A0A087XUV1_POEFO Loading...

Rho GTPase-activating protein 10

GTPase-activating protein that catalyzes the conversion of active GTP-bound Rho GTPases to their inactive GDP-bound form, thus suppressing various Rho GTPase-mediated cellular processes. Also converts Cdc42 to an inactive GDP-bound state. Essential for PTKB2 regulation of cytoskeletal organization via Rho family GTPases. Inhibits PAK2 proteolytic fragment PAK-2p34 kinase activity and changes its localization from the nucleus to the perinuclear region. Stabilizes PAK-2p34 thereby increasing stimulation of cell death. Associates with MICAL1 on the endosomal membrane to promote Rab8-Rab10-dependent tubule extension. After dissociation with MICAL1, recruits WDR44 which connects the endoplasmic reticulum (ER) with the endosomal tubule, thereby participating in the export of a subset of neosynthesized proteins.

AlphaFold DB , UniProt , Accession A0A087XUV1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 761 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.1	Low	87.9	Confident	245 Å²	245	78.2 Å²	78.2	100%	1.207	45%	0.449	S	S	*	.				0	152.5	0	-67.7	-158.1	-83.6	0	0	108.7
2	G	76.6	Confident	88.4	Confident	74 Å²	74	82.9 Å²	82.9	76%	0.763	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-71.6	169.5	175.7	0	0	0	0	0	112.5
3	L	86.9	Confident	88.9	Confident	72 Å²	72	86.8 Å²	86.8	38%	0.377	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-68.6	139.8	166.7	-67.3	169.2	0	0	0	109	A24 Q25 E28	L3-A24 HydrophobicContact CD2-CB 4.15Å; L3-Q25 HydrophobicContact CB-CG 4.49Å; L3-Q25 HydrophobicContact CD1-CB 4.49Å; L3-Q25 HydrophobicContact CD1-CG 4.16Å; L3-Q25 HydrophobicContact CD2-CG 4.32Å; L3-E28 HydrophobicContact CD1-CB 4.06Å; L3-E28 HydrophobicContact CD1-CG 4.09Å
4	T	88.6	Confident	89.4	Confident	72 Å²	72	81.9 Å²	81.9	44%	0.442	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-72.9	146	171.7	50.6	0	0	0	0	110.5	K21 Q25	T4-K21 WeakPolarHBondContact OG1-CG 3.4Å; T4-Q25 PolarHBondContact O-NE2 3.01Å; T4-Q25 VanDerWaalsContact O-NE2 3.08Å
5	P	89.8	Confident	89.9	Confident	83 Å²	83	78.2 Å²	78.2	54%	0.539	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-54.8	157.5	165.2	-24	34.8	0	0	0	112.2
6	L	94.7	Very high	90.3	Very high	3 Å²	3	80.1 Å²	80.1	2%	0.016	45%	0.448	C	S	.	.			trans	-111.1	112	172.8	-65.7	174.2	0	0	0	107.8	F18 K21 I22 Q25 V182 L185 Q186	L6-F18 HydrophobicContact CB-CE2 4.14Å; L6-F18 HydrophobicContact CD2-CD2 4.12Å; L6-F18 HydrophobicContact CD2-CE2 3.87Å; L6-K21 HydrophobicContact CD2-CB 3.46Å; L6-K21 VanDerWaalsContact CD2-CB 3.46Å; L6-K21 HydrophobicContact CD2-CD 4.29Å; L6-I22 HydrophobicContact CD1-CG1 4.03Å; L6-I22 HydrophobicContact CD2-CG1 3.9Å; L6-Q25 HydrophobicContact CD1-CG 4.4Å; L6-V182 HydrophobicContact CB-CG1 3.57Å; L6-V182 HydrophobicContact CD1-CG1 4.1Å; L6-V182 HydrophobicContact CD1-CG2 4.46Å; L6-V182 HydrophobicContact CG-CG1 4.48Å; L6-L185 HydrophobicContact CD1-CB 4.38Å; L6-L185 HydrophobicContact CD1-CD1 4.12Å; L6-Q186 PolarHBondContact O-NE2 2.82Å
7	E	94.9	Very high	90.6	Very high	108 Å²	108	79.2 Å²	79.2	51%	0.505	45%	0.448	S	S	.	.			trans	-79.2	132.3	-179.5	-63.5	-60.2	150.5	0	0	110.3	S9 E10	E7-S9 PolarHBondContact O-N 2.8Å; E7-E10 HydrophobicContact CB-CG 4.11Å; E7-E10 WeakPolarHBondContact O-CB 3.39Å; E7-E10 PolarHBondContact O-N 3.48Å
8	F	96.3	Very high	91	Very high	101 Å²	101	74.8 Å²	74.8	44%	0.443	42%	0.423	S	S	.	.	H	α-helix	trans	-61.6	-28.5	178.2	-69.3	-54.1	0	0	0	112.8	E10 C11 L179 V182 C183	F8-E10 VanDerWaalsContact C-N 3.28Å; F8-E10 PolarHBondContact O-N 3.27Å; F8-C11 VanDerWaalsContact O-CB 3.25Å; F8-C11 WeakPolarHBondContact O-CB 3.46Å; F8-C11 PolarHBondContact O-N 2.88Å; F8-L179 HydrophobicContact CB-CD2 3.66Å; F8-L179 HydrophobicContact CD1-CD2 3.72Å; F8-L179 HydrophobicContact CG-CD2 4.03Å; F8-V182 HydrophobicContact CD1-CG1 4.1Å; F8-V182 HydrophobicContact CE1-CG1 4.05Å; F8-C183 HydrophobicContact CE1-CB 3.97Å; F8-C183 HydrophobicContact CZ-CB 4.11Å
9	S	95.6	Very high	91.2	Very high	75 Å²	75	73.5 Å²	73.5	52%	0.524	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-30.2	173.7	54.6	0	0	0	0	113.1	E7 C11 Y12	E7-S9 PolarHBondContact O-N 2.8Å; S9-C11 PolarHBondContact O-N 3.15Å; S9-Y12 PolarHBondContact O-N 3.4Å
