; C270-A288 WeakPolarHBondContact CA-O 3.35Å; C270-H290 VanDerWaalsContact CB-CE1 3.44Å; C270-H290 WeakPolarHBondContact CB-CE1 3.49Å; C270-H290 VanDerWaalsContact CB-ND1 3.3Å; C270-H290 WeakPolarHBondContact CB-ND1 3.24Å
271	A	89.8	Confident	81	Confident	23 Å²	23	74.3 Å²	74.3	19%	0.19	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-20.4	179	0	0	0	0	0	114.1	E269 K274 R287 A288 F289	E269-A271 PolarHBondContact O-N 3.06Å; A271-K274 PolarHBondContact O-NZ 2.89Å; A271-R287 HydrophobicContact CB-CB 3.99Å; A271-R287 HydrophobicContact CB-CG 3.99Å; A271-A288 PolarHBondContact N-O 3.37Å; A271-F289 HydrophobicContact CB-CD1 4.23Å; A271-F289 HydrophobicContact CB-CE1 3.75Å; A271-F289 HydrophobicContact CB-CZ 4.06Å
272	V	89.9	Confident	83.2	Confident	81 Å²	81	67.4 Å²	67.4	49%	0.491	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-62.1	179.7	178.7	0	0	0	0	112.5	C270 F289 C293	C270-V272 PolarHBondContact O-N 2.9Å; C270-V272 PolarHBondContact SG-N 3.24Å; C270-V272 VanDerWaalsContact SG-N 3.4Å; V272-F289 HydrophobicContact CG2-CD1 4.02Å; V272-F289 HydrophobicContact CG2-CE1 4.23Å; V272-C293 HydrophobicContact CB-CB 4.07Å; V272-C293 HydrophobicContact CG1-CB 4.29Å; V272-C293 HydrophobicContact CG2-CB 4.4Å
273	C	91.9	Very high	85.1	Confident	53 Å²	53	66.8 Å²	66.8	36%	0.358	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-12.4	-175.2	69.8	0	0	0	0	115.1	D275 H290	C273-D275 PolarHBondContact O-N 3.39Å; C273-D275 PolarHBondContact SG-OD2 2.79Å; C273-H290 VanDerWaalsContact SG-CE1 3.5Å
274	K	88.7	Confident	86.9	Confident	129 Å²	129	61.4 Å²	61.4	56%	0.561	36%	0.362	S	S	*	.			trans	69.8	4.4	-174.6	-48.7	-50.7	-172.6	-168.8	0	116.3	C270 A271	C270-K274 VanDerWaalsContact O-CA 3.24Å; C270-K274 WeakPolarHBondContact O-CA 3.21Å; C270-K274 PolarHBondContact O-N 2.97Å; A271-K274 PolarHBondContact O-NZ 2.89Å
275	D	87	Confident	88.5	Confident	102 Å²	102	58.1 Å²	58.1	55%	0.545	35%	0.348	S	S	.	.			trans	-82.4	144	170	-53.1	-71.5	0	0	0	111.8	C270 C273 H290	C270-D275 VanDerWaalsContact CB-O 3.3Å; C270-D275 WeakPolarHBondContact CB-O 3.28Å; C270-D275 PolarHBondContact N-O 3.24Å; C273-D275 PolarHBondContact O-N 3.39Å; C273-D275 PolarHBondContact SG-OD2 2.79Å; D275-H290 PolarHBondContact O-CE1 2.86Å; D275-H290 VanDerWaalsContact O-CE1 3.3Å
276	G	87.3	Confident	89.3	Confident	37 Å²	37	55.5 Å²	55.5	38%	0.381	33%	0.329	S	S	.	.			trans	-73.9	179.6	164.8	0	0	0	0	0	112.8	D268 H290	D268-G276 WeakPolarHBondContact O-CA 3.34Å; G276-H290 PolarHBondContact O-NE2 3.29Å
277	G	88.8	Confident	89.6	Confident	58 Å²	58	57.8 Å²	57.8	60%	0.598	34%	0.335	S	S	*	.	S	Bend	trans	142.3	-140.5	173.1	0	0	0	0	0	113.2	L279	G277-L279 PolarHBondContact O-N 2.96Å
278	E	88.4	Confident	89.9	Confident	123 Å²	123	54.4 Å²	54.4	58%	0.575	32%	0.317	S	S	*	.	S	Bend	trans	-78.5	99.8	171.1	-176.4	168.2	-159.5	0	0	109.9	I226 H290	I226-E278 HydrophobicContact CD1-CG 3.89Å; I226-E278 VanDerWaalsContact CD1-OE1 3.31Å; I226-E278 WeakPolarHBondContact CD1-OE1 3.5Å; E278-H290 PolarHBondContact O-CD2 3.07Å
279	L	92.1	Very high	90.1	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	29%	0.291	C	S	.	.			trans	-116.4	132.6	-176.1	-54.3	175.8	0	0	0	111.5	D268 C270 G277 A288 F289 H290	D268-L279 WeakPolarHBondContact O-CD1 3.32Å; C270-L279 HydrophobicContact CB-CD2 3.72Å; G277-L279 PolarHBondContact O-N 2.96Å; L279-A288 HydrophobicContact CB-CB 3.85Å; L279-A288 HydrophobicContact CD1-CB 3.95Å; L279-A288 HydrophobicContact CG-CB 4.48Å; L279-F289 CarbonylContact C-O 3.39Å; L279-F289 VanDerWaalsContact CA-O 3.26Å; L279-F289 WeakPolarHBondContact CA-O 3.36Å; L279-H290 HydrophobicContact CD2-CB 4.46Å
280	I	90.2	Very high	90.2	Very high	15 Å²	15	46 Å²	46	8%	0.077	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133.1	163.6	-172.1	170.4	0	0	0	109.8	A288 F289 L291 L294 P302 W306	I280-A288 CarbonylContact O-C 3.48Å; I280-A288 VanDerWaalsContact O-CA 3.27Å; I280-A288 WeakPolarHBondContact O-CA 3.39Å; I280-F289 HydrophobicContact CG2-CB 4.21Å; I280-F289 WeakPolarHBondContact CG2-O 3.11Å; I280-F289 PolarHBondContact N-O 3.34Å; I280-F289 PolarHBondContact O-N 2.96Å; I280-L291 HydrophobicContact CB-CD2 4.06Å; I280-L291 HydrophobicContact CD1-CD2 4.24Å; I280-L291 HydrophobicContact CG2-CD2 3.87Å; I280-L294 HydrophobicContact CG2-CD1 4.23Å; I280-P302 VanDerWaalsContact CD1-CD 3.45Å; I280-P302 HydrophobicContact CD1-CG 3.72Å; I280-W306 HydrophobicContact CD1-CB 4.04Å; I280-W306 HydrophobicContact CD1-CD2 3.78Å; I280-W306 HydrophobicContact CD1-CE3 3.86Å; I280-W306 HydrophobicContact CD1-CG 3.84Å; I280-W306 HydrophobicContact CG1-CD2 4.36Å; I280-W306 HydrophobicContact CG1-CE3 3.91Å; I280-W306 HydrophobicContact CG1-CZ3 4.44Å; I280-W306 HydrophobicContact CG2-CE3 4.27Å; I280-W306 HydrophobicContact CG2-CH2 4.33Å; I280-W306 HydrophobicContact CG2-CZ3 4.03Å
281	C	92	Very high	90	Very high	11 Å²	11	47.4 Å²	47.4	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	142.8	174	-63	0	0	0	0	111.6	N266	N266-C281 HydrophobicContact CB-CB 4.27Å; N266-C281 WeakPolarHBondContact ND2-CB 3.47Å; N266-C281 PolarHBondContact ND2-SG 2.65Å
282	C	91.2	Very high	89.9	Confident	1 Å²	1	50 Å²	50	1%	0.007	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-87.2	126.7	169.5	173.4	0	0	0	0	111.5	G284 C285 R287 F289 W306 C308 C311	C282-G284 PolarHBondContact O-N 3.36Å; C282-G284 PolarHBondContact SG-N 3.02Å; C282-G284 VanDerWaalsContact SG-N 3.38Å; C282-C285 VanDerWaalsContact SG-SG 3.69Å; C282-R287 WeakPolarHBondContact CB-O 3.31Å; C282-R287 PolarHBondContact N-O 3.44Å; C282-R287 VanDerWaalsContact N-O 3.08Å; C282-F289 HydrophobicContact CB-CE2 4.26Å; C282-W306 HydrophobicContact CB-CE3 4.3Å; C282-W306 HydrophobicContact CB-CZ3 3.86Å; C282-C308 HydrophobicContact CB-CB 4.26Å; C282-C308 PolarHBondContact SG-N 3.14Å; C282-C311 VanDerWaalsContact SG-SG 3.63Å
283	D	87.9	Confident	89.9	Confident	101 Å²	101	48.1 Å²	48.1	54%	0.54	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-15.8	178.4	-65	-47.4	0	0	0	113.7	S305 W306 Q307	D283-S305 WeakPolarHBondContact OD2-CA 3.41Å; D283-S305 WeakPolarHBondContact OD2-CB 3.47Å; D283-W306 PolarHBondContact N-O 3.35Å; D283-W306 PolarHBondContact OD2-N 3.34Å; D283-Q307 HydrophobicContact CB-CG 4.4Å
284	G	85.2	Confident	89.6	Confident	40 Å²	40	46.7 Å²	46.7	41%	0.412	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-4.6	-177.9	0	0	0	0	0	116.3	C282 C311	C282-G284 PolarHBondContact O-N 3.36Å; C282-G284 PolarHBondContact SG-N 3.02Å; C282-G284 VanDerWaalsContact SG-N 3.38Å; G284-C311 VanDerWaalsContact C-SG 3.5Å; G284-C311 PolarHBondContact O-SG 3.24Å
285	C	89.2	Confident	89.1	Confident	17 Å²	17	47 Å²	47	12%	0.115	29%	0.29	C	S	.	.	S	Bend	trans	-167.6	155.9	177.9	77.6	0	0	0	0	109.8	C282 R287	C282-C285 VanDerWaalsContact SG-SG 3.69Å; C285-R287 PolarHBondContact O-N 3.43Å
286	P	90.5	Very high	88.8	Confident	48 Å²	48	46.9 Å²	46.9	31%	0.312	30%	0.295	S	S	.	.	S	Bend	trans	-64.1	-1.5	-173.6	26.3	-36.4	0	0	0	115.9	S265 N266 D267	S265-P286 WeakPolarHBondContact O-CB 3.27Å; N266-P286 CarbonylContact C-O 3.56Å; N266-P286 WeakPolarHBondContact CA-O 3.4Å; N266-P286 WeakPolarHBondContact CB-O 3.43Å; N266-P286 WeakPolarHBondContact OD1-CA 3.39Å; D267-P286 PolarHBondContact N-O 2.83Å
287	R	91.2	Very high	88.8	Confident	78 Å²	78	49.2 Å²	49.2	29%	0.294	30%	0.303	S	S	.	.			trans	-74	138.7	-174.4	-69.9	-178.4	-113.8	126.8	1.7	113.1	D267 A271 C282 C285 F289 W310	D267-R287 WeakPolarHBondContact OD2-CA 3.37Å; A271-R287 HydrophobicContact CB-CB 3.99Å; A271-R287 HydrophobicContact CB-CG 3.99Å; C282-R287 WeakPolarHBondContact CB-O 3.31Å; C282-R287 PolarHBondContact N-O 3.44Å; C282-R287 VanDerWaalsContact N-O 3.08Å; C285-R287 PolarHBondContact O-N 3.43Å; R287-F289 HydrophobicContact CB-CE2 3.6Å; R287-F289 HydrophobicContact CB-CZ 3.69Å; R287-W310 VanDerWaalsContact NH1-CD2 3.31Å
288	A	94.1	Very high	88.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	156.6	170.3	0	0	0	0	0	111.7	D267 C270 A271 L279 I280	D267-A288 WeakPolarHBondContact O-CB 3.38Å; C270-A288 WeakPolarHBondContact CA-O 3.35Å; A271-A288 PolarHBondContact N-O 3.37Å; L279-A288 HydrophobicContact CB-CB 3.85Å; L279-A288 HydrophobicContact CD1-CB 3.95Å; L279-A288 HydrophobicContact CG-CB 4.48Å; I280-A288 CarbonylContact O-C 3.48Å; I280-A288 VanDerWaalsContact O-CA 3.27Å; I280-A288 WeakPolarHBondContact O-CA 3.39Å