10	E	96	Very high	91.5	Very high	27 Å²	27	76.7 Å²	76.7	13%	0.126	42%	0.422	C	S	.	.	H	α-helix	trans	-69.8	-19.4	176.6	-68.4	-176.9	109.6	0	0	112.6	E7 F8 Y12 L13 D14 F18 K21	E7-E10 HydrophobicContact CB-CG 4.11Å; E7-E10 WeakPolarHBondContact O-CB 3.39Å; E7-E10 PolarHBondContact O-N 3.48Å; F8-E10 VanDerWaalsContact C-N 3.28Å; F8-E10 PolarHBondContact O-N 3.27Å; E10-Y12 VanDerWaalsContact C-N 3.28Å; E10-Y12 PolarHBondContact O-N 3.32Å; E10-L13 PolarHBondContact O-N 2.93Å; E10-D14 PolarHBondContact O-N 3.39Å; E10-F18 HydrophobicContact CB-CB 4Å; E10-F18 HydrophobicContact CB-CD1 4.13Å; E10-F18 HydrophobicContact CB-CD2 3.29Å; E10-F18 HydrophobicContact CB-CE1 4.39Å; E10-F18 HydrophobicContact CB-CE2 3.6Å; E10-F18 HydrophobicContact CB-CG 3.56Å; E10-F18 HydrophobicContact CB-CZ 4.13Å; E10-F18 HydrophobicContact CG-CD2 4.09Å; E10-F18 HydrophobicContact CG-CG 4.48Å; E10-K21 IonicContact OE1-NZ 3.5Å; E10-K21 PolarHBondContact OE1-NZ 2.87Å; E10-K21 IonicContact OE2-NZ 3.81Å; E10-K21 PolarHBondContact OE2-NZ 3.45Å
11	C	96.1	Very high	91.7	Very high	0 Å²	0	75.6 Å²	75.6	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-63.2	-33.4	173.7	-60.3	0	0	0	0	112.5	F8 S9 L179	F8-C11 VanDerWaalsContact O-CB 3.25Å; F8-C11 WeakPolarHBondContact O-CB 3.46Å; F8-C11 PolarHBondContact O-N 2.88Å; S9-C11 PolarHBondContact O-N 3.15Å; C11-L179 HydrophobicContact CB-CD2 3.91Å; C11-L179 HydrophobicContact CB-CG 4.2Å
12	Y	94.7	Very high	93.9	Very high	135 Å²	135	64.1 Å²	64.1	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-77.9	-28.3	177.1	-65.3	-84.6	0	0	0	112.7	S9 E10 Q175 L179	S9-Y12 PolarHBondContact O-N 3.4Å; E10-Y12 VanDerWaalsContact C-N 3.28Å; E10-Y12 PolarHBondContact O-N 3.32Å; Y12-Q175 HydrophobicContact CD1-CB 4.26Å; Y12-Q175 VanDerWaalsContact CD1-CD 3.47Å; Y12-Q175 HydrophobicContact CD1-CG 4.01Å; Y12-Q175 HydrophobicContact CE1-CB 4.16Å; Y12-Q175 HydrophobicContact CE1-CG 4.41Å; Y12-L179 HydrophobicContact CE2-CD1 4.26Å; Y12-L179 HydrophobicContact CE2-CD2 4.34Å
13	L	94.7	Very high	94.7	Very high	133 Å²	133	67 Å²	67	70%	0.696	35%	0.348	S	S	*	.	H	α-helix	trans	-85.9	-26.7	179.9	-64.3	175.3	0	0	0	113.1	E10 S15	E10-L13 PolarHBondContact O-N 2.93Å; L13-S15 VanDerWaalsContact C-N 3.26Å; L13-S15 PolarHBondContact O-N 3.09Å
14	D	96.2	Very high	95.2	Very high	18 Å²	18	65.9 Å²	65.9	10%	0.096	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	44.7	-177	-159.3	27	0	0	0	114.9	E10 R19 Y142 F174	E10-D14 PolarHBondContact O-N 3.39Å; D14-R19 IonicContact OD1-CZ 3.31Å; D14-R19 VanDerWaalsContact OD1-CZ 3.31Å; D14-R19 IonicContact OD1-NE 2.68Å; D14-R19 PolarHBondContact OD1-NE 3.36Å; D14-R19 IonicContact OD1-NH2 3.22Å; D14-R19 PolarHBondContact OD1-NH2 3.48Å; D14-R19 IonicContact OD2-CZ 3.47Å; D14-R19 IonicContact OD2-NE 3.41Å; D14-R19 PolarHBondContact OD2-NE 3.23Å; D14-R19 IonicContact OD2-NH2 2.71Å; D14-R19 PolarHBondContact OD2-NH2 2.91Å; D14-Y142 PolarHBondContact OD2-OH 3.3Å; D14-F174 HydrophobicContact CB-CE1 4.34Å; D14-F174 HydrophobicContact CB-CZ 4.31Å; D14-F174 WeakPolarHBondContact OD2-CZ 3.4Å
15	S	96.8	Very high	95.5	Very high	27 Å²	27	62.9 Å²	62.9	19%	0.189	33%	0.33	C	S	.	.			trans	-69.7	152.1	-171	73.5	0	0	0	0	112.7	L13 S17 F18 R19	L13-S15 VanDerWaalsContact C-N 3.26Å; L13-S15 PolarHBondContact O-N 3.09Å; S15-S17 VanDerWaalsContact C-N 3.25Å; S15-S17 PolarHBondContact O-N 3.48Å; S15-S17 PolarHBondContact OG-OG 3.19Å; S15-S17 VanDerWaalsContact OG-OG 3.12Å; S15-F18 WeakPolarHBondContact O-CB 3.42Å; S15-F18 PolarHBondContact O-N 3.29Å; S15-F18 VanDerWaalsContact OG-CB 3.23Å; S15-F18 WeakPolarHBondContact OG-CB 3.27Å; S15-F18 PolarHBondContact OG-N 3.47Å; S15-F18 VanDerWaalsContact OG-N 3.09Å; S15-R19 PolarHBondContact O-N 3.03Å
16	P	96.8	Very high	95.7	Very high	109 Å²	109	59.9 Å²	59.9	71%	0.708	31%	0.309	S	S	*	.	H	α-helix	trans	-55.8	-39.2	174.7	-27.7	35.8	0	0	0	113.1	R19 E20	P16-R19 PolarHBondContact O-N 3.01Å; P16-E20 WeakPolarHBondContact O-CG 3.36Å; P16-E20 PolarHBondContact O-N 3.18Å
17	S	95.1	Very high	95.8	Very high	65 Å²	65	62 Å²	62	46%	0.455	33%	0.327	S	S	.	.	H	α-helix	trans	-66.3	-36.2	176	47.6	0	0	0	0	112.5	S15 E20 K21	S15-S17 VanDerWaalsContact C-N 3.25Å; S15-S17 PolarHBondContact O-N 3.48Å; S15-S17 PolarHBondContact OG-OG 3.19Å; S15-S17 VanDerWaalsContact OG-OG 3.12Å; S17-E20 PolarHBondContact O-N 2.83Å; S17-K21 WeakPolarHBondContact O-CG 3.35Å; S17-K21 PolarHBondContact O-N 2.95Å; S17-K21 VanDerWaalsContact O-N 3.08Å