289	F	92.6	Very high	88.1	Confident	1 Å²	1	50.1 Å²	50.1	0%	0.004	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	141.3	-171.1	-57.2	-94.8	0	0	0	111.4	A271 V272 L279 I280 C282 R287 L294 W306 C308 W310	A271-F289 HydrophobicContact CB-CD1 4.23Å; A271-F289 HydrophobicContact CB-CE1 3.75Å; A271-F289 HydrophobicContact CB-CZ 4.06Å; V272-F289 HydrophobicContact CG2-CD1 4.02Å; V272-F289 HydrophobicContact CG2-CE1 4.23Å; L279-F289 CarbonylContact C-O 3.39Å; L279-F289 VanDerWaalsContact CA-O 3.26Å; L279-F289 WeakPolarHBondContact CA-O 3.36Å; I280-F289 HydrophobicContact CG2-CB 4.21Å; I280-F289 WeakPolarHBondContact CG2-O 3.11Å; I280-F289 PolarHBondContact N-O 3.34Å; I280-F289 PolarHBondContact O-N 2.96Å; C282-F289 HydrophobicContact CB-CE2 4.26Å; R287-F289 HydrophobicContact CB-CE2 3.6Å; R287-F289 HydrophobicContact CB-CZ 3.69Å; F289-L294 HydrophobicContact CB-CD2 3.69Å; F289-L294 HydrophobicContact CB-CG 4.29Å; F289-L294 HydrophobicContact CD1-CD2 3.87Å; F289-L294 HydrophobicContact CD2-CD2 4.4Å; F289-L294 HydrophobicContact CG-CD2 3.74Å; F289-W306 AromaticContact CD2-CH2 3.71Å; F289-W306 HydrophobicContact CD2-CH2 3.71Å; F289-W306 AromaticContact CD2-CZ3 3.82Å; F289-W306 HydrophobicContact CD2-CZ3 3.82Å; F289-W306 HydrophobicContact CE2-CH2 4.1Å; F289-W306 HydrophobicContact CE2-CZ3 4.23Å; F289-W306 HydrophobicContact CG-CH2 4.3Å; F289-C308 HydrophobicContact CD2-CB 4.49Å; F289-C308 HydrophobicContact CE2-CB 3.63Å; F289-C308 HydrophobicContact CZ-CB 3.74Å; F289-W310 HydrophobicContact CE1-CE3 4.49Å; F289-W310 HydrophobicContact CE1-CH2 4.13Å; F289-W310 AromaticContact CE1-CZ3 3.54Å; F289-W310 HydrophobicContact CE1-CZ3 3.54Å; F289-W310 HydrophobicContact CZ-CE3 4.2Å; F289-W310 AromaticContact CZ-CZ3 3.67Å; F289-W310 HydrophobicContact CZ-CZ3 3.67Å
290	H	93.9	Very high	87.7	Confident	39 Å²	39	53.4 Å²	53.4	18%	0.181	33%	0.327	C	S	.	.			trans	-68.5	144.7	160.5	-52.6	97.2	0	0	0	109	C270 C273 D275 G276 E278 L279 A292 C293	C270-H290 VanDerWaalsContact CB-CE1 3.44Å; C270-H290 WeakPolarHBondContact CB-CE1 3.49Å; C270-H290 VanDerWaalsContact CB-ND1 3.3Å; C270-H290 WeakPolarHBondContact CB-ND1 3.24Å; C273-H290 VanDerWaalsContact SG-CE1 3.5Å; D275-H290 PolarHBondContact O-CE1 2.86Å; D275-H290 VanDerWaalsContact O-CE1 3.3Å; G276-H290 PolarHBondContact O-NE2 3.29Å; E278-H290 PolarHBondContact O-CD2 3.07Å; L279-H290 HydrophobicContact CD2-CB 4.46Å; H290-A292 PolarHBondContact O-N 3.15Å; H290-C293 HydrophobicContact CB-CB 4.24Å; H290-C293 PolarHBondContact O-N 2.83Å
291	L	88.8	Confident	87.4	Confident	30 Å²	30	56.1 Å²	56.1	16%	0.157	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-55	-35.8	176.5	-62.1	175	0	0	0	112.3	I280 C293 L298 I301	I280-L291 HydrophobicContact CB-CD2 4.06Å; I280-L291 HydrophobicContact CD1-CD2 4.24Å; I280-L291 HydrophobicContact CG2-CD2 3.87Å; L291-C293 VanDerWaalsContact C-N 3.34Å; L291-C293 PolarHBondContact O-N 3.33Å; L291-L298 HydrophobicContact CB-CB 4.13Å; L291-L298 WeakPolarHBondContact CB-O 3.12Å; L291-L298 HydrophobicContact CD2-CB 4Å; L291-L298 HydrophobicContact CD2-CD1 4.14Å; L291-L298 PolarHBondContact O-N 3.35Å; L291-I301 HydrophobicContact CD1-CG1 4.08Å
292	A	87.6	Confident	87	Confident	78 Å²	78	57.7 Å²	57.7	65%	0.645	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-72.9	-19.1	177.3	0	0	0	0	0	114.8	H290	H290-A292 PolarHBondContact O-N 3.15Å
293	C	89.1	Confident	86.2	Confident	42 Å²	42	63.9 Å²	63.9	28%	0.284	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-91.3	1.8	179.7	-70.6	0	0	0	0	113.2	V272 H290 L291	V272-C293 HydrophobicContact CB-CB 4.07Å; V272-C293 HydrophobicContact CG1-CB 4.29Å; V272-C293 HydrophobicContact CG2-CB 4.4Å; H290-C293 HydrophobicContact CB-CB 4.24Å; H290-C293 PolarHBondContact O-N 2.83Å; L291-C293 VanDerWaalsContact C-N 3.34Å; L291-C293 PolarHBondContact O-N 3.33Å
294	L	86.4	Confident	85.8	Confident	22 Å²	22	62.4 Å²	62.4	12%	0.115	40%	0.402	C	S	.	.	S	Bend	trans	-83.2	159.8	174.1	-61.6	174.6	0	0	0	110.8	I280 F289 P296 P297 L298 W306	I280-L294 HydrophobicContact CG2-CD1 4.23Å; F289-L294 HydrophobicContact CB-CD2 3.69Å; F289-L294 HydrophobicContact CB-CG 4.29Å; F289-L294 HydrophobicContact CD1-CD2 3.87Å; F289-L294 HydrophobicContact CD2-CD2 4.4Å; F289-L294 HydrophobicContact CG-CD2 3.74Å; L294-P296 VanDerWaalsContact C-C 3.5Å; L294-P296 CarbonylContact C-O 3.5Å; L294-P296 CarbonylContact O-C 3.23Å; L294-P296 VanDerWaalsContact O-C 3.23Å; L294-P297 WeakPolarHBondContact O-CA 3.36Å; L294-P297 WeakPolarHBondContact O-CD 3.34Å; L294-P297 WeakPolarHBondContact O-CG 3.31Å; L294-L298 HydrophobicContact CD1-CB 4.31Å; L294-L298 HydrophobicContact CD1-CD1 3.51Å; L294-L298 HydrophobicContact CD1-CG 3.68Å; L294-W306 HydrophobicContact CD1-CH2 4.07Å; L294-W306 HydrophobicContact CD1-CZ2 3.6Å; L294-W306 HydrophobicContact CD2-CH2 3.65Å; L294-W306 HydrophobicContact CD2-CZ2 3.7Å; L294-W306 HydrophobicContact CG-CZ2 4.31Å
295	N	78.5	Confident	85.6	Confident	136 Å²	136	65 Å²	65	73%	0.727	42%	0.415	S	S	*	.	S	Bend	trans	-125.7	110.9	175.4	-174.6	28	0	0	0	110
296	P	80.8	Confident	85.6	Confident	100 Å²	100	66.2 Å²	66.2	65%	0.649	42%	0.417	S	S	*	.	S	Bend	cis	-64.8	155.9	-8.4	30.3	-36.3	0	0	0	112.2	L294 L298	L294-P296 VanDerWaalsContact C-C 3.5Å; L294-P296 CarbonylContact C-O 3.5Å; L294-P296 CarbonylContact O-C 3.23Å; L294-P296 VanDerWaalsContact O-C 3.23Å; P296-L298 PolarHBondContact O-N 2.76Å
297	P	85.9	Confident	85.6	Confident	85 Å²	85	66.1 Å²	66.1	55%	0.552	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-59.4	135.8	173.9	-26.6	36	0	0	0	112	L294	L294-P297 WeakPolarHBondContact O-CA 3.36Å; L294-P297 WeakPolarHBondContact O-CD 3.34Å; L294-P297 WeakPolarHBondContact O-CG 3.31Å
298	L	84.9	Confident	85.4	Confident	57 Å²	57	62.4 Å²	62.4	30%	0.298	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-85.3	138.2	173.1	-65.1	-175.3	0	0	0	110.3	L291 L294 P296 P302	L291-L298 HydrophobicContact CB-CB 4.13Å; L291-L298 WeakPolarHBondContact CB-O 3.12Å; L291-L298 HydrophobicContact CD2-CB 4Å; L291-L298 HydrophobicContact CD2-CD1 4.14Å; L291-L298 PolarHBondContact O-N 3.35Å; L294-L298 HydrophobicContact CD1-CB 4.31Å; L294-L298 HydrophobicContact CD1-CD1 3.51Å; L294-L298 HydrophobicContact CD1-CG 3.68Å; P296-L298 PolarHBondContact O-N 2.76Å; L298-P302 HydrophobicContact CD1-CG 4.49Å
299	T	78.7	Confident	84.9	Confident	144 Å²	144	68.6 Å²	68.6	88%	0.883	43%	0.427	S	S	*	.	S	Bend	trans	-93.5	-10.6	177.5	50.7	0	0	0	0	113.5
300	S	82.6	Confident	84.4	Confident	76 Å²	76	75 Å²	75	53%	0.531	45%	0.451	S	S	.	.	S	Bend	trans	-153.7	163.2	178.6	59.2	0	0	0	0	111
301	I	84.1	Confident	83.9	Confident	72 Å²	72	73.9 Å²	73.9	37%	0.369	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-69	127.3	169.7	-57.3	177.4	0	0	0	108	I226 L291	I226-I301 HydrophobicContact CB-CD1 4.42Å; I226-I301 HydrophobicContact CD1-CD1 4.33Å; I226-I301 HydrophobicContact CG2-CD1 3.75Å; L291-I301 HydrophobicContact CD1-CG1 4.08Å
302	P	83.8	Confident	83.4	Confident	45 Å²	45	75.2 Å²	75.2	29%	0.292	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-71.2	144.9	177.5	30.5	-34.6	0	0	0	111.4	I280 L298 W306	I280-P302 VanDerWaalsContact CD1-CD 3.45Å; I280-P302 HydrophobicContact CD1-CG 3.72Å; L298-P302 HydrophobicContact CD1-CG 4.49Å; P302-W306 HydrophobicContact CG-CB 3.75Å; P302-W306 HydrophobicContact CG-CG 3.85Å
303	S	73.6	Confident	82.5	Confident	131 Å²	131	73.3 Å²	73.3	92%	0.916	45%	0.447	S	S	*	.	S	Bend	trans	-77.8	125.4	175.3	-55.8	0	0	0	0	111.3
304	G	79.6	Confident	80.8	Confident	69 Å²	69	77.1 Å²	77.1	71%	0.711	46%	0.464	S	S	*	.	S	Bend	trans	91.3	-158.9	-179.6	0	0	0	0	0	113.1
305	S	82.6	Confident	79.2	Confident	96 Å²	96	82.8 Å²	82.8	67%	0.671	48%	0.484	S	S	*	.			trans	-74.6	132.8	-175.1	57.6	0	0	0	0	112.5	D283	D283-S305 WeakPolarHBondContact OD2-CA 3.41Å; D283-S305 WeakPolarHBondContact OD2-CB 3.47Å