18	F	96.6	Very high	95.8	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.1	-44.8	172.5	176.2	-117.3	0	0	0	112.1	L6 E10 S15 E20 K21 I22 V182	L6-F18 HydrophobicContact CB-CE2 4.14Å; L6-F18 HydrophobicContact CD2-CD2 4.12Å; L6-F18 HydrophobicContact CD2-CE2 3.87Å; E10-F18 HydrophobicContact CB-CB 4Å; E10-F18 HydrophobicContact CB-CD1 4.13Å; E10-F18 HydrophobicContact CB-CD2 3.29Å; E10-F18 HydrophobicContact CB-CE1 4.39Å; E10-F18 HydrophobicContact CB-CE2 3.6Å; E10-F18 HydrophobicContact CB-CG 3.56Å; E10-F18 HydrophobicContact CB-CZ 4.13Å; E10-F18 HydrophobicContact CG-CD2 4.09Å; E10-F18 HydrophobicContact CG-CG 4.48Å; S15-F18 WeakPolarHBondContact O-CB 3.42Å; S15-F18 PolarHBondContact O-N 3.29Å; S15-F18 VanDerWaalsContact OG-CB 3.23Å; S15-F18 WeakPolarHBondContact OG-CB 3.27Å; S15-F18 PolarHBondContact OG-N 3.47Å; S15-F18 VanDerWaalsContact OG-N 3.09Å; F18-E20 VanDerWaalsContact C-N 3.26Å; F18-E20 PolarHBondContact O-N 3.04Å; F18-K21 WeakPolarHBondContact O-CB 3.46Å; F18-K21 PolarHBondContact O-N 3.41Å; F18-K21 VanDerWaalsContact O-N 3.09Å; F18-I22 HydrophobicContact CD1-CD1 4.02Å; F18-I22 HydrophobicContact CE1-CD1 3.57Å; F18-I22 HydrophobicContact CE2-CD1 4.34Å; F18-I22 HydrophobicContact CZ-CD1 3.76Å; F18-I22 HydrophobicContact CZ-CG1 4.38Å; F18-I22 PolarHBondContact O-N 3.45Å; F18-V182 HydrophobicContact CZ-CG2 3.75Å
19	R	96.3	Very high	95.7	Very high	49 Å²	49	54.8 Å²	54.8	19%	0.185	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-32.5	173.9	-70	-73.9	-170.7	158.8	0.4	112.4	D14 S15 P16 K23 Y134 T138	D14-R19 IonicContact OD1-CZ 3.31Å; D14-R19 VanDerWaalsContact OD1-CZ 3.31Å; D14-R19 IonicContact OD1-NE 2.68Å; D14-R19 PolarHBondContact OD1-NE 3.36Å; D14-R19 IonicContact OD1-NH2 3.22Å; D14-R19 PolarHBondContact OD1-NH2 3.48Å; D14-R19 IonicContact OD2-CZ 3.47Å; D14-R19 IonicContact OD2-NE 3.41Å; D14-R19 PolarHBondContact OD2-NE 3.23Å; D14-R19 IonicContact OD2-NH2 2.71Å; D14-R19 PolarHBondContact OD2-NH2 2.91Å; S15-R19 PolarHBondContact O-N 3.03Å; P16-R19 PolarHBondContact O-N 3.01Å; R19-K23 VanDerWaalsContact O-CG 3.31Å; R19-K23 WeakPolarHBondContact O-CG 3.47Å; R19-K23 PolarHBondContact O-N 3.31Å; R19-Y134 PolarHBondContact NE-OH 2.88Å; R19-Y134 PolarHBondContact NH1-OH 2.76Å; R19-Y134 VanDerWaalsContact NH1-OH 3.11Å; R19-T138 PolarHBondContact NH1-OG1 3.07Å; R19-T138 VanDerWaalsContact NH2-CG2 3.27Å; R19-T138 PolarHBondContact NH2-OG1 3.01Å
20	E	95.9	Very high	95.7	Very high	137 Å²	137	53.2 Å²	53.2	64%	0.64	28%	0.281	S	S	*	.	H	α-helix	trans	-66.9	-42.7	171.1	-75.3	-178.9	171.6	0	0	112.7	P16 S17 F18 I22 K23 A24	P16-E20 WeakPolarHBondContact O-CG 3.36Å; P16-E20 PolarHBondContact O-N 3.18Å; S17-E20 PolarHBondContact O-N 2.83Å; F18-E20 VanDerWaalsContact C-N 3.26Å; F18-E20 PolarHBondContact O-N 3.04Å; E20-I22 PolarHBondContact O-N 3.11Å; E20-K23 PolarHBondContact O-N 3.03Å; E20-A24 PolarHBondContact O-N 2.97Å
21	K	96.1	Very high	95.6	Very high	55 Å²	55	58.2 Å²	58.2	24%	0.239	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-45.4	173.6	-61.9	170.9	-176.6	167.9	0	111.4	T4 L6 E10 S17 F18 A24 Q25	T4-K21 WeakPolarHBondContact OG1-CG 3.4Å; L6-K21 HydrophobicContact CD2-CB 3.46Å; L6-K21 VanDerWaalsContact CD2-CB 3.46Å; L6-K21 HydrophobicContact CD2-CD 4.29Å; E10-K21 IonicContact OE1-NZ 3.5Å; E10-K21 PolarHBondContact OE1-NZ 2.87Å; E10-K21 IonicContact OE2-NZ 3.81Å; E10-K21 PolarHBondContact OE2-NZ 3.45Å; S17-K21 WeakPolarHBondContact O-CG 3.35Å; S17-K21 PolarHBondContact O-N 2.95Å; S17-K21 VanDerWaalsContact O-N 3.08Å; F18-K21 WeakPolarHBondContact O-CB 3.46Å; F18-K21 PolarHBondContact O-N 3.41Å; F18-K21 VanDerWaalsContact O-N 3.09Å; K21-A24 WeakPolarHBondContact O-CB 3.32Å; K21-A24 PolarHBondContact O-N 3.25Å; K21-Q25 PolarHBondContact O-N 3.46Å; K21-Q25 VanDerWaalsContact O-N 3.11Å
22	I	96.3	Very high	95.5	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.015	31%	0.307	C	S	.	.	H	α-helix	trans	-57.1	-52.8	175.6	-71.3	174.6	0	0	0	110.3	L6 F18 E20 A24 Q25 E26 Y134 Y181 V182 L185	L6-I22 HydrophobicContact CD1-CG1 4.03Å; L6-I22 HydrophobicContact CD2-CG1 3.9Å; F18-I22 HydrophobicContact CD1-CD1 4.02Å; F18-I22 HydrophobicContact CE1-CD1 3.57Å; F18-I22 HydrophobicContact CE2-CD1 4.34Å; F18-I22 HydrophobicContact CZ-CD1 3.76Å; F18-I22 HydrophobicContact CZ-CG1 4.38Å; F18-I22 PolarHBondContact O-N 3.45Å; E20-I22 PolarHBondContact O-N 3.11Å; I22-A24 PolarHBondContact O-N 2.96Å; I22-Q25 PolarHBondContact O-N 3.43Å; I22-E26 HydrophobicContact CG2-CG 4.22Å; I22-E26 WeakPolarHBondContact O-CG 3.48Å; I22-E26 PolarHBondContact O-N 2.84Å; I22-Y134 HydrophobicContact CD1-CE1 4.4Å; I22-Y181 HydrophobicContact CG2-CE1 4.09Å; I22-V182 HydrophobicContact CD1-CG2 4.13Å; I22-L185 HydrophobicContact CG2-CD1 4.02Å
23	K	95.4	Very high	95.5	Very high	135 Å²	135	54 Å²	54	59%	0.587	29%	0.289	S	S	*	.	H	α-helix	trans	-56.9	-35.8	177.9	-74.6	171.8	-177.6	174.8	0	112.8	R19 E20 A27	R19-K23 VanDerWaalsContact O-CG 3.31Å; R19-K23 WeakPolarHBondContact O-CG 3.47Å; R19-K23 PolarHBondContact O-N 3.31Å; E20-K23 PolarHBondContact O-N 3.03Å; K23-A27 VanDerWaalsContact O-CB 3.24Å; K23-A27 WeakPolarHBondContact O-CB 3.26Å; K23-A27 PolarHBondContact O-N 2.8Å
24	A	95.4	Very high	95.6	Very high	48 Å²	48	54.1 Å²	54.1	40%	0.397	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-41.3	175.8	0	0	0	0	0	112.3	L3 E20 K21 I22 E28	L3-A24 HydrophobicContact CD2-CB 4.15Å; E20-A24 PolarHBondContact O-N 2.97Å; K21-A24 WeakPolarHBondContact O-CB 3.32Å; K21-A24 PolarHBondContact O-N 3.25Å; I22-A24 PolarHBondContact O-N 2.96Å; A24-E28 PolarHBondContact O-N 3.05Å
25	Q	95.2	Very high	95.5	Very high	9 Å²	9	59.7 Å²	59.7	4%	0.042	30%	0.304	C	S	.	.	H	α-helix	trans	-67.8	-43.5	174.5	-60.5	-155.8	-4.1	0	0	111.9	L3 T4 L6 K21 I22 A27 E28 L29 Q189	L3-Q25 HydrophobicContact CB-CG 4.49Å; L3-Q25 HydrophobicContact CD1-CB 4.49Å; L3-Q25 HydrophobicContact CD1-CG 4.16Å; L3-Q25 HydrophobicContact CD2-CG 4.32Å; T4-Q25 PolarHBondContact O-NE2 3.01Å; T4-Q25 VanDerWaalsContact O-NE2 3.08Å; L6-Q25 HydrophobicContact CD1-CG 4.4Å; K21-Q25 PolarHBondContact O-N 3.46Å; K21-Q25 VanDerWaalsContact O-N 3.11Å; I22-Q25 PolarHBondContact O-N 3.43Å; Q25-A27 PolarHBondContact O-N 2.91Å; Q25-E28 PolarHBondContact O-N 3Å; Q25-L29 PolarHBondContact O-N 3.41Å; Q25-Q189 PolarHBondContact O-NE2 3.02Å
26	E	95.3	Very high	95.4	Very high	20 Å²	20	58.6 Å²	58.6	9%	0.093	30%	0.296	C	S	.	.	H	α-helix	trans	-57.1	-48.3	175	-70.2	177.6	162.7	0	0	112.2	I22 E28 L29 D30 R131 Y181	I22-E26 HydrophobicContact CG2-CG 4.22Å; I22-E26 WeakPolarHBondContact O-CG 3.48Å; I22-E26 PolarHBondContact O-N 2.84Å; E26-E28 PolarHBondContact O-N 3.39Å; E26-L29 PolarHBondContact O-N 3.27Å; E26-D30 PolarHBondContact O-N 3.01Å; E26-R131 IonicContact OE1-CZ 3.62Å; E26-R131 IonicContact OE1-NE 2.81Å; E26-R131 IonicContact OE1-NH1 3.29Å; E26-R131 IonicContact OE1-NH2 3.33Å; E26-R131 PolarHBondContact OE1-NH2 2.88Å; E26-R131 IonicContact OE2-CZ 3.81Å; E26-R131 IonicContact OE2-NH1 2.8Å; E26-R131 PolarHBondContact OE2-NH1 2.72Å; E26-R131 IonicContact OE2-NH2 3.06Å; E26-R131 PolarHBondContact OE2-NH2 3.45Å; E26-Y181 PolarHBondContact OE1-OH 2.89Å; E26-Y181 VanDerWaalsContact OE1-OH 3.05Å
27	A	95.3	Very high	95.4	Very high	47 Å²	47	58.2 Å²	58.2	39%	0.388	28%	0.283	S	S	.	.	H	α-helix	trans	-64.2	-26.6	-179.4	0	0	0	0	0	112.6	K23 Q25 K31	K23-A27 VanDerWaalsContact O-CB 3.24Å; K23-A27 WeakPolarHBondContact O-CB 3.26Å; K23-A27 PolarHBondContact O-N 2.8Å; Q25-A27 PolarHBondContact O-N 2.91Å; A27-K31 WeakPolarHBondContact O-CG 3.18Å; A27-K31 PolarHBondContact O-N 3.08Å
28	E	94.9	Very high	95.4	Very high	47 Å²	47	58.6 Å²	58.6	22%	0.22	28%	0.278	C	S	.	.	H	α-helix	trans	-75.1	-46.2	173	-166.1	-77.5	157.7	0	0	111.5	L3 A24 Q25 E26 D30 K31 T32 Q189 K192	L3-E28 HydrophobicContact CD1-CB 4.06Å; L3-E28 HydrophobicContact CD1-CG 4.09Å; A24-E28 PolarHBondContact O-N 3.05Å; Q25-E28 PolarHBondContact O-N 3Å; E26-E28 PolarHBondContact O-N 3.39Å; E28-D30 PolarHBondContact O-N 3.38Å; E28-K31 WeakPolarHBondContact O-CA 3.31Å; E28-K31 VanDerWaalsContact O-CB 3.31Å; E28-K31 WeakPolarHBondContact O-CB 3.46Å; E28-K31 PolarHBondContact O-N 3.5Å; E28-T32 PolarHBondContact O-N 3.03Å; E28-T32 PolarHBondContact O-OG1 3.49Å; E28-T32 PolarHBondContact OE1-OG1 2.7Å; E28-Q189 PolarHBondContact OE2-NE2 3.47Å; E28-Q189 PolarHBondContact OE2-OE1 3.37Å; E28-K192 IonicContact OE1-NZ 2.92Å; E28-K192 PolarHBondContact OE1-NZ 3.36Å; E28-K192 IonicContact OE2-NZ 2.7Å; E28-K192 PolarHBondContact OE2-NZ 3.38Å
29	L	94.8	Very high	95.3	Very high	11 Å²	11	61 Å²	61	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-33.1	174.5	-64.1	175.5	0	0	0	112.6	Q25 E26 T32 N33 L124 V127 L185 I188	Q25-L29 PolarHBondContact O-N 3.41Å; E26-L29 PolarHBondContact O-N 3.27Å; L29-T32 PolarHBondContact O-N 3.2Å; L29-N33 WeakPolarHBondContact O-CB 3.49Å; L29-N33 PolarHBondContact O-N 3.12Å; L29-L124 HydrophobicContact CD2-CD2 4.27Å; L29-V127 HydrophobicContact CD1-CG1 4.01Å; L29-L185 HydrophobicContact CD1-CD2 3.71Å; L29-I188 HydrophobicContact CD1-CG2 3.51Å; L29-I188 HydrophobicContact CD2-CG1 4.19Å; L29-I188 HydrophobicContact CD2-CG2 3.89Å; L29-I188 HydrophobicContact CG-CG2 4.36Å
30	D	94.9	Very high	95.3	Very high	43 Å²	43	60 Å²	60	23%	0.23	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-35.5	171.3	-97.2	-33.5	0	0	0	112.7	E26 E28 R34 R128	E26-D30 PolarHBondContact O-N 3.01Å; E28-D30 PolarHBondContact O-N 3.38Å; D30-R34 WeakPolarHBondContact O-CG 3.49Å; D30-R34 PolarHBondContact O-N 2.81Å; D30-R34 PolarHBondContact O-NH1 3.31Å; D30-R128 IonicContact OD1-CZ 3.38Å; D30-R128 VanDerWaalsContact OD1-CZ 3.22Å; D30-R128 IonicContact OD1-NH1 2.78Å; D30-R128 PolarHBondContact OD1-NH1 2.94Å; D30-R128 IonicContact OD1-NH2 2.72Å; D30-R128 PolarHBondContact OD1-NH2 3.37Å