306	W	88.9	Confident	77.9	Confident	41 Å²	41	79.9 Å²	79.9	16%	0.155	47%	0.471	C	S	.	.			trans	-121.2	141.2	179.1	179.9	81.8	0	0	0	112.2	I280 C282 D283 F289 L294 P302 C308	I280-W306 HydrophobicContact CD1-CB 4.04Å; I280-W306 HydrophobicContact CD1-CD2 3.78Å; I280-W306 HydrophobicContact CD1-CE3 3.86Å; I280-W306 HydrophobicContact CD1-CG 3.84Å; I280-W306 HydrophobicContact CG1-CD2 4.36Å; I280-W306 HydrophobicContact CG1-CE3 3.91Å; I280-W306 HydrophobicContact CG1-CZ3 4.44Å; I280-W306 HydrophobicContact CG2-CE3 4.27Å; I280-W306 HydrophobicContact CG2-CH2 4.33Å; I280-W306 HydrophobicContact CG2-CZ3 4.03Å; C282-W306 HydrophobicContact CB-CE3 4.3Å; C282-W306 HydrophobicContact CB-CZ3 3.86Å; D283-W306 PolarHBondContact N-O 3.35Å; D283-W306 PolarHBondContact OD2-N 3.34Å; F289-W306 AromaticContact CD2-CH2 3.71Å; F289-W306 HydrophobicContact CD2-CH2 3.71Å; F289-W306 AromaticContact CD2-CZ3 3.82Å; F289-W306 HydrophobicContact CD2-CZ3 3.82Å; F289-W306 HydrophobicContact CE2-CH2 4.1Å; F289-W306 HydrophobicContact CE2-CZ3 4.23Å; F289-W306 HydrophobicContact CG-CH2 4.3Å; L294-W306 HydrophobicContact CD1-CH2 4.07Å; L294-W306 HydrophobicContact CD1-CZ2 3.6Å; L294-W306 HydrophobicContact CD2-CH2 3.65Å; L294-W306 HydrophobicContact CD2-CZ2 3.7Å; L294-W306 HydrophobicContact CG-CZ2 4.31Å; P302-W306 HydrophobicContact CG-CB 3.75Å; P302-W306 HydrophobicContact CG-CG 3.85Å; W306-C308 HydrophobicContact CH2-CB 3.68Å; W306-C308 HydrophobicContact CZ2-CB 4.3Å; W306-C308 HydrophobicContact CZ3-CB 4.18Å
307	Q	89.9	Confident	76.2	Confident	47 Å²	47	83.1 Å²	83.1	22%	0.22	48%	0.475	C	S	.	.			trans	-133.1	134.2	-177.9	-70.5	173.5	41.9	0	0	109.7	D283 C311 C312 R315	D283-Q307 HydrophobicContact CB-CG 4.4Å; Q307-C311 HydrophobicContact CB-CB 3.98Å; Q307-C312 PolarHBondContact O-SG 2.67Å; Q307-R315 VanDerWaalsContact OE1-CZ 3.29Å
308	C	87.8	Confident	74.1	Confident	0 Å²	0	85.6 Å²	85.6	0%	0	48%	0.479	C	S	.	.			trans	-66.5	160.4	177.3	70.7	0	0	0	0	111.9	C282 F289 W306 W310 C311 C312	C282-C308 HydrophobicContact CB-CB 4.26Å; C282-C308 PolarHBondContact SG-N 3.14Å; F289-C308 HydrophobicContact CD2-CB 4.49Å; F289-C308 HydrophobicContact CE2-CB 3.63Å; F289-C308 HydrophobicContact CZ-CB 3.74Å; W306-C308 HydrophobicContact CH2-CB 3.68Å; W306-C308 HydrophobicContact CZ2-CB 4.3Å; W306-C308 HydrophobicContact CZ3-CB 4.18Å; C308-W310 HydrophobicContact CB-CE3 3.96Å; C308-W310 HydrophobicContact CB-CZ3 4.37Å; C308-W310 PolarHBondContact O-N 3.15Å; C308-W310 VanDerWaalsContact O-N 3.1Å; C308-C311 WeakPolarHBondContact O-CA 3.46Å; C308-C311 WeakPolarHBondContact O-CB 3.44Å; C308-C311 PolarHBondContact O-N 3.43Å; C308-C311 VanDerWaalsContact SG-SG 3.66Å; C308-C312 PolarHBondContact O-N 3.47Å; C308-C312 VanDerWaalsContact O-N 3.1Å
309	E	82.1	Confident	72.1	Confident	129 Å²	129	87.8 Å²	87.8	60%	0.603	49%	0.488	S	S	*	.	H	α-helix	trans	-48.5	-42.9	-177	-172.2	-177.1	-173.1	0	0	113	C311 C312 G313	E309-C311 VanDerWaalsContact C-N 3.33Å; E309-C311 PolarHBondContact O-N 3.17Å; E309-C312 PolarHBondContact O-N 3.24Å; E309-G313 PolarHBondContact O-N 2.94Å
310	W	81.8	Confident	70.5	Confident	136 Å²	136	86.4 Å²	86.4	52%	0.515	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-35.8	176.9	-59.7	-87.4	0	0	0	114	R287 F289 C308 L314	R287-W310 VanDerWaalsContact NH1-CD2 3.31Å; F289-W310 HydrophobicContact CE1-CE3 4.49Å; F289-W310 HydrophobicContact CE1-CH2 4.13Å; F289-W310 AromaticContact CE1-CZ3 3.54Å; F289-W310 HydrophobicContact CE1-CZ3 3.54Å; F289-W310 HydrophobicContact CZ-CE3 4.2Å; F289-W310 AromaticContact CZ-CZ3 3.67Å; F289-W310 HydrophobicContact CZ-CZ3 3.67Å; C308-W310 HydrophobicContact CB-CE3 3.96Å; C308-W310 HydrophobicContact CB-CZ3 4.37Å; C308-W310 PolarHBondContact O-N 3.15Å; C308-W310 VanDerWaalsContact O-N 3.1Å; W310-L314 WeakPolarHBondContact O-CD1 3.24Å; W310-L314 WeakPolarHBondContact O-CG 3.23Å
311	C	84.9	Confident	68.8	Low	15 Å²	15	86.5 Å²	86.5	10%	0.101	48%	0.48	C	S	.	.	H	α-helix	trans	-76.4	-35.8	177.2	-68.6	0	0	0	0	111.5	C282 G284 Q307 C308 E309	C282-C311 VanDerWaalsContact SG-SG 3.63Å; G284-C311 VanDerWaalsContact C-SG 3.5Å; G284-C311 PolarHBondContact O-SG 3.24Å; Q307-C311 HydrophobicContact CB-CB 3.98Å; C308-C311 WeakPolarHBondContact O-CA 3.46Å; C308-C311 WeakPolarHBondContact O-CB 3.44Å; C308-C311 PolarHBondContact O-N 3.43Å; C308-C311 VanDerWaalsContact SG-SG 3.66Å; E309-C311 VanDerWaalsContact C-N 3.33Å; E309-C311 PolarHBondContact O-N 3.17Å
312	C	78.5	Confident	67.1	Low	58 Å²	58	89.5 Å²	89.5	39%	0.392	50%	0.496	S	S	.	.	H	α-helix	trans	-69.2	-48.1	175.4	-64.7	0	0	0	0	111.8	Q307 C308 E309 L314 R315 V316	Q307-C312 PolarHBondContact O-SG 2.67Å; C308-C312 PolarHBondContact O-N 3.47Å; C308-C312 VanDerWaalsContact O-N 3.1Å; E309-C312 PolarHBondContact O-N 3.24Å; C312-L314 PolarHBondContact O-N 3.25Å; C312-R315 WeakPolarHBondContact O-CB 3.42Å; C312-R315 PolarHBondContact O-N 3.47Å; C312-V316 PolarHBondContact O-N 3.45Å
313	G	67.3	Low	65	Low	39 Å²	39	95.4 Å²	95.4	40%	0.402	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-19.6	-177.8	0	0	0	0	0	115	E309	E309-G313 PolarHBondContact O-N 2.94Å
314	L	55.1	Low	63.6	Low	122 Å²	122	96.9 Å²	96.9	64%	0.639	52%	0.517	S	S	*	.	H	α-helix	trans	-72	-36	170.6	-76.3	168.6	0	0	0	112.3	W310 C312 Q318	W310-L314 WeakPolarHBondContact O-CD1 3.24Å; W310-L314 WeakPolarHBondContact O-CG 3.23Å; C312-L314 PolarHBondContact O-N 3.25Å; L314-Q318 PolarHBondContact O-N 2.86Å
315	R	51.7	Low	61.8	Low	140 Å²	140	99.5 Å²	99.5	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-44.4	178.9	-60.1	179.3	-174.3	-80.7	-2.5	111.4	Q307 C312 K317 Q318 E319	Q307-R315 VanDerWaalsContact OE1-CZ 3.29Å; C312-R315 WeakPolarHBondContact O-CB 3.42Å; C312-R315 PolarHBondContact O-N 3.47Å; R315-K317 PolarHBondContact O-N 3.46Å; R315-Q318 WeakPolarHBondContact O-CA 3.37Å; R315-Q318 PolarHBondContact O-N 2.96Å; R315-E319 PolarHBondContact O-N 3.16Å
316	V	51.8	Low	59.9	Low	75 Å²	75	104.1 Å²	104.1	46%	0.455	53%	0.53	S	S	.	.	H	α-helix	trans	-61.1	-30.7	-178.3	-174.8	0	0	0	0	112.8	C312 E319 N320	C312-V316 PolarHBondContact O-N 3.45Å; V316-E319 WeakPolarHBondContact CA-OE1 3.49Å; V316-N320 PolarHBondContact O-ND2 2.89Å
317	K	44	Very low	57.2	Low	169 Å²	169	108.9 Å²	108.9	74%	0.735	56%	0.563	S	S	*	*	H	α-helix	trans	-78.6	-20.4	173.9	-73.4	-177.9	176.2	177.1	0	113.9	R315	R315-K317 PolarHBondContact O-N 3.46Å
318	Q	43.1	Very low	54.5	Low	136 Å²	136	114.1 Å²	114.1	64%	0.636	59%	0.592	S	S	*	*	H	α-helix	trans	-89.6	-34	-179.1	-164.1	164.3	3.6	0	0	112.2	L314 R315 A321	L314-Q318 PolarHBondContact O-N 2.86Å; R315-Q318 WeakPolarHBondContact O-CA 3.37Å; R315-Q318 PolarHBondContact O-N 2.96Å; Q318-A321 PolarHBondContact O-N 3.14Å
319	E	43.2	Very low	52	Low	104 Å²	104	119.6 Å²	119.6	49%	0.486	63%	0.627	S	S	.	*	H	α-helix	trans	-70.7	-41	173.4	63.2	-161	-173.7	0	0	112.5	R315 V316 A321 L322 Q323	R315-E319 PolarHBondContact O-N 3.16Å; V316-E319 WeakPolarHBondContact CA-OE1 3.49Å; E319-A321 PolarHBondContact O-N 3.27Å; E319-A321 VanDerWaalsContact O-N 3.14Å; E319-L322 PolarHBondContact O-N 2.79Å; E319-Q323 PolarHBondContact O-N 2.77Å; E319-Q323 VanDerWaalsContact O-N 3.15Å
320	N	43.2	Very low	49.5	Very low	115 Å²	115	119.6 Å²	119.6	62%	0.615	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-19	172.8	-83	-85.3	0	0	0	113.6	V316	V316-N320 PolarHBondContact O-ND2 2.89Å
321	A	47.1	Very low	47.2	Very low	78 Å²	78	121.8 Å²	121.8	65%	0.645	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-9.4	173.8	0	0	0	0	0	113.6	Q318 E319	Q318-A321 PolarHBondContact O-N 3.14Å; E319-A321 PolarHBondContact O-N 3.27Å; E319-A321 VanDerWaalsContact O-N 3.14Å
322	L	48.8	Very low	44.7	Very low	134 Å²	134	126.4 Å²	126.4	70%	0.702	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.1	-10.6	-176.8	-65.1	175.2	0	0	0	113.4	E319 L324	E319-L322 PolarHBondContact O-N 2.79Å; L322-L324 VanDerWaalsContact C-N 3.32Å; L322-L324 PolarHBondContact O-N 2.84Å
323	Q	40.5	Very low	42.6	Very low	169 Å²	169	132.7 Å²	132.7	79%	0.79	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	23.9	-175.6	-148.9	162.5	23	0	0	114.8	E319	E319-Q323 PolarHBondContact O-N 2.77Å; E319-Q323 VanDerWaalsContact O-N 3.15Å
324	L	43.8	Very low	40.9	Very low	163 Å²	163	140.1 Å²	140.1	85%	0.853	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	20.7	173.2	-142.2	148.9	0	0	0	112.5	L322	L322-L324 VanDerWaalsContact C-N 3.32Å; L322-L324 PolarHBondContact O-N 2.84Å
325	V	41.6	Very low	39.6	Very low	123 Å²	123	141 Å²	141	75%	0.745	74%	0.74	S	S	*	*			trans	-134.5	77.2	174.5	-172.2	0	0	0	0	110.6
326	Q	43	Very low	38.5	Very low	194 Å²	194	139.9 Å²	139.9	91%	0.907	75%	0.754	S	S	*	*			trans	-179.1	81.5	149.3	-104.3	170.7	44.8	0	0	112.8