31	K	94.9	Very high	95.3	Very high	131 Å²	131	58.6 Å²	58.6	57%	0.57	28%	0.279	S	S	*	.	H	α-helix	trans	-66.7	-46.1	170.9	-69	165.6	-173.6	175.7	0	110.4	A27 E28 N33 R34 F35	A27-K31 WeakPolarHBondContact O-CG 3.18Å; A27-K31 PolarHBondContact O-N 3.08Å; E28-K31 WeakPolarHBondContact O-CA 3.31Å; E28-K31 VanDerWaalsContact O-CB 3.31Å; E28-K31 WeakPolarHBondContact O-CB 3.46Å; E28-K31 PolarHBondContact O-N 3.5Å; K31-N33 PolarHBondContact O-N 2.89Å; K31-R34 PolarHBondContact O-N 3.22Å; K31-R34 VanDerWaalsContact O-N 3.16Å; K31-F35 PolarHBondContact O-N 2.98Å
32	T	94	Very high	95.3	Very high	19 Å²	19	60 Å²	60	12%	0.117	29%	0.289	C	S	.	.	H	α-helix	trans	-58.2	-45.2	176.7	-54.6	0	0	0	0	112	E28 L29 R34 F35 I36 L124	E28-T32 PolarHBondContact O-N 3.03Å; E28-T32 PolarHBondContact O-OG1 3.49Å; E28-T32 PolarHBondContact OE1-OG1 2.7Å; L29-T32 PolarHBondContact O-N 3.2Å; T32-R34 VanDerWaalsContact C-N 3.34Å; T32-R34 PolarHBondContact O-N 2.71Å; T32-F35 PolarHBondContact O-N 2.68Å; T32-I36 HydrophobicContact CG2-CD1 3.79Å; T32-I36 HydrophobicContact CG2-CG1 4.39Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.41Å; T32-L124 HydrophobicContact CG2-CD1 4.5Å
33	N	95.4	Very high	95.2	Very high	28 Å²	28	60.3 Å²	60.3	15%	0.15	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-41.9	175.3	176	38.4	0	0	0	112.6	L29 K31 K37 R120 L124 R128	L29-N33 WeakPolarHBondContact O-CB 3.49Å; L29-N33 PolarHBondContact O-N 3.12Å; K31-N33 PolarHBondContact O-N 2.89Å; N33-K37 WeakPolarHBondContact O-CB 3.4Å; N33-K37 PolarHBondContact O-N 2.99Å; N33-R120 WeakPolarHBondContact OD1-CG 3.33Å; N33-R120 PolarHBondContact OD1-NE 3Å; N33-L124 HydrophobicContact CB-CD1 3.93Å; N33-R128 PolarHBondContact ND2-NH2 3.02Å
34	R	95.7	Very high	95.3	Very high	135 Å²	135	58.4 Å²	58.4	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-66.2	-43.9	176.5	-73.5	-171.8	-64.6	-87.1	2.6	111.6	D30 K31 T32 K37 E38	D30-R34 WeakPolarHBondContact O-CG 3.49Å; D30-R34 PolarHBondContact O-N 2.81Å; D30-R34 PolarHBondContact O-NH1 3.31Å; K31-R34 PolarHBondContact O-N 3.22Å; K31-R34 VanDerWaalsContact O-N 3.16Å; T32-R34 VanDerWaalsContact C-N 3.34Å; T32-R34 PolarHBondContact O-N 2.71Å; R34-K37 WeakPolarHBondContact O-CB 3.37Å; R34-K37 PolarHBondContact O-N 3.34Å; R34-E38 PolarHBondContact O-N 3.34Å; R34-E38 VanDerWaalsContact O-N 3.13Å
35	F	94.6	Very high	95.3	Very high	136 Å²	136	60 Å²	60	60%	0.596	29%	0.287	S	S	*	.	H	α-helix	trans	-59.4	-51.6	176.9	176.7	-103.3	0	0	0	111.9	K31 T32 K37 E38 L39	K31-F35 PolarHBondContact O-N 2.98Å; T32-F35 PolarHBondContact O-N 2.68Å; F35-K37 VanDerWaalsContact C-N 3.26Å; F35-K37 PolarHBondContact O-N 3.32Å; F35-E38 PolarHBondContact O-N 2.99Å; F35-L39 HydrophobicContact CD1-CD2 4.5Å; F35-L39 HydrophobicContact CE1-CD2 3.69Å; F35-L39 HydrophobicContact CZ-CD2 3.86Å; F35-L39 WeakPolarHBondContact O-CB 3.44Å; F35-L39 PolarHBondContact O-N 3.18Å
36	I	95.4	Very high	95.3	Very high	3 Å²	3	63.7 Å²	63.7	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-34.2	179	-62.8	171.1	0	0	0	111.4	T32 Y40 L116 F119 R120 L124 C196	T32-I36 HydrophobicContact CG2-CD1 3.79Å; T32-I36 HydrophobicContact CG2-CG1 4.39Å; T32-I36 WeakPolarHBondContact O-CG1 3.43Å; T32-I36 PolarHBondContact O-N 3.41Å; I36-Y40 WeakPolarHBondContact O-CB 3.45Å; I36-Y40 PolarHBondContact O-N 3.12Å; I36-L116 HydrophobicContact CG2-CB 4.08Å; I36-L116 HydrophobicContact CG2-CD2 4.28Å; I36-F119 HydrophobicContact CD1-CD1 3.61Å; I36-F119 HydrophobicContact CD1-CE1 3.81Å; I36-R120 HydrophobicContact CG2-CB 4.01Å; I36-R120 HydrophobicContact CG2-CG 4.48Å; I36-L124 HydrophobicContact CD1-CD1 4.25Å; I36-C196 VanDerWaalsContact CD1-SG 3.58Å
37	K	95.6	Very high	95.4	Very high	102 Å²	102	64.1 Å²	64.1	44%	0.443	31%	0.308	S	S	.	.	H	α-helix	trans	-61.4	-49.1	175.6	-176.9	-173	175.2	-163	0	112.2	N33 R34 F35 K41	N33-K37 WeakPolarHBondContact O-CB 3.4Å; N33-K37 PolarHBondContact O-N 2.99Å; R34-K37 WeakPolarHBondContact O-CB 3.37Å; R34-K37 PolarHBondContact O-N 3.34Å; F35-K37 VanDerWaalsContact C-N 3.26Å; F35-K37 PolarHBondContact O-N 3.32Å; K37-K41 PolarHBondContact O-N 2.98Å; K37-K41 VanDerWaalsContact O-N 3.16Å
38	E	96.3	Very high	95.4	Very high	73 Å²	73	66.4 Å²	66.4	34%	0.341	31%	0.314	S	S	.	.	H	α-helix	trans	-72.4	-40.5	179.9	-61.9	-52.2	118.8	0	0	111.1	R34 F35 Y40 K41 D42	R34-E38 PolarHBondContact O-N 3.34Å; R34-E38 VanDerWaalsContact O-N 3.13Å; F35-E38 PolarHBondContact O-N 2.99Å; E38-Y40 VanDerWaalsContact C-N 3.32Å; E38-Y40 PolarHBondContact O-N 3.05Å; E38-K41 CarbonylContact O-C 3.45Å; E38-K41 WeakPolarHBondContact O-CA 3.32Å; E38-K41 WeakPolarHBondContact O-CB 3.27Å; E38-K41 PolarHBondContact O-N 3.45Å; E38-K41 WeakPolarHBondContact OE2-CD 3.37Å; E38-K41 IonicContact OE2-NZ 3.57Å; E38-K41 PolarHBondContact OE2-NZ 2.88Å; E38-D42 PolarHBondContact O-N 3.26Å
39	L	94.3	Very high	95.5	Very high	51 Å²	51	67.1 Å²	67.1	27%	0.267	33%	0.328	S	S	.	.	H	α-helix	trans	-59.3	-40.2	175.9	-175.9	54.2	0	0	0	112.8	F35 D42 G43 L116 M200	F35-L39 HydrophobicContact CD1-CD2 4.5Å; F35-L39 HydrophobicContact CE1-CD2 3.69Å; F35-L39 HydrophobicContact CZ-CD2 3.86Å; F35-L39 WeakPolarHBondContact O-CB 3.44Å; F35-L39 PolarHBondContact O-N 3.18Å; L39-D42 PolarHBondContact O-N 3.02Å; L39-G43 PolarHBondContact O-N 3.19Å; L39-L116 HydrophobicContact CG-CD1 4.5Å; L39-M200 HydrophobicContact CD2-CE 3.39Å; L39-M200 HydrophobicContact CD2-SD 4.12Å; L39-M200 HydrophobicContact CG-CE 4.29Å
40	Y	95.4	Very high	95.6	Very high	28 Å²	28	67.5 Å²	67.5	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-31.8	173.5	175.6	-85.5	0	0	0	112.8	I36 E38 K44 M113 E117	I36-Y40 WeakPolarHBondContact O-CB 3.45Å; I36-Y40 PolarHBondContact O-N 3.12Å; E38-Y40 VanDerWaalsContact C-N 3.32Å; E38-Y40 PolarHBondContact O-N 3.05Å; Y40-K44 HydrophobicContact CE1-CD 3.89Å; Y40-K44 HydrophobicContact CE1-CG 4.47Å; Y40-K44 PolarHBondContact O-N 3.48Å; Y40-K44 WeakPolarHBondContact OH-CE 3.4Å; Y40-K44 PolarHBondContact OH-NZ 2.91Å; Y40-M113 HydrophobicContact CD2-CE 3.71Å; Y40-M113 HydrophobicContact CE2-CB 4.27Å; Y40-M113 HydrophobicContact CE2-CE 3.97Å; Y40-M113 WeakPolarHBondContact CE2-O 3.36Å; Y40-M113 HydrophobicContact CG-CE 4.07Å; Y40-M113 WeakPolarHBondContact O-CE 3.44Å; Y40-E117 HydrophobicContact CD2-CB 4.16Å; Y40-E117 HydrophobicContact CE2-CB 3.65Å; Y40-E117 HydrophobicContact CE2-CG 4.21Å; Y40-E117 WeakPolarHBondContact CE2-OE2 3.44Å; Y40-E117 VanDerWaalsContact CZ-OE2 3.27Å; Y40-E117 PolarHBondContact OH-OE1 2.68Å; Y40-E117 PolarHBondContact OH-OE2 2.62Å
41	K	96.9	Very high	95.7	Very high	106 Å²	106	71.1 Å²	71.1	46%	0.461	35%	0.345	S	S	.	.	H	α-helix	trans	-69.6	-42.6	173.7	169.3	-159.7	174.5	-153.6	0	110.6	K37 E38 K44 N45	K37-K41 PolarHBondContact O-N 2.98Å; K37-K41 VanDerWaalsContact O-N 3.16Å; E38-K41 CarbonylContact O-C 3.45Å; E38-K41 WeakPolarHBondContact O-CA 3.32Å; E38-K41 WeakPolarHBondContact O-CB 3.27Å; E38-K41 PolarHBondContact O-N 3.45Å; E38-K41 WeakPolarHBondContact OE2-CD 3.37Å; E38-K41 IonicContact OE2-NZ 3.57Å; E38-K41 PolarHBondContact OE2-NZ 2.88Å; K41-K44 WeakPolarHBondContact O-CB 3.46Å; K41-K44 PolarHBondContact O-N 3.33Å; K41-N45 VanDerWaalsContact O-CG 3.32Å; K41-N45 PolarHBondContact O-N 3.5Å; K41-N45 PolarHBondContact O-ND2 3.22Å
42	D	95.6	Very high	95.8	Very high	84 Å²	84	70.6 Å²	70.6	45%	0.449	34%	0.344	S	S	.	.	H	α-helix	trans	-70.6	-36.6	178.4	-65.4	-26.5	0	0	0	112.1	E38 L39 K44 N45 L46	E38-D42 PolarHBondContact O-N 3.26Å; L39-D42 PolarHBondContact O-N 3.02Å; D42-K44 VanDerWaalsContact C-N 3.31Å; D42-K44 PolarHBondContact O-N 2.88Å; D42-N45 WeakPolarHBondContact O-CB 3.31Å; D42-N45 PolarHBondContact O-N 3.44Å; D42-N45 VanDerWaalsContact O-N 3.11Å; D42-L46 PolarHBondContact O-N 3.5Å
43	G	94.8	Very high	96	Very high	10 Å²	10	73.6 Å²	73.6	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-58.5	-39	168.7	0	0	0	0	0	113.1	L39 L46 I47	L39-G43 PolarHBondContact O-N 3.19Å; G43-L46 PolarHBondContact O-N 3.12Å; G43-I47 WeakPolarHBondContact O-CG1 3.49Å; G43-I47 PolarHBondContact O-N 2.8Å
44	K	96.2	Very high	96	Very high	96 Å²	96	72.3 Å²	72.3	42%	0.417	35%	0.352	S	S	.	.	H	α-helix	trans	-65.9	-39.9	171.8	-78.9	-171.3	173	176.1	0	112.7	Y40 K41 D42 L46 I47 N48 M113	Y40-K44 HydrophobicContact CE1-CD 3.89Å; Y40-K44 HydrophobicContact CE1-CG 4.47Å; Y40-K44 PolarHBondContact O-N 3.48Å; Y40-K44 WeakPolarHBondContact OH-CE 3.4Å; Y40-K44 PolarHBondContact OH-NZ 2.91Å; K41-K44 WeakPolarHBondContact O-CB 3.46Å; K41-K44 PolarHBondContact O-N 3.33Å; D42-K44 VanDerWaalsContact C-N 3.31Å; D42-K44 PolarHBondContact O-N 2.88Å; K44-L46 VanDerWaalsContact C-N 3.35Å; K44-I47 PolarHBondContact O-N 3.29Å; K44-N48 WeakPolarHBondContact O-CB 3.4Å; K44-N48 PolarHBondContact O-N 2.75Å; K44-N48 PolarHBondContact O-ND2 3.18Å; K44-M113 HydrophobicContact CG-CE 3.78Å
45	N	96.9	Very high	96.1	Very high	82 Å²	82	70.6 Å²	70.6	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-43.3	176.2	-65.4	-27.5	0	0	0	111	K41 D42 N48 A49	K41-N45 VanDerWaalsContact O-CG 3.32Å; K41-N45 PolarHBondContact O-N 3.5Å; K41-N45 PolarHBondContact O-ND2 3.22Å; D42-N45 WeakPolarHBondContact O-CB 3.31Å; D42-N45 PolarHBondContact O-N 3.44Å; D42-N45 VanDerWaalsContact O-N 3.11Å; N45-N48 PolarHBondContact O-N 2.78Å; N45-A49 WeakPolarHBondContact O-CB 3.47Å; N45-A49 PolarHBondContact O-N 2.9Å