327	V	32.5	Very low	37.7	Very low	141 Å²	141	144.3 Å²	144.3	86%	0.855	77%	0.773	S	S	*	*			trans	-141.3	111.2	146.2	-176.8	0	0	0	0	107.7
328	L	33.7	Very low	37.1	Very low	157 Å²	157	142.7 Å²	142.7	82%	0.822	77%	0.773	S	S	*	*			trans	-119.7	114.2	168.7	-175.1	74	0	0	0	107.9	T330	L328-T330 PolarHBondContact O-N 3.44Å
329	P	34.7	Very low	36.6	Very low	115 Å²	115	142 Å²	142	75%	0.747	78%	0.778	S	S	*	*			trans	-74.3	111.7	175.8	-15.3	30.5	0	0	0	110.7	Q331	P329-Q331 PolarHBondContact O-N 2.96Å
330	T	29.2	Very low	36.1	Very low	129 Å²	129	143.5 Å²	143.5	79%	0.791	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.7	122.3	171	-42.8	0	0	0	0	109.7	L328 P332	L328-T330 PolarHBondContact O-N 3.44Å; T330-P332 WeakPolarHBondContact O-CD 3.43Å
331	Q	33.2	Very low	35.8	Very low	181 Å²	181	144.6 Å²	144.6	85%	0.846	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-76	122.7	177.2	-177.8	-179.9	4	0	0	111.2	P329	P329-Q331 PolarHBondContact O-N 2.96Å
332	P	33.3	Very low	35.4	Very low	113 Å²	113	145.8 Å²	145.8	73%	0.734	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-73.8	147.9	168.5	-14.2	31.1	0	0	0	111.5	T330	T330-P332 WeakPolarHBondContact O-CD 3.43Å
333	Q	33.2	Very low	34.7	Very low	190 Å²	190	146.8 Å²	146.8	89%	0.888	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-78.1	160.2	172.9	-71.5	-171.4	-16.5	0	0	112.4
334	Q	31.7	Very low	34.8	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-79.4	132.6	180	-64.2	170.4	-15.5	0	0	111.8
335	T	29	Very low	34.1	Very low	141 Å²	141	143.9 Å²	143.9	87%	0.865	79%	0.793	S	S	*	*			trans	-137.9	126.7	158.5	49.5	0	0	0	0	109.4
336	S	28.6	Very low	33.6	Very low	116 Å²	116	145.2 Å²	145.2	81%	0.811	80%	0.796	S	S	*	*			trans	-91.1	131.3	-172.6	53.6	0	0	0	0	113.4
337	I	33.9	Very low	33.1	Very low	168 Å²	168	140.2 Å²	140.2	86%	0.862	78%	0.782	S	S	*	*			trans	-138.4	151.5	157.4	-41.8	178.1	0	0	0	107.7
338	N	31	Very low	32.9	Very low	136 Å²	136	143 Å²	143	73%	0.727	78%	0.783	S	S	*	*			trans	-91.8	165.1	-165.4	-55.9	-67.8	0	0	0	114.5
339	T	32.9	Very low	33	Very low	121 Å²	121	145.2 Å²	145.2	74%	0.742	78%	0.782	S	S	*	*			trans	51.2	130.4	145.9	48.5	0	0	0	0	118.8
340	D	32.4	Very low	33.4	Very low	136 Å²	136	145.6 Å²	145.6	73%	0.727	79%	0.785	S	S	*	*				-160.9	165.8	53	-113.2	-48.4	0	0	0	116.5
341	N	37.9	Very low	33.5	Very low	138 Å²	138	143.8 Å²	143.8	74%	0.738	77%	0.774	S	S	*	*			trans	-31.4	144.1	176	-62.6	-71.2	0	0	0	121.9
342	S	37.9	Very low	33.6	Very low	102 Å²	102	142.5 Å²	142.5	71%	0.713	77%	0.772	S	S	*	*				153.6	125.4	111.9	63.3	0	0	0	0	114
343	I	35.4	Very low	33.4	Very low	155 Å²	155	142.5 Å²	142.5	80%	0.795	77%	0.774	S	S	*	*				68.1	120.4	100.8	-62.9	171.2	0	0	0	112.7
344	L	41.9	Very low	33.4	Very low	149 Å²	149	137.9 Å²	137.9	78%	0.78	76%	0.763	S	S	*	*			cis	-139.7	143.2	15.6	-97.5	142.2	0	0	0	113.2
345	D	29.4	Very low	33.4	Very low	123 Å²	123	133.6 Å²	133.6	66%	0.658	75%	0.754	S	S	*	*				26.6	124.8	119	-165.4	32	0	0	0	122.4
346	N	31.2	Very low	33.9	Very low	151 Å²	151	134.6 Å²	134.6	81%	0.807	75%	0.754	S	S	*	*				-155.3	144.6	112.3	-165.8	15.9	0	0	0	109.8
347	S	32.1	Very low	34.2	Very low	88 Å²	88	135.4 Å²	135.4	62%	0.615	75%	0.754	S	S	*	*			trans	-115.4	146.6	-170.5	68.8	0	0	0	0	114.5
348	F	27.3	Very low	34.2	Very low	200 Å²	200	132.3 Å²	132.3	88%	0.877	75%	0.747	S	S	*	*			trans	-147.7	102.6	158.3	-109.4	-80.3	0	0	0	111.4
349	Y	35.8	Very low	34.3	Very low	204 Å²	204	131.8 Å²	131.8	80%	0.8	75%	0.748	S	S	*	*			trans	-153.3	162.1	172.1	-92.2	-68.4	0	0	0	105	T351	Y349-T351 VanDerWaalsContact CD1-OG1 3.27Å; Y349-T351 WeakPolarHBondContact CD1-OG1 3.13Å
350	P	44.4	Very low	34.2	Very low	122 Å²	122	132.7 Å²	132.7	79%	0.792	75%	0.754	S	S	*	*			cis	-125.8	-177.8	33.4	15.9	11	0	0	0	114
351	T	31.4	Very low	34.1	Very low	92 Å²	92	130.5 Å²	130.5	56%	0.564	76%	0.755	S	S	*	*			cis	125.9	114.7	-4	-61.5	0	0	0	0	113.4	Y349	Y349-T351 VanDerWaalsContact CD1-OG1 3.27Å; Y349-T351 WeakPolarHBondContact CD1-OG1 3.13Å
352	L	34.4	Very low	33.7	Very low	154 Å²	154	129.5 Å²	129.5	81%	0.806	76%	0.759	S	S	*	*			trans	57.5	121.2	155.6	-65.9	169.5	0	0	0	122.8
353	S	30.2	Very low	33.5	Very low	112 Å²	112	130.7 Å²	130.7	78%	0.783	76%	0.761	S	S	*	*				167.4	167.4	116.7	-84.2	0	0	0	0	112.8
354	S	33.2	Very low	33.2	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	77%	0.765	S	S	*	*			cis	-177.5	158.8	-31.5	-82.6	0	0	0	0	108.9
355	S	31.9	Very low	32.6	Very low	104 Å²	104	130.1 Å²	130.1	73%	0.727	76%	0.764	S	S	*	*			trans	70.5	104.1	153.6	-57.9	0	0	0	0	123.7
356	L	38.1	Very low	32.8	Very low	163 Å²	163	129.5 Å²	129.5	85%	0.853	77%	0.769	S	S	*	*				48.4	121.8	112.6	-63.6	166.9	0	0	0	123.6
357	T	35.4	Very low	32.6	Very low	133 Å²	133	129.7 Å²	129.7	82%	0.816	77%	0.77	S	S	*	*			trans	-148.8	144.8	134.6	39.6	0	0	0	0	107.7
358	S	34.6	Very low	32.4	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	77%	0.77	S	S	*	*			cis	80.7	128.4	36.4	-64.3	0	0	0	0	113.3
359	V	31.8	Very low	32.6	Very low	125 Å²	125	127.9 Å²	127.9	76%	0.758	77%	0.768	S	S	*	*			cis	-158.8	174	7.9	-108.9	0	0	0	0	113.5
360	T	31.7	Very low	32.3	Very low	141 Å²	141	125.7 Å²	125.7	87%	0.865	77%	0.77	S	S	*	*			trans	85.1	159.8	170.9	79.1	0	0	0	0	115.6
361	A	30	Very low	31.9	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	77%	0.771	S	S	*	*			cis	-145.7	-180	7.8	0	0	0	0	0	113.6
362	S	29.9	Very low	31.8	Very low	116 Å²	116	129 Å²	129	81%	0.811	78%	0.779	S	S	*	*			trans	-83.3	150.6	176.7	-59.6	0	0	0	0	113.1
363	V	33.6	Very low	31.8	Very low	127 Å²	127	127.5 Å²	127.5	77%	0.77	78%	0.782	S	S	*	*			cis	86.1	118.9	27.5	179.7	0	0	0	0	116
364	K	28.3	Very low	31.8	Very low	202 Å²	202	126.3 Å²	126.3	88%	0.878	79%	0.787	S	S	*	*			trans	-159.3	115.2	139.6	-100.5	167.5	-177.1	177.1	0	106.7
365	A	30.2	Very low	31.7	Very low	91 Å²	91	125 Å²	125	75%	0.752	79%	0.789	S	S	*	*				76.9	133.3	69.6	0	0	0	0	0	112.2
366	S	33.2	Very low	32.2	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	80%	0.799	S	S	*	*			cis	-149.7	-173.2	3.7	57.2	0	0	0	0	109
367	N	28.1	Very low	31.9	Very low	155 Å²	155	130.2 Å²	130.2	83%	0.829	80%	0.799	S	S	*	*			cis	-162.8	-172.8	17.5	-158	-13.9	0	0	0	110.2
368	G	26.5	Very low	32.1	Very low	60 Å²	60	130.1 Å²	130.1	62%	0.619	80%	0.798	S	S	*	*			trans	119	47.1	132.9	0	0	0	0	0	121.5
369	K	31.4	Very low	32.2	Very low	189 Å²	189	129.6 Å²	129.6	82%	0.822	80%	0.8	S	S	*	*			trans	22.4	122.6	152	-61.7	177.3	179	178.2	0	119.9
370	N	30.5	Very low	33	Very low	158 Å²	158	129.6 Å²	129.6	85%	0.845	80%	0.8	S	S	*	*				-164.7	176.9	108.1	-99.2	-19	0	0	0	112
371	Q	36.4	Very low	34.3	Very low	173 Å²	173	133.6 Å²	133.6	81%	0.808	80%	0.799	S	S	*	*			trans	-123.8	168	-152.7	-56.5	177.4	72.4	0	0	115.4
372	C	27.6	Very low	36.5	Very low	110 Å²	110	134.7 Å²	134.7	74%	0.743	79%	0.789	S	S	*	*			trans	93.2	141.3	148.5	-67	0	0	0	0	121
373	S	34.4	Very low	39	Very low	123 Å²	123	132.3 Å²	132.3	86%	0.86	77%	0.769	S	S	*	*			trans	70	102.2	159.1	-56.1	0	0	0	0	117.6
374	G	31.6	Very low	41.2	Very low	87 Å²	87	126.3 Å²	126.3	90%	0.897	73%	0.733	S	S	*	*			trans	-88.4	152.2	170.4	0	0	0	0	0	113.1
375	G	30.3	Very low	43.1	Very low	66 Å²	66	118.3 Å²	118.3	68%	0.68	71%	0.708	S	S	*	*			trans	-120.5	132.3	153.7	0	0	0	0	0	107.7	M377	G375-M377 VanDerWaalsContact C-N 3.29Å; G375-M377 PolarHBondContact O-N 3.2Å
376	E	41.9	Very low	45.2	Very low	204 Å²	204	117.8 Å²	117.8	95%	0.953	70%	0.695	S	S	*	*			trans	-75.3	80.9	-176.5	-167.3	176.7	151.6	0	0	110.5	V378	E376-V378 PolarHBondContact O-N 3.26Å
377	M	32.6	Very low	47.3	Very low	173 Å²	173	114.9 Å²	114.9	85%	0.852	67%	0.674	S	S	*	*			trans	-74.4	117.9	174.1	-71.1	-162.9	70.8	0	0	109.9	G375 A379	G375-M377 VanDerWaalsContact C-N 3.29Å; G375-M377 PolarHBondContact O-N 3.2Å; M377-A379 PolarHBondContact O-N 3.37Å; M377-A379 VanDerWaalsContact O-N 3.08Å
378	V	39.1	Very low	49.4	Very low	131 Å²	131	114.1 Å²	114.1	79%	0.794	67%	0.666	S	S	*	*			trans	-48	117.1	169.1	176.2	0	0	0	0	109	E376 V380	E376-V378 PolarHBondContact O-N 3.26Å; V378-V380 VanDerWaalsContact C-N 3.35Å; V378-V380 PolarHBondContact O-N 2.9Å
379	A	38	Very low	51.8	Low	90 Å²	90	116.8 Å²	116.8	74%	0.744	67%	0.665	S	S	*	*			trans	-67.4	92.3	-179.3	0	0	0	0	0	110.1	M377 R381	M377-A379 PolarHBondContact O-N 3.37Å; M377-A379 VanDerWaalsContact O-N 3.08Å; A379-R381 PolarHBondContact O-N 2.95Å
380	V	48.6	Very low	53.9	Low	125 Å²	125	110.2 Å²	110.2	76%	0.758	65%	0.651	S	S	*	*			trans	-58.4	104.5	168.8	178.8	0	0	0	0	106.8	V378 E382	V378-V380 VanDerWaalsContact C-N 3.35Å; V378-V380 PolarHBondContact O-N 2.9Å; V380-E382 PolarHBondContact O-N 3.39Å
381	R	58.5	Low	56.2	Low	225 Å²	225	105.2 Å²	105.2	85%	0.849	64%	0.637	S	S	*	*			trans	-60.8	111.9	179.4	-74.1	-177.2	177	-116.1	1.5	108.4	A379 V383	A379-R381 PolarHBondContact O-N 2.95Å; R381-V383 PolarHBondContact O-N 2.96Å
382	E	75.9	Confident	58.1	Low	114 Å²	114	104 Å²	104	53%	0.533	64%	0.636	S	S	.	*			trans	-66.2	128.9	175.7	-54.8	-163.3	121	0	0	108.7	V380 L393 H402	V380-E382 PolarHBondContact O-N 3.39Å; E382-L393 HydrophobicContact CB-CD1 4.11Å; E382-L393 VanDerWaalsContact O-CD1 3.23Å; E382-L393 WeakPolarHBondContact O-CD1 3.3Å; E382-H402 HydrophobicContact CB-CB 4.49Å; E382-H402 IonicContact OE1-CE1 2.69Å; E382-H402 PolarHBondContact OE1-CE1 2.87Å; E382-H402 IonicContact OE1-ND1 2.76Å; E382-H402 PolarHBondContact OE1-ND1 3.27Å; E382-H402 IonicContact OE2-CE1 2.6Å; E382-H402 PolarHBondContact OE2-CE1 3Å; E382-H402 IonicContact OE2-CG 2.67Å; E382-H402 IonicContact OE2-ND1 3.58Å; E382-H402 PolarHBondContact OE2-ND1 2.86Å; E382-H402 IonicContact OE2-NE2 2.67Å
383	V	81.6	Confident	60.7	Low	66 Å²	66	100.2 Å²	100.2	40%	0.4	61%	0.608	S	S	.	*			trans	-121.3	146.5	-178	-69.1	0	0	0	0	109.5	R381 G385 H388	R381-V383 PolarHBondContact O-N 2.96Å; V383-G385 PolarHBondContact O-N 3.4Å; V383-H388 WeakPolarHBondContact CB-O 3.3Å; V383-H388 WeakPolarHBondContact CG1-O 3.39Å
384	C	80.7	Confident	62.7	Low	0 Å²	0	96.5 Å²	96.5	0%	0	58%	0.58	C	S	.	*			trans	-59.8	122.2	177.9	177	0	0	0	0	110.5	V386 C387 H388 L389 L393 H402 H404	C384-V386 PolarHBondContact O-N 3.4Å; C384-C387 VanDerWaalsContact CB-SG 3.59Å; C384-C387 PolarHBondContact O-N 2.85Å; C384-H388 VanDerWaalsContact O-CA 3.31Å; C384-H388 WeakPolarHBondContact O-CA 3.36Å; C384-H388 PolarHBondContact O-N 3.32Å; C384-L389 WeakPolarHBondContact CB-O 3.44Å; C384-L389 PolarHBondContact N-O 2.88Å; C384-L393 HydrophobicContact CB-CD2 3.67Å; C384-H402 WeakPolarHBondContact CA-O 3.09Å; C384-H404 VanDerWaalsContact CB-ND1 3.31Å; C384-H404 WeakPolarHBondContact CB-ND1 3.27Å
385	G	68.6	Low	64.8	Low	35 Å²	35	95.6 Å²	95.6	36%	0.361	55%	0.553	S	S	.	*	T	Hydrogen-bonded Turn	trans	-68.2	22.8	178	0	0	0	0	0	116	V383 H402	V383-G385 PolarHBondContact O-N 3.4Å; G385-H402 PolarHBondContact N-O 2.83Å
386	V	73.4	Confident	67	Low	79 Å²	79	92.8 Å²	92.8	48%	0.479	52%	0.522	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-49.6	176.6	174.5	0	0	0	0	110.9	C384 F403 C407	C384-V386 PolarHBondContact O-N 3.4Å; V386-F403 HydrophobicContact CG2-CD1 3.93Å; V386-F403 HydrophobicContact CG2-CE1 4.12Å; V386-C407 HydrophobicContact CB-CB 4.32Å; V386-C407 HydrophobicContact CG1-CB 4.44Å
387	C	78	Confident	68.5	Low	50 Å²	50	89.8 Å²	89.8	34%	0.338	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-2.3	-179.2	65.7	0	0	0	0	114.8	C384 L389 H404	C384-C387 VanDerWaalsContact CB-SG 3.59Å; C384-C387 PolarHBondContact O-N 2.85Å; C387-L389 PolarHBondContact O-N 3.15Å; C387-H404 PolarHBondContact SG-ND1 2.84Å; C387-H404 VanDerWaalsContact SG-ND1 3.39Å
388	H	72.6	Confident	70.3	Confident	139 Å²	139	86.7 Å²	86.7	64%	0.644	50%	0.495	S	S	*	.			trans	58.2	8.3	178.9	-59.5	-85.4	0	0	0	116.4	V383 C384	V383-H388 WeakPolarHBondContact CB-O 3.3Å; V383-H388 WeakPolarHBondContact CG1-O 3.39Å; C384-H388 VanDerWaalsContact O-CA 3.31Å; C384-H388 WeakPolarHBondContact O-CA 3.36Å; C384-H388 PolarHBondContact O-N 3.32Å
389	L	76.8	Confident	72	Confident	115 Å²	115	82.3 Å²	82.3	60%	0.602	47%	0.47	S	S	*	.			trans	-83.8	145.4	168.6	-61.2	171.3	0	0	0	110.4	C384 C387 H404	C384-L389 WeakPolarHBondContact CB-O 3.44Å; C384-L389 PolarHBondContact N-O 2.88Å; C387-L389 PolarHBondContact O-N 3.15Å; L389-H404 PolarHBondContact O-CE1 2.99Å; L389-H404 VanDerWaalsContact O-CE1 3.32Å
390	G	74.9	Confident	73.8	Confident	51 Å²	51	84.1 Å²	84.1	53%	0.526	47%	0.467	S	S	.	.			trans	-86.7	156.4	166.9	0	0	0	0	0	111.6
391	G	78.9	Confident	75.2	Confident	54 Å²	54	83.9 Å²	83.9	56%	0.557	46%	0.456	S	S	*	.	S	Bend	trans	171.7	-153.6	-176	0	0	0	0	0	111.2	L393	G391-L393 PolarHBondContact O-N 2.85Å
392	D	77.3	Confident	76.4	Confident	148 Å²	148	75 Å²	75	79%	0.791	42%	0.423	S	S	*	.	S	Bend	trans	-76.4	111.9	167.9	-178.2	21	0	0	0	109.8	H404	D392-H404 PolarHBondContact O-CD2 3.4Å; D392-H404 VanDerWaalsContact O-CD2 3.29Å
393	L	80.7	Confident	76.6	Confident	30 Å²	30	69.7 Å²	69.7	16%	0.157	40%	0.399	C	S	.	.			trans	-122	121.8	-168.8	-61.8	174.2	0	0	0	111.7	E382 C384 G391 H402 H404	E382-L393 HydrophobicContact CB-CD1 4.11Å; E382-L393 VanDerWaalsContact O-CD1 3.23Å; E382-L393 WeakPolarHBondContact O-CD1 3.3Å; C384-L393 HydrophobicContact CB-CD2 3.67Å; G391-L393 PolarHBondContact O-N 2.85Å; L393-H402 HydrophobicContact CB-CB 3.91Å; L393-H402 HydrophobicContact CD1-CB 3.92Å; L393-H402 HydrophobicContact CG-CB 4.46Å; L393-H404 HydrophobicContact CD2-CB 4.48Å; L393-H404 VanDerWaalsContact CD2-CD2 3.46Å; L393-H404 WeakPolarHBondContact CD2-CD2 3.46Å
394	T	76.5	Confident	76.7	Confident	45 Å²	45	68.2 Å²	68.2	28%	0.276	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.1	171.7	59.7	0	0	0	0	111.1	H402 F403	T394-H402 WeakPolarHBondContact O-CA 3.42Å; T394-F403 PolarHBondContact N-O 3.29Å; T394-F403 PolarHBondContact O-N 2.93Å; T394-F403 PolarHBondContact OG1-O 3.5Å
395	H	76.5	Confident	76.2	Confident	68 Å²	68	70.6 Å²	70.6	32%	0.315	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.9	176.5	173.9	-119.2	0	0	0	111.5	L397 H402 W423	H395-L397 PolarHBondContact O-N 3.01Å; H395-H402 WeakPolarHBondContact CB-NE2 3.23Å; H395-H402 AromaticContact CD2-CD2 3.98Å; H395-H402 AromaticContact CD2-CE1 3.9Å; H395-H402 AromaticContact CD2-NE2 3.26Å; H395-H402 PolarHBondContact CD2-NE2 2.83Å; H395-H402 VanDerWaalsContact CD2-NE2 3.26Å; H395-H402 AromaticContact CG-NE2 3.56Å; H395-W423 VanDerWaalsContact O-CH2 3.3Å; H395-W423 WeakPolarHBondContact O-CH2 3.05Å
396	C	76.3	Confident	76.2	Confident	6 Å²	6	76.8 Å²	76.8	4%	0.041	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	100.6	173	-172.2	0	0	0	0	111.6	Q398 C399 L400 K401 F403 C419	C396-Q398 PolarHBondContact O-N 3.36Å; C396-C399 PolarHBondContact O-N 3.39Å; C396-L400 WeakPolarHBondContact O-CA 3.36Å; C396-L400 PolarHBondContact O-N 2.79Å; C396-K401 PolarHBondContact N-O 3.3Å; C396-F403 HydrophobicContact CB-CD2 4.21Å; C396-F403 HydrophobicContact CB-CE2 3.95Å; C396-C419 VanDerWaalsContact SG-SG 3.67Å
397	L	74.2	Confident	75.9	Confident	141 Å²	141	74.6 Å²	74.6	74%	0.738	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-22.9	177.1	-63.6	170.1	0	0	0	115	H395	H395-L397 PolarHBondContact O-N 3.01Å
398	Q	69.4	Low	75.3	Confident	108 Å²	108	72.6 Å²	72.6	51%	0.505	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-25	-177.3	-169.4	65.7	82.6	0	0	114.4	C396 R421	C396-Q398 PolarHBondContact O-N 3.36Å; Q398-R421 HydrophobicContact CG-CG 4.26Å
399	C	75.4	Confident	74.4	Confident	39 Å²	39	70 Å²	70	26%	0.264	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	7	-178.6	72.4	0	0	0	0	114.4	C396 K401 C419	C396-C399 PolarHBondContact O-N 3.39Å; C399-K401 VanDerWaalsContact C-N 3.3Å; C399-K401 PolarHBondContact O-N 3.2Å; C399-C419 HydrophobicContact CB-CB 3.93Å
400	L	74.7	Confident	73.2	Confident	128 Å²	128	67.9 Å²	67.9	67%	0.67	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	44.9	173.3	-51.4	-178.3	0	0	0	113.5	C396	C396-L400 WeakPolarHBondContact O-CA 3.36Å; C396-L400 PolarHBondContact O-N 2.79Å
401	K	78.7	Confident	72.1	Confident	120 Å²	120	75.1 Å²	75.1	52%	0.522	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.5	-178.5	-77.1	-175.1	178	-170.6	0	111.8	C396 C399 F403	C396-K401 PolarHBondContact N-O 3.3Å; C399-K401 VanDerWaalsContact C-N 3.3Å; C399-K401 PolarHBondContact O-N 3.2Å; K401-F403 HydrophobicContact CB-CE1 4.44Å; K401-F403 HydrophobicContact CB-CE2 3.53Å; K401-F403 HydrophobicContact CB-CZ 3.49Å; K401-F403 VanDerWaalsContact CB-CZ 3.49Å; K401-F403 HydrophobicContact CD-CZ 4.29Å; K401-F403 WeakPolarHBondContact O-CD2 3.45Å; K401-F403 WeakPolarHBondContact O-CE2 3.26Å