46	L	94.9	Very high	96.2	Very high	85 Å²	85	67 Å²	67	45%	0.445	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-47.1	175.8	179.6	62.7	0	0	0	112.4	D42 G43 K44 N48 A49 T50 F203	D42-L46 PolarHBondContact O-N 3.5Å; G43-L46 PolarHBondContact O-N 3.12Å; K44-L46 VanDerWaalsContact C-N 3.35Å; L46-N48 VanDerWaalsContact C-N 3.35Å; L46-N48 PolarHBondContact O-N 2.73Å; L46-A49 PolarHBondContact O-N 2.93Å; L46-T50 WeakPolarHBondContact O-CB 3.39Å; L46-T50 PolarHBondContact O-N 3.4Å; L46-T50 PolarHBondContact O-OG1 3.28Å; L46-F203 HydrophobicContact CD2-CE2 4.1Å; L46-F203 HydrophobicContact CD2-CZ 4.08Å
47	I	95.6	Very high	96.4	Very high	29 Å²	29	69 Å²	69	15%	0.149	36%	0.356	C	S	.	.	H	α-helix	trans	-61.3	-43.9	176.2	-68.9	165.1	0	0	0	110.7	G43 K44 T50 K51 I108 M113	G43-I47 WeakPolarHBondContact O-CG1 3.49Å; G43-I47 PolarHBondContact O-N 2.8Å; K44-I47 PolarHBondContact O-N 3.29Å; I47-T50 PolarHBondContact O-N 2.98Å; I47-K51 WeakPolarHBondContact O-CB 3.4Å; I47-K51 PolarHBondContact O-N 2.81Å; I47-I108 HydrophobicContact CD1-CG2 4.19Å; I47-I108 HydrophobicContact CG1-CG2 4.4Å; I47-M113 HydrophobicContact CD1-CG 3.69Å; I47-M113 HydrophobicContact CD1-SD 4.11Å
48	N	96.6	Very high	96.5	Very high	95 Å²	95	67.8 Å²	67.8	51%	0.508	35%	0.349	S	S	.	.	H	α-helix	trans	-63.1	-44.2	178.1	-78.3	-20.4	0	0	0	112.4	K44 N45 L46 K51 Q52	K44-N48 WeakPolarHBondContact O-CB 3.4Å; K44-N48 PolarHBondContact O-N 2.75Å; K44-N48 PolarHBondContact O-ND2 3.18Å; N45-N48 PolarHBondContact O-N 2.78Å; L46-N48 VanDerWaalsContact C-N 3.35Å; L46-N48 PolarHBondContact O-N 2.73Å; N48-K51 PolarHBondContact O-N 3.28Å; N48-Q52 WeakPolarHBondContact O-CG 3.47Å; N48-Q52 PolarHBondContact O-N 3.16Å
49	A	97.6	Very high	96.5	Very high	62 Å²	62	71.4 Å²	71.4	51%	0.512	36%	0.363	S	S	.	.	H	α-helix	trans	-62.4	-44.4	175.7	0	0	0	0	0	111.7	N45 L46 K51 Q52 L53	N45-A49 WeakPolarHBondContact O-CB 3.47Å; N45-A49 PolarHBondContact O-N 2.9Å; L46-A49 PolarHBondContact O-N 2.93Å; A49-K51 VanDerWaalsContact C-N 3.28Å; A49-K51 PolarHBondContact O-N 3.49Å; A49-Q52 PolarHBondContact O-N 2.98Å; A49-L53 PolarHBondContact O-N 3.12Å
50	T	96.4	Very high	96.7	Very high	20 Å²	20	74.9 Å²	74.9	12%	0.123	38%	0.377	C	S	.	.	H	α-helix	trans	-61.2	-37.4	176.8	-53.4	0	0	0	0	111.7	L46 I47 G54 R101 M104 M105	L46-T50 WeakPolarHBondContact O-CB 3.39Å; L46-T50 PolarHBondContact O-N 3.4Å; L46-T50 PolarHBondContact O-OG1 3.28Å; I47-T50 PolarHBondContact O-N 2.98Å; T50-G54 PolarHBondContact O-N 2.73Å; T50-R101 HydrophobicContact CG2-CG 3.67Å; T50-M104 HydrophobicContact CG2-CE 3.91Å; T50-M105 HydrophobicContact CG2-CE 4.49Å; T50-M105 HydrophobicContact CG2-CG 3.62Å; T50-M105 HydrophobicContact CG2-SD 3.56Å; T50-M105 VanDerWaalsContact CG2-SD 3.56Å
51	K	96.5	Very high	96.8	Very high	118 Å²	118	73.6 Å²	73.6	51%	0.513	37%	0.371	S	S	.	.	H	α-helix	trans	-66.1	-42.3	174.5	-175.9	179	179	179.2	0	112.5	I47 N48 A49 G54 M55 M105	I47-K51 WeakPolarHBondContact O-CB 3.4Å; I47-K51 PolarHBondContact O-N 2.81Å; N48-K51 PolarHBondContact O-N 3.28Å; A49-K51 VanDerWaalsContact C-N 3.28Å; A49-K51 PolarHBondContact O-N 3.49Å; K51-G54 PolarHBondContact O-N 3.41Å; K51-M55 HydrophobicContact CG-SD 4.26Å; K51-M55 WeakPolarHBondContact O-CG 3.4Å; K51-M55 PolarHBondContact O-N 2.95Å; K51-M105 HydrophobicContact CB-SD 4.11Å
52	Q	97.3	Very high	96.8	Very high	121 Å²	121	73.3 Å²	73.3	57%	0.565	37%	0.372	S	S	*	.	H	α-helix	trans	-64.5	-43.4	177.1	-66.2	-58.5	-24.3	0	0	111.7	N48 A49 G54 M55 A56	N48-Q52 WeakPolarHBondContact O-CG 3.47Å; N48-Q52 PolarHBondContact O-N 3.16Å; A49-Q52 PolarHBondContact O-N 2.98Å; Q52-G54 VanDerWaalsContact C-N 3.34Å; Q52-G54 PolarHBondContact O-N 2.72Å; Q52-M55 PolarHBondContact O-N 3.47Å; Q52-A56 PolarHBondContact O-N 3.06Å
53	L	97.2	Very high	96.9	Very high	81 Å²	81	72.7 Å²	72.7	42%	0.424	37%	0.373	S	S	.	.	H	α-helix	trans	-55.2	-50.4	172	174.5	62.7	0	0	0	110.9	A49 M55 A56 Q57	A49-L53 PolarHBondContact O-N 3.12Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.31Å; L53-A56 PolarHBondContact O-N 2.91Å; L53-A56 VanDerWaalsContact O-N 3.14Å; L53-Q57 HydrophobicContact CD1-CG 4.02Å; L53-Q57 HydrophobicContact CG-CG 4.5Å; L53-Q57 VanDerWaalsContact CG-OE1 3.3Å; L53-Q57 WeakPolarHBondContact O-CG 2.95Å; L53-Q57 PolarHBondContact O-N 2.99Å