402	H	82.8	Confident	71	Confident	38 Å²	38	75.8 Å²	75.8	18%	0.176	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.5	-173	-68.1	113.8	0	0	0	111.6	E382 C384 G385 L393 T394 H395	E382-H402 HydrophobicContact CB-CB 4.49Å; E382-H402 IonicContact OE1-CE1 2.69Å; E382-H402 PolarHBondContact OE1-CE1 2.87Å; E382-H402 IonicContact OE1-ND1 2.76Å; E382-H402 PolarHBondContact OE1-ND1 3.27Å; E382-H402 IonicContact OE2-CE1 2.6Å; E382-H402 PolarHBondContact OE2-CE1 3Å; E382-H402 IonicContact OE2-CG 2.67Å; E382-H402 IonicContact OE2-ND1 3.58Å; E382-H402 PolarHBondContact OE2-ND1 2.86Å; E382-H402 IonicContact OE2-NE2 2.67Å; C384-H402 WeakPolarHBondContact CA-O 3.09Å; G385-H402 PolarHBondContact N-O 2.83Å; L393-H402 HydrophobicContact CB-CB 3.91Å; L393-H402 HydrophobicContact CD1-CB 3.92Å; L393-H402 HydrophobicContact CG-CB 4.46Å; T394-H402 WeakPolarHBondContact O-CA 3.42Å; H395-H402 WeakPolarHBondContact CB-NE2 3.23Å; H395-H402 AromaticContact CD2-CD2 3.98Å; H395-H402 AromaticContact CD2-CE1 3.9Å; H395-H402 AromaticContact CD2-NE2 3.26Å; H395-H402 PolarHBondContact CD2-NE2 2.83Å; H395-H402 VanDerWaalsContact CD2-NE2 3.26Å; H395-H402 AromaticContact CG-NE2 3.56Å
403	F	80.9	Confident	69.9	Low	3 Å²	3	78 Å²	78	1%	0.013	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	137.8	-175.2	-52.5	-81.1	0	0	0	112.2	V386 T394 C396 K401 S418	V386-F403 HydrophobicContact CG2-CD1 3.93Å; V386-F403 HydrophobicContact CG2-CE1 4.12Å; T394-F403 PolarHBondContact N-O 3.29Å; T394-F403 PolarHBondContact O-N 2.93Å; T394-F403 PolarHBondContact OG1-O 3.5Å; C396-F403 HydrophobicContact CB-CD2 4.21Å; C396-F403 HydrophobicContact CB-CE2 3.95Å; K401-F403 HydrophobicContact CB-CE1 4.44Å; K401-F403 HydrophobicContact CB-CE2 3.53Å; K401-F403 HydrophobicContact CB-CZ 3.49Å; K401-F403 VanDerWaalsContact CB-CZ 3.49Å; K401-F403 HydrophobicContact CD-CZ 4.29Å; K401-F403 WeakPolarHBondContact O-CD2 3.45Å; K401-F403 WeakPolarHBondContact O-CE2 3.26Å; F403-S418 VanDerWaalsContact CE1-OG 3.28Å; F403-S418 WeakPolarHBondContact CE1-OG 3.49Å; F403-S418 WeakPolarHBondContact CZ-OG 3.33Å
404	H	82.9	Confident	69.1	Low	35 Å²	35	79.3 Å²	79.3	16%	0.162	42%	0.415	C	S	.	.			trans	-62.2	142.1	168.4	-59.8	113.9	0	0	0	110	C384 C387 L389 D392 L393 H406 C407 H408	C384-H404 VanDerWaalsContact CB-ND1 3.31Å; C384-H404 WeakPolarHBondContact CB-ND1 3.27Å; C387-H404 PolarHBondContact SG-ND1 2.84Å; C387-H404 VanDerWaalsContact SG-ND1 3.39Å; L389-H404 PolarHBondContact O-CE1 2.99Å; L389-H404 VanDerWaalsContact O-CE1 3.32Å; D392-H404 PolarHBondContact O-CD2 3.4Å; D392-H404 VanDerWaalsContact O-CD2 3.29Å; L393-H404 HydrophobicContact CD2-CB 4.48Å; L393-H404 VanDerWaalsContact CD2-CD2 3.46Å; L393-H404 WeakPolarHBondContact CD2-CD2 3.46Å; H404-H406 VanDerWaalsContact C-N 3.26Å; H404-H406 PolarHBondContact O-N 3.29Å; H404-C407 HydrophobicContact CB-CB 4.12Å; H404-C407 PolarHBondContact O-N 3.33Å; H404-H408 PolarHBondContact O-N 2.78Å
405	A	71.3	Confident	68.4	Low	51 Å²	51	79.8 Å²	79.8	42%	0.421	42%	0.418	S	S	.	.	H	α-helix	trans	-53.5	-43.3	176	0	0	0	0	0	112	C407 H408 F409	A405-C407 PolarHBondContact O-N 2.94Å; A405-H408 PolarHBondContact O-N 3.08Å; A405-H408 VanDerWaalsContact O-N 3.07Å; A405-F409 HydrophobicContact CB-CD2 4.38Å; A405-F409 WeakPolarHBondContact O-CB 3.36Å; A405-F409 VanDerWaalsContact O-CD2 3.3Å; A405-F409 WeakPolarHBondContact O-CD2 3.34Å; A405-F409 PolarHBondContact O-N 3.25Å
406	H	67.3	Low	67.8	Low	165 Å²	165	76.7 Å²	76.7	76%	0.764	40%	0.404	S	S	*	.	H	α-helix	trans	-67	-32.7	178.3	-164.4	75.2	0	0	0	113.6	H404 H408	H404-H406 VanDerWaalsContact C-N 3.26Å; H404-H406 PolarHBondContact O-N 3.29Å; H406-H408 VanDerWaalsContact C-N 3.27Å; H406-H408 PolarHBondContact O-N 3.25Å
407	C	67.8	Low	67.3	Low	33 Å²	33	81.3 Å²	81.3	22%	0.223	43%	0.427	C	S	.	.	H	α-helix	trans	-73.7	-19	172.7	-61.3	0	0	0	0	113	V386 H404 A405 L417	V386-C407 HydrophobicContact CB-CB 4.32Å; V386-C407 HydrophobicContact CG1-CB 4.44Å; H404-C407 HydrophobicContact CB-CB 4.12Å; H404-C407 PolarHBondContact O-N 3.33Å; A405-C407 PolarHBondContact O-N 2.94Å; C407-L417 WeakPolarHBondContact O-CD1 3.34Å
408	H	65	Low	66.7	Low	8 Å²	8	77.1 Å²	77.1	4%	0.037	41%	0.41	C	S	.	.	H	α-helix	trans	-92.4	-33.4	178.4	-174.7	-89.4	0	0	0	112.9	H404 A405 H406 C416 L417	H404-H408 PolarHBondContact O-N 2.78Å; A405-H408 PolarHBondContact O-N 3.08Å; A405-H408 VanDerWaalsContact O-N 3.07Å; H406-H408 VanDerWaalsContact C-N 3.27Å; H406-H408 PolarHBondContact O-N 3.25Å; H408-C416 WeakPolarHBondContact NE2-CA 3.49Å; H408-L417 WeakPolarHBondContact O-CD1 3.4Å
409	F	54.8	Low	66.5	Low	83 Å²	83	73.7 Å²	73.7	36%	0.364	40%	0.397	S	S	.	.			trans	-112.7	43.4	-170.8	-69.4	-80.2	0	0	0	114.2	A405 K411 G412 R413	A405-F409 HydrophobicContact CB-CD2 4.38Å; A405-F409 WeakPolarHBondContact O-CB 3.36Å; A405-F409 VanDerWaalsContact O-CD2 3.3Å; A405-F409 WeakPolarHBondContact O-CD2 3.34Å; A405-F409 PolarHBondContact O-N 3.25Å; F409-K411 PolarHBondContact O-N 2.94Å; F409-K411 VanDerWaalsContact O-N 3.13Å; F409-G412 PolarHBondContact O-N 3.33Å; F409-R413 WeakPolarHBondContact CD1-O 3.45Å
410	S	51.2	Low	66	Low	72 Å²	72	75.7 Å²	75.7	50%	0.503	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-64.3	115.4	169.4	51	0	0	0	0	110.5
411	K	52.3	Low	65.2	Low	203 Å²	203	76.3 Å²	76.3	88%	0.883	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	63.1	37	-176.3	-52.1	-177.9	-179	-179.2	0	115.5	F409 R413	F409-K411 PolarHBondContact O-N 2.94Å; F409-K411 VanDerWaalsContact O-N 3.13Å; K411-R413 VanDerWaalsContact C-N 3.26Å; K411-R413 PolarHBondContact O-N 3.17Å
412	G	55.2	Low	64.2	Low	67 Å²	67	74.4 Å²	74.4	69%	0.691	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	68.2	10.5	157.4	0	0	0	0	0	117.3	F409	F409-G412 PolarHBondContact O-N 3.33Å
413	R	55.1	Low	62.7	Low	194 Å²	194	78 Å²	78	73%	0.732	42%	0.417	S	S	*	.			trans	-82.7	134.9	172.7	-61.9	-173.1	-177.8	-151	-1.8	109.4	F409 K411 V415	F409-R413 WeakPolarHBondContact CD1-O 3.45Å; K411-R413 VanDerWaalsContact C-N 3.26Å; K411-R413 PolarHBondContact O-N 3.17Å; R413-V415 PolarHBondContact O-N 3.45Å
414	S	62.4	Low	61.3	Low	59 Å²	59	81.4 Å²	81.4	41%	0.413	45%	0.453	S	S	.	.			trans	-73.2	25.1	178.8	54.7	0	0	0	0	114.2	P422 W423	S414-P422 CarbonylContact O-C 3.59Å; S414-P422 WeakPolarHBondContact O-CA 3.39Å; S414-W423 WeakPolarHBondContact O-CB 3.49Å; S414-W423 PolarHBondContact O-N 3.46Å
415	V	61.8	Low	59.3	Low	55 Å²	55	84.9 Å²	84.9	33%	0.333	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-109.7	119.4	-166.7	-178.9	0	0	0	0	111.7	R413 L417 R421	R413-V415 PolarHBondContact O-N 3.45Å; V415-L417 PolarHBondContact O-N 3.37Å; V415-R421 WeakPolarHBondContact CA-O 3.44Å
416	C	65.3	Low	57.5	Low	3 Å²	3	87.9 Å²	87.9	2%	0.02	50%	0.499	C	S	.	.			trans	-54.9	107	172.3	161.3	0	0	0	0	111.4	H408 S418 C419 S420 R421	H408-C416 WeakPolarHBondContact NE2-CA 3.49Å; C416-S418 VanDerWaalsContact C-N 3.26Å; C416-S418 PolarHBondContact O-N 3.1Å; C416-C419 HydrophobicContact CB-CB 4.41Å; C416-C419 WeakPolarHBondContact CB-SG 3.45Å; C416-C419 CarbonylContact O-C 3.41Å; C416-C419 PolarHBondContact O-N 3.25Å; C416-C419 VanDerWaalsContact O-N 3.1Å; C416-C419 WeakPolarHBondContact SG-CB 3.31Å; C416-C419 PolarHBondContact SG-N 2.83Å; C416-C419 CovalentContact SG-SG 2.05Å; C416-C419 PolarHBondContact SG-SG 2.93Å; C416-S420 WeakPolarHBondContact O-CA 3.43Å; C416-S420 PolarHBondContact O-N 3.19Å; C416-R421 PolarHBondContact N-O 3.5Å
417	L	64.9	Low	56.1	Low	102 Å²	102	84.6 Å²	84.6	53%	0.534	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-35.7	-178.1	-74.7	130.2	0	0	0	113.2	C407 H408 V415 C419	C407-L417 WeakPolarHBondContact O-CD1 3.34Å; H408-L417 WeakPolarHBondContact O-CD1 3.4Å; V415-L417 PolarHBondContact O-N 3.37Å; L417-C419 VanDerWaalsContact C-N 3.33Å; L417-C419 PolarHBondContact O-N 2.86Å
418	S	61.5	Low	54.4	Low	54 Å²	54	92.7 Å²	92.7	38%	0.378	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.3	179.3	-67.4	0	0	0	0	114.7	F403 C416	F403-S418 VanDerWaalsContact CE1-OG 3.28Å; F403-S418 WeakPolarHBondContact CE1-OG 3.49Å; F403-S418 WeakPolarHBondContact CZ-OG 3.33Å; C416-S418 VanDerWaalsContact C-N 3.26Å; C416-S418 PolarHBondContact O-N 3.1Å
419	C	66.1	Low	53.2	Low	35 Å²	35	100.3 Å²	100.3	24%	0.236	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-136.5	-0.3	-169.7	69.8	0	0	0	0	115	C396 C399 C416 L417 R421	C396-C419 VanDerWaalsContact SG-SG 3.67Å; C399-C419 HydrophobicContact CB-CB 3.93Å; C416-C419 HydrophobicContact CB-CB 4.41Å; C416-C419 WeakPolarHBondContact CB-SG 3.45Å; C416-C419 CarbonylContact O-C 3.41Å; C416-C419 PolarHBondContact O-N 3.25Å; C416-C419 VanDerWaalsContact O-N 3.1Å; C416-C419 WeakPolarHBondContact SG-CB 3.31Å; C416-C419 PolarHBondContact SG-N 2.83Å; C416-C419 CovalentContact SG-SG 2.05Å; C416-C419 PolarHBondContact SG-SG 2.93Å; L417-C419 VanDerWaalsContact C-N 3.33Å; L417-C419 PolarHBondContact O-N 2.86Å; C419-R421 PolarHBondContact O-N 3.1Å; C419-R421 VanDerWaalsContact O-N 3.09Å
420	S	64.7	Low	52.3	Low	82 Å²	82	103.5 Å²	103.5	57%	0.573	58%	0.584	S	S	*	*			trans	52.3	25	176.5	-46.1	0	0	0	0	115.5	C416	C416-S420 WeakPolarHBondContact O-CA 3.43Å; C416-S420 PolarHBondContact O-N 3.19Å
421	R	57.9	Low	51.3	Low	141 Å²	141	106.5 Å²	106.5	53%	0.532	60%	0.6	S	S	.	*			trans	-105.7	144.3	177.6	-68.4	-142.8	-178.8	-174	-12.9	112.6	Q398 V415 C416 C419	Q398-R421 HydrophobicContact CG-CG 4.26Å; V415-R421 WeakPolarHBondContact CA-O 3.44Å; C416-R421 PolarHBondContact N-O 3.5Å; C419-R421 PolarHBondContact O-N 3.1Å; C419-R421 VanDerWaalsContact O-N 3.09Å
422	P	57.8	Low	50.3	Low	80 Å²	80	104.8 Å²	104.8	52%	0.519	60%	0.595	S	S	.	*	B	Isolated β-bridge	trans	-65.5	137.1	167.7	29.2	-33.9	0	0	0	110.8	S414	S414-P422 CarbonylContact O-C 3.59Å; S414-P422 WeakPolarHBondContact O-CA 3.39Å
423	W	50.1	Low	49.6	Very low	113 Å²	113	106.9 Å²	106.9	43%	0.428	60%	0.596	S	S	.	*	S	Bend	trans	-77.9	135.9	172.1	-178.4	-79.6	0	0	0	109.7	H395 S414	H395-W423 VanDerWaalsContact O-CH2 3.3Å; H395-W423 WeakPolarHBondContact O-CH2 3.05Å; S414-W423 WeakPolarHBondContact O-CB 3.49Å; S414-W423 PolarHBondContact O-N 3.46Å
424	G	51.8	Low	48.8	Very low	74 Å²	74	109.4 Å²	109.4	76%	0.763	61%	0.606	S	S	*	*	S	Bend	trans	78.2	43.7	173	0	0	0	0	0	115.8
425	S	40.4	Very low	47.1	Very low	109 Å²	109	110.3 Å²	110.3	76%	0.762	62%	0.624	S	S	*	*			trans	-126.6	93.2	167.2	-166.4	0	0	0	0	111.4
426	S	34.2	Very low	45.7	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	65%	0.65	S	S	*	*	S	Bend	trans	-158.6	108.5	163.6	-179.2	0	0	0	0	110.2
427	A	37.4	Very low	44	Very low	95 Å²	95	124 Å²	124	79%	0.785	69%	0.686	S	S	*	*			trans	47.3	88.8	160	0	0	0	0	0	118.6
428	E	32.4	Very low	42.2	Very low	203 Å²	203	127 Å²	127	95%	0.949	70%	0.702	S	S	*	*			trans	-111.5	121.3	137.8	-69.9	-170.5	149.8	0	0	107.8
429	K	39.7	Very low	40.6	Very low	169 Å²	169	128.5 Å²	128.5	74%	0.735	72%	0.717	S	S	*	*			trans	-144.4	115.4	174.8	-154.4	177.5	-168.9	-75.6	0	109.6
430	E	36.9	Very low	39.2	Very low	150 Å²	150	132.3 Å²	132.3	70%	0.701	74%	0.742	S	S	*	*			trans	66.1	113.5	161.8	-72.3	157.2	-142.4	0	0	119.3
431	T	29.6	Very low	37.4	Very low	135 Å²	135	133.6 Å²	133.6	83%	0.828	75%	0.75	S	S	*	*				-159.8	113.6	117.2	3.4	0	0	0	0	112.3
432	E	30.7	Very low	36	Very low	166 Å²	166	133.4 Å²	133.4	78%	0.776	77%	0.765	S	S	*	*			trans	57.9	165.9	140.2	-77.8	-78.8	88.4	0	0	121.5
433	P	41.7	Very low	34.8	Very low	111 Å²	111	137.5 Å²	137.5	72%	0.721	78%	0.777	S	S	*	*			cis	-123.8	174.4	-9.6	38.3	-22.6	0	0	0	115.9
434	R	36.8	Very low	33.7	Very low	248 Å²	248	137.5 Å²	137.5	94%	0.936	79%	0.785	S	S	*	*			trans	-58.3	130.2	172.5	-165.3	-175.9	-160.7	-174.4	6.4	114
435	G	27.9	Very low	32.5	Very low	77 Å²	77	139.8 Å²	139.8	79%	0.794	79%	0.79	S	S	*	*			trans	-148.5	133.8	179.2	0	0	0	0	0	115
436	M	31	Very low	31.9	Very low	181 Å²	181	142.8 Å²	142.8	89%	0.892	79%	0.789	S	S	*	*			trans	-73.1	137.3	-165.9	-67.7	169.5	170.5	0	0	116.9
437	Q	30.2	Very low	31.6	Very low	166 Å²	166	143.5 Å²	143.5	78%	0.776	79%	0.794	S	S	*	*				58.8	118.4	122.2	-159.8	179.2	17.8	0	0	120.8
438	L	27	Very low	31.3	Very low	165 Å²	165	145.6 Å²	145.6	86%	0.864	79%	0.788	S	S	*	*				173.1	155.1	118.2	-92.9	170.6	0	0	0	113.1
439	A	27.7	Very low	31	Very low	84 Å²	84	144.2 Å²	144.2	69%	0.694	79%	0.787	S	S	*	*			trans	-140	148.7	166.8	0	0	0	0	0	109.4
440	P	37.6	Very low	30.8	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	79%	0.787	S	S	*	*				-136.2	157.4	111.8	22.5	-1.3	0	0	0	111.6
441	S	26.6	Very low	30.4	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	79%	0.789	S	S	*	*				59.9	133.7	60.4	-55	0	0	0	0	113
442	V	28.7	Very low	30.4	Very low	137 Å²	137	140.7 Å²	140.7	83%	0.83	78%	0.784	S	S	*	*			cis	-153.4	171.6	-3.9	-99.1	0	0	0	0	106.7
443	Q	31.9	Very low	30.3	Very low	167 Å²	167	138.2 Å²	138.2	78%	0.78	79%	0.785	S	S	*	*			cis	-132	172.1	26.9	-81.8	-164.5	83	0	0	110.7
444	N	27	Very low	29.7	Very low	112 Å²	112	142.1 Å²	142.1	60%	0.599	79%	0.791	S	S	*	*			cis	79.9	115	37.5	-167.5	36.3	0	0	0	116.6
445	S	27.8	Very low	29.5	Very low	122 Å²	122	135.7 Å²	135.7	85%	0.853	78%	0.784	S	S	*	*			trans	-163.7	131.7	161	-78.8	0	0	0	0	109.4
446	F	27.2	Very low	30	Very low	172 Å²	172	140.9 Å²	140.9	75%	0.754	79%	0.787	S	S	*	*			trans	-81.1	146.8	-172.7	-99.7	-124.1	0	0	0	113.6
447	S	28.2	Very low	30.5	Very low	130 Å²	130	137.4 Å²	137.4	91%	0.909	78%	0.778	S	S	*	*				-152.5	153.6	129.6	-80.3	0	0	0	0	109.1
448	Q	31	Very low	31.1	Very low	139 Å²	139	136.4 Å²	136.4	65%	0.65	78%	0.783	S	S	*	*			trans	-127.4	132.1	-158.5	166.2	-174.8	-20.5	0	0	110.3
449	D	26.5	Very low	31.8	Very low	173 Å²	173	134.8 Å²	134.8	93%	0.925	77%	0.774	S	S	*	*			trans	-149.8	151.2	150.8	-109.9	-38.6	0	0	0	110.5
450	Q	35.5	Very low	32.8	Very low	158 Å²	158	135.7 Å²	135.7	74%	0.738	77%	0.767	S	S	*	*			trans	-113.8	136.1	-173.9	-65.4	178.1	-4.1	0	0	111.4
451	S	27.5	Very low	33.3	Very low	107 Å²	107	136.6 Å²	136.6	75%	0.748	76%	0.759	S	S	*	*				-174.1	133.3	127.5	35.9	0	0	0	0	113.9
452	T	29.8	Very low	34.2	Very low	116 Å²	116	136.8 Å²	136.8	71%	0.712	75%	0.752	S	S	*	*			trans	43.8	96.5	149.5	55.9	0	0	0	0	119.4
453	S	29.6	Very low	35.3	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	74%	0.741	S	S	*	*			trans	-67.2	137.8	150.6	53.2	0	0	0	0	111.6
454	F	29	Very low	36.3	Very low	193 Å²	193	133.5 Å²	133.5	85%	0.846	73%	0.73	S	S	*	*			trans	-116	124	157.5	-83.9	-85.1	0	0	0	109.3
455	S	32.8	Very low	37.4	Very low	113 Å²	113	132.8 Å²	132.8	79%	0.79	73%	0.726	S	S	*	*			trans	-83.8	130.4	175.6	-54.7	0	0	0	0	109.9
456	E	37.8	Very low	38.4	Very low	186 Å²	186	131.5 Å²	131.5	87%	0.869	72%	0.717	S	S	*	*			trans	-74.9	123.2	175.2	-170	171.2	-159.9	0	0	109.9	V458	E456-V458 PolarHBondContact O-N 2.87Å
457	P	42.2	Very low	39.4	Very low	107 Å²	107	129.2 Å²	129.2	70%	0.695	71%	0.712	S	S	*	*			trans	-78	115.7	-179.8	30	-32.4	0	0	0	110.5	I459	P457-I459 PolarHBondContact O-N 3.36Å; P457-I459 VanDerWaalsContact O-N 3.13Å
458	V	41.4	Very low	40.6	Very low	146 Å²	146	129.5 Å²	129.5	89%	0.885	70%	0.703	S	S	*	*			trans	-69.8	106.2	166.2	178.6	0	0	0	0	107.9	E456 D460	E456-V458 PolarHBondContact O-N 2.87Å; V458-D460 PolarHBondContact O-N 3.08Å
459	I	42.9	Very low	41.3	Very low	130 Å²	130	125.5 Å²	125.5	67%	0.667	70%	0.699	S	S	*	*			trans	-71.7	125.8	174.9	-60.7	174.9	0	0	0	108.3	P457	P457-I459 PolarHBondContact O-N 3.36Å; P457-I459 VanDerWaalsContact O-N 3.13Å
460	D	47.8	Very low	42.4	Very low	103 Å²	103	124.1 Å²	124.1	55%	0.551	69%	0.691	S	S	*	*			trans	-77.8	152.6	179.1	-174.9	46.2	0	0	0	111.9	V458 D462	V458-D460 PolarHBondContact O-N 3.08Å; D460-D462 VanDerWaalsContact C-N 3.32Å; D460-D462 PolarHBondContact O-N 3.13Å
461	K	47.7	Very low	43.3	Very low	136 Å²	136	121.8 Å²	121.8	59%	0.591	69%	0.69	S	S	*	*	H	α-helix	trans	-68.5	-29.9	-170.9	173.3	164.3	163	32.7	0	113.1	D465	K461-D465 IonicContact NZ-OD2 2.9Å; K461-D465 PolarHBondContact NZ-OD2 3.23Å
462	D	45.2	Very low	44.5	Very low	112 Å²	112	124.2 Å²	124.2	60%	0.599	69%	0.694	S	S	*	*	H	α-helix	trans	-85.9	-16.2	-170.5	-64.3	-14.9	0	0	0	113.1	D460 S466	D460-D462 VanDerWaalsContact C-N 3.32Å; D460-D462 PolarHBondContact O-N 3.13Å; D462-S466 PolarHBondContact O-OG 3.38Å; D462-S466 VanDerWaalsContact O-OG 3.1Å
463	E	53.1	Low	45.7	Very low	127 Å²	127	122.8 Å²	122.8	59%	0.593	69%	0.689	S	S	*	*	H	α-helix	trans	-72.7	-32.8	172.7	-165.8	170.9	-151.9	0	0	111.6	S466 I467	E463-S466 WeakPolarHBondContact O-CB 3.18Å; E463-S466 PolarHBondContact O-N 2.98Å; E463-I467 PolarHBondContact O-N 2.87Å
464	L	52.8	Low	47	Very low	107 Å²	107	123.5 Å²	123.5	56%	0.56	68%	0.683	S	S	*	*	H	α-helix	trans	-70.8	-39.8	-179.6	-173.6	63.7	0	0	0	113	S466 I467	L464-S466 PolarHBondContact O-N 3.26Å; L464-I467 PolarHBondContact O-N 3.49Å
465	D	50.1	Low	48.5	Very low	97 Å²	97	120.2 Å²	120.2	52%	0.519	67%	0.674	S	S	.	*	H	α-helix	trans	-68.8	-22.2	175.9	-81.3	-47.4	0	0	0	111.6	K461	K461-D465 IonicContact NZ-OD2 2.9Å; K461-D465 PolarHBondContact NZ-OD2 3.23Å
466	S	48.7	Very low	49.6	Very low	95 Å²	95	116.9 Å²	116.9	66%	0.664	66%	0.657	S	S	*	*	H	α-helix	trans	-73.8	-27	172.9	-59.5	0	0	0	0	113.4	D462 E463 L464	D462-S466 PolarHBondContact O-OG 3.38Å; D462-S466 VanDerWaalsContact O-OG 3.1Å; E463-S466 WeakPolarHBondContact O-CB 3.18Å; E463-S466 PolarHBondContact O-N 2.98Å; L464-S466 PolarHBondContact O-N 3.26Å
467	I	48.6	Very low	50.7	Low	125 Å²	125	114.2 Å²	114.2	64%	0.641	65%	0.648	S	S	*	*	H	α-helix	trans	-81.3	-22	-179	-68.1	166.7	0	0	0	112.2	E463 L464	E463-I467 PolarHBondContact O-N 2.87Å; L464-I467 PolarHBondContact O-N 3.49Å
468	L	52.7	Low	51.7	Low	136 Å²	136	113.5 Å²	113.5	71%	0.712	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	4.5	-178.7	-63.6	175.1	0	0	0	114
469	G	45.9	Very low	52.6	Low	55 Å²	55	112 Å²	112	57%	0.567	62%	0.622	S	S	*	*			trans	-85.5	-28.3	-170.9	0	0	0	0	0	117	P471	G469-P471 WeakPolarHBondContact O-CD 3.27Å
470	D	49.4	Very low	53.6	Low	143 Å²	143	114.5 Å²	114.5	77%	0.765	62%	0.623	S	S	*	*			trans	-96.9	115	-166.9	-99	-36.6	0	0	0	113.9	N472	D470-N472 VanDerWaalsContact C-N 3.26Å; D470-N472 PolarHBondContact O-N 3.46Å; D470-N472 VanDerWaalsContact O-N 3.11Å
471	P	54.1	Low	54.2	Low	109 Å²	109	111.5 Å²	111.5	71%	0.708	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-4.1	-172.3	-21.7	34.9	0	0	0	117.2	G469	G469-P471 WeakPolarHBondContact O-CD 3.27Å
472	N	53.1	Low	54.6	Low	158 Å²	158	112.8 Å²	112.8	85%	0.845	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	14.6	-160.6	-80.3	-13.4	0	0	0	115.9	D470	D470-N472 VanDerWaalsContact C-N 3.26Å; D470-N472 PolarHBondContact O-N 3.46Å; D470-N472 VanDerWaalsContact O-N 3.11Å
473	S	55.4	Low	55.2	Low	87 Å²	87	115 Å²	115	61%	0.608	63%	0.625	S	S	*	*			trans	-121.2	32.5	-175.4	-151.9	0	0	0	0	115.7	D475	S473-D475 VanDerWaalsContact C-N 3.27Å; S473-D475 PolarHBondContact O-N 3.05Å
474	I	56.9	Low	55.1	Low	129 Å²	129	111.9 Å²	111.9	66%	0.662	62%	0.617	S	S	*	*	H	α-helix	trans	-66.1	-33.5	171.7	-65.5	175.3	0	0	0	111.1	L477 L478	I474-L477 PolarHBondContact O-N 3.01Å; I474-L478 HydrophobicContact CG2-CD1 4.44Å; I474-L478 PolarHBondContact O-N 3.47Å
475	D	60.9	Low	55.1	Low	123 Å²	123	113.1 Å²	113.1	66%	0.658	62%	0.622	S	S	*	*	H	α-helix	trans	-66.1	-40.1	-175.3	-150	46.6	0	0	0	112.5	S473 L477 L478 Q479	S473-D475 VanDerWaalsContact C-N 3.27Å; S473-D475 PolarHBondContact O-N 3.05Å; D475-L477 VanDerWaalsContact C-N 3.29Å; D475-L477 PolarHBondContact O-N 2.89Å; D475-L478 PolarHBondContact O-N 3.2Å; D475-Q479 PolarHBondContact O-N 2.85Å
476	G	55.8	Low	54.7	Low	43 Å²	43	113.8 Å²	113.8	44%	0.443	64%	0.635	S	S	.	*	H	α-helix	trans	-64.7	-31.3	176.7	0	0	0	0	0	113.7	Q479 W480	G476-Q479 PolarHBondContact O-N 3.48Å; G476-W480 PolarHBondContact O-N 3.01Å; G476-W480 VanDerWaalsContact O-N 3.08Å
477	L	60.2	Low	54.9	Low	130 Å²	130	120.5 Å²	120.5	68%	0.681	65%	0.645	S	S	*	*	H	α-helix	trans	-72	-36	177.6	-131.7	165.7	0	0	0	111.3	I474 D475 A481	I474-L477 PolarHBondContact O-N 3.01Å; D475-L477 VanDerWaalsContact C-N 3.29Å; D475-L477 PolarHBondContact O-N 2.89Å; L477-A481 PolarHBondContact O-N 2.95Å
478	L	63	Low	54.8	Low	92 Å²	92	120.2 Å²	120.2	48%	0.482	65%	0.652	S	S	.	*	H	α-helix	trans	-69.1	-42	170.6	-65.7	172.2	0	0	0	111.6	I474 D475 W480 A481 F482	I474-L478 HydrophobicContact CG2-CD1 4.44Å; I474-L478 PolarHBondContact O-N 3.47Å; D475-L478 PolarHBondContact O-N 3.2Å; L478-W480 VanDerWaalsContact C-N 3.28Å; L478-W480 PolarHBondContact O-N 3.37Å; L478-A481 WeakPolarHBondContact O-CB 3.36Å; L478-A481 PolarHBondContact O-N 3.14Å; L478-A481 VanDerWaalsContact O-N 3.12Å; L478-F482 WeakPolarHBondContact O-CD2 3.31Å; L478-F482 PolarHBondContact O-N 2.82Å
479	Q	60.9	Low	54.1	Low	115 Å²	115	121.8 Å²	121.8	54%	0.537	66%	0.66	S	S	.	*	H	α-helix	trans	-58.6	-39.6	177.5	-164.5	70	26.5	0	0	112	D475 G476 H483	D475-Q479 PolarHBondContact O-N 2.85Å; G476-Q479 PolarHBondContact O-N 3.48Å; Q479-H483 PolarHBondContact O-N 3.27Å
480	W	63.2	Low	54.2	Low	183 Å²	183	124.8 Å²	124.8	69%	0.693	67%	0.67	S	S	*	*	H	α-helix	trans	-65.7	-41.2	174.3	-176.3	88.8	0	0	0	112.7	G476 L478 H483 S484	G476-W480 PolarHBondContact O-N 3.01Å; G476-W480 VanDerWaalsContact O-N 3.08Å; L478-W480 VanDerWaalsContact C-N 3.28Å; L478-W480 PolarHBondContact O-N 3.37Å; W480-H483 PolarHBondContact O-N 3.15Å; W480-S484 PolarHBondContact O-N 3.46Å; W480-S484 PolarHBondContact O-OG 3.28Å
481	A	59.5	Low	53.9	Low	40 Å²	40	125.4 Å²	125.4	33%	0.331	67%	0.673	S	S	.	*	H	α-helix	trans	-63.7	-40.6	177.8	0	0	0	0	0	112.3	L477 L478 H483 S484	L477-A481 PolarHBondContact O-N 2.95Å; L478-A481 WeakPolarHBondContact O-CB 3.36Å; L478-A481 PolarHBondContact O-N 3.14Å; L478-A481 VanDerWaalsContact O-N 3.12Å; A481-H483 VanDerWaalsContact C-N 3.29Å; A481-H483 PolarHBondContact O-N 3.34Å; A481-S484 WeakPolarHBondContact CA-OG 3.15Å; A481-S484 PolarHBondContact O-N 2.91Å; A481-S484 PolarHBondContact O-OG 3.41Å
482	F	56.5	Low	53.5	Low	162 Å²	162	126 Å²	126	71%	0.711	68%	0.68	S	S	*	*	H	α-helix	trans	-67.5	-25.9	176.1	-85.8	-73.3	0	0	0	114	L478	L478-F482 WeakPolarHBondContact O-CD2 3.31Å; L478-F482 PolarHBondContact O-N 2.82Å
483	H	59.3	Low	53.3	Low	160 Å²	160	127.7 Å²	127.7	74%	0.741	68%	0.682	S	S	*	*	H	α-helix	trans	-87.9	-13.9	177.8	-98.8	-113	0	0	0	114.7	Q479 W480 A481	Q479-H483 PolarHBondContact O-N 3.27Å; W480-H483 PolarHBondContact O-N 3.15Å; A481-H483 VanDerWaalsContact C-N 3.29Å; A481-H483 PolarHBondContact O-N 3.34Å
484	S	51.1	Low	52.7	Low	61 Å²	61	126.7 Å²	126.7	43%	0.427	69%	0.686	S	S	.	*	H	α-helix	trans	-101.9	-3.5	-175.1	47.5	0	0	0	0	114.6	W480 A481	W480-S484 PolarHBondContact O-N 3.46Å; W480-S484 PolarHBondContact O-OG 3.28Å; A481-S484 WeakPolarHBondContact CA-OG 3.15Å; A481-S484 PolarHBondContact O-N 2.91Å; A481-S484 PolarHBondContact O-OG 3.41Å
485	I	51	Low	51.9	Low	132 Å²	132	125.8 Å²	125.8	68%	0.677	69%	0.69	S	S	*	*	S	Bend	trans	-84.9	112.9	172	-60.6	167	0	0	0	109.7	R487	I485-R487 PolarHBondContact O-N 2.66Å
486	S	43.1	Very low	50.9	Low	111 Å²	111	130.2 Å²	130.2	78%	0.776	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-57.4	131.9	177.5	-60.8	0	0	0	0	112.6
487	R	51.4	Low	50.3	Low	236 Å²	236	141.3 Å²	141.3	89%	0.891	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-62.9	144.2	171	-68.6	-175.4	177.6	-166.2	-0.6	110.9	I485	I485-R487 PolarHBondContact O-N 2.66Å
488	P	46.4	Very low	49.8	Very low	120 Å²	120	141.9 Å²	141.9	78%	0.779	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-64	150.1	163.5	29.2	-34	0	0	0	110.7
489	L	39.9	Very low	49.1	Very low	169 Å²	169	144.5 Å²	144.5	89%	0.885	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-68.4	143.4	174.9	-76.3	158.6	0	0	0	110.9
490	P	47.8	Very low	48.5	Very low	118 Å²	118	146.2 Å²	146.2	77%	0.766	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-77.2	155.5	173.4	33	-35	0	0	0	112.1
491	D	42.9	Very low	47.6	Very low	156 Å²	156	144 Å²	144	83%	0.834	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-60.5	139.1	179.3	-66.4	-67.2	0	0	0	114	Q493	D491-Q493 PolarHBondContact O-N 2.67Å
492	S	45.8	Very low	46.9	Very low	122 Å²	122	150.5 Å²	150.5	85%	0.853	80%	0.795	S	S	*	*			trans	-86.1	95.2	166.6	58.7	0	0	0	0	110.8
493	Q	48.8	Very low	46.2	Very low	192 Å²	192	149.7 Å²	149.7	90%	0.897	80%	0.8	S	S	*	*			trans	-81.3	142.3	168.8	-72.5	-169.6	-7.8	0	0	112.2	D491	D491-Q493 PolarHBondContact O-N 2.67Å
494	G	43	Very low	45.3	Very low	67 Å²	67	149 Å²	149	69%	0.691	81%	0.805	S	S	*	*			trans	118.6	145	169.6	0	0	0	0	0	113.9
495	C	39.1	Very low	44.9	Very low	110 Å²	110	155.8 Å²	155.8	74%	0.743	83%	0.834	S	S	*	*			cis	-159.2	150.8	2.3	-103.1	0	0	0	0	111.6
496	Y	39.6	Very low	44.3	Very low	216 Å²	216	157.8 Å²	157.8	85%	0.847	85%	0.847	S	S	*	*			trans	19.1	133.3	157.1	-53.8	-80.8	0	0	0	119.8
497	K	44.3	Very low	44.5	Very low	276 Å²	276	162 Å²	162	100%	1.2	85%	0.853	S	S	*	*				-149.9	0	54.8	-94.2	-176.7	172.6	177.2	0	114.2

Retrieved 497 of 497 residues in 115.1 ms (Link to these results)

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