54	G	97	Very high	96.9	Very high	1 Å²	1	73.6 Å²	73.6	1%	0.01	38%	0.376	C	S	.	.	H	α-helix	trans	-68.7	-25.9	-178.2	0	0	0	0	0	115	T50 K51 Q52 R58 E98	T50-G54 PolarHBondContact O-N 2.73Å; K51-G54 PolarHBondContact O-N 3.41Å; Q52-G54 VanDerWaalsContact C-N 3.34Å; Q52-G54 PolarHBondContact O-N 2.72Å; G54-R58 WeakPolarHBondContact O-CB 3.41Å; G54-R58 WeakPolarHBondContact O-CD 3.36Å; G54-R58 WeakPolarHBondContact O-CG 3.24Å; G54-R58 PolarHBondContact O-N 3.22Å; G54-R58 VanDerWaalsContact O-N 3.13Å; G54-R58 PolarHBondContact O-NH1 3.29Å; G54-E98 WeakPolarHBondContact CA-OE2 3.33Å
55	M	96.6	Very high	96.8	Very high	100 Å²	100	70.3 Å²	70.3	49%	0.493	37%	0.368	S	S	.	.	H	α-helix	trans	-69.9	-44	169	-74.3	173.6	57.1	0	0	111.4	K51 Q52 L53 K59	K51-M55 HydrophobicContact CG-SD 4.26Å; K51-M55 WeakPolarHBondContact O-CG 3.4Å; K51-M55 PolarHBondContact O-N 2.95Å; Q52-M55 PolarHBondContact O-N 3.47Å; L53-M55 VanDerWaalsContact C-N 3.32Å; L53-M55 PolarHBondContact O-N 3.31Å; M55-K59 PolarHBondContact O-N 3.11Å
56	A	98.1	Very high	96.6	Very high	60 Å²	60	72.5 Å²	72.5	50%	0.496	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.3	0	0	0	0	0	112	Q52 L53 K59 F60	Q52-A56 PolarHBondContact O-N 3.06Å; L53-A56 PolarHBondContact O-N 2.91Å; L53-A56 VanDerWaalsContact O-N 3.14Å; A56-K59 PolarHBondContact O-N 3.04Å; A56-F60 PolarHBondContact O-N 3.09Å
57	Q	97.9	Very high	96.4	Very high	44 Å²	44	73.8 Å²	73.8	21%	0.206	38%	0.378	C	S	.	.	H	α-helix	trans	-66.4	-40.7	178.7	-68.3	-170.2	-93.4	0	0	112.5	L53 K59 F60 A61 E98	L53-Q57 HydrophobicContact CD1-CG 4.02Å; L53-Q57 HydrophobicContact CG-CG 4.5Å; L53-Q57 VanDerWaalsContact CG-OE1 3.3Å; L53-Q57 WeakPolarHBondContact O-CG 2.95Å; L53-Q57 PolarHBondContact O-N 2.99Å; Q57-K59 PolarHBondContact O-N 3.22Å; Q57-F60 PolarHBondContact O-N 2.87Å; Q57-A61 WeakPolarHBondContact O-CB 3.26Å; Q57-A61 PolarHBondContact O-N 3.11Å; Q57-E98 HydrophobicContact CB-CG 3.79Å; Q57-E98 PolarHBondContact OE1-OE1 3.29Å
58	R	97.8	Very high	96	Very high	78 Å²	78	80.2 Å²	80.2	29%	0.294	41%	0.408	S	S	.	.	H	α-helix	trans	-59.7	-43.4	172	-77.8	171.2	-177.1	69.7	-1.4	112.1	G54 A61 Q62 E98 E102	G54-R58 WeakPolarHBondContact O-CB 3.41Å; G54-R58 WeakPolarHBondContact O-CD 3.36Å; G54-R58 WeakPolarHBondContact O-CG 3.24Å; G54-R58 PolarHBondContact O-N 3.22Å; G54-R58 VanDerWaalsContact O-N 3.13Å; G54-R58 PolarHBondContact O-NH1 3.29Å; R58-A61 PolarHBondContact O-N 3.23Å; R58-Q62 PolarHBondContact O-N 2.71Å; R58-E98 HydrophobicContact CG-CB 4.13Å; R58-E98 HydrophobicContact CG-CG 4.36Å; R58-E98 IonicContact NH1-OE2 2.76Å; R58-E98 PolarHBondContact NH1-OE2 2.95Å; R58-E98 PolarHBondContact NH2-O 3.48Å; R58-E102 IonicContact CZ-OE2 2.64Å; R58-E102 IonicContact NH2-OE2 4Å; R58-E102 PolarHBondContact NH2-OE2 2.98Å
59	K	97.5	Very high	95.6	Very high	148 Å²	148	79.6 Å²	79.6	64%	0.643	40%	0.401	S	S	*	.	H	α-helix	trans	-64.7	-44.1	177.9	-175.3	178.8	178.1	-177.5	0	111.8	M55 A56 Q57 Q62 C63	M55-K59 PolarHBondContact O-N 3.11Å; A56-K59 PolarHBondContact O-N 3.04Å; Q57-K59 PolarHBondContact O-N 3.22Å; K59-Q62 WeakPolarHBondContact O-CB 3.5Å; K59-Q62 PolarHBondContact O-N 3.08Å; K59-C63 PolarHBondContact O-N 3.09Å; K59-C63 VanDerWaalsContact O-N 3.11Å; K59-C63 PolarHBondContact O-SG 2.9Å; K59-C63 VanDerWaalsContact O-SG 3.4Å
60	F	97.9	Very high	95.1	Very high	125 Å²	125	86 Å²	86	55%	0.548	42%	0.42	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.7	-179.7	-116.7	0	0	0	111.5	A56 Q57 Q62 C63 L64 L94	A56-F60 PolarHBondContact O-N 3.09Å; Q57-F60 PolarHBondContact O-N 2.87Å; F60-Q62 VanDerWaalsContact C-N 3.3Å; F60-Q62 PolarHBondContact O-N 2.7Å; F60-C63 PolarHBondContact O-N 3.18Å; F60-L64 HydrophobicContact CD1-CD1 4.2Å; F60-L64 HydrophobicContact CE1-CD1 3.79Å; F60-L64 HydrophobicContact CE1-CG 4.38Å; F60-L64 HydrophobicContact CE2-CD2 4.4Å; F60-L64 HydrophobicContact CZ-CD1 4.08Å; F60-L64 HydrophobicContact CZ-CD2 4.14Å; F60-L64 HydrophobicContact CZ-CG 4.27Å; F60-L64 PolarHBondContact O-N 3.49Å; F60-L64 VanDerWaalsContact O-N 3.12Å; F60-L94 HydrophobicContact CD1-CD1 3.86Å; F60-L94 HydrophobicContact CE1-CD1 4.14Å
61	A	97.9	Very high	94.5	Very high	0 Å²	0	90.5 Å²	90.5	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-58.5	-39.8	174.1	0	0	0	0	0	112.3	Q57 R58 L64 G65 S91 L94 K95	Q57-A61 WeakPolarHBondContact O-CB 3.26Å; Q57-A61 PolarHBondContact O-N 3.11Å; R58-A61 PolarHBondContact O-N 3.23Å; A61-L64 PolarHBondContact O-N 3.11Å; A61-G65 PolarHBondContact O-N 3.39Å; A61-S91 VanDerWaalsContact O-CB 3.22Å; A61-S91 WeakPolarHBondContact O-CB 3.5Å; A61-S91 PolarHBondContact O-OG 3.31Å; A61-L94 HydrophobicContact CB-CB 3.7Å; A61-L94 HydrophobicContact CB-CD1 4.16Å; A61-K95 HydrophobicContact CB-CG 4.16Å
62	Q	96.8	Very high	93.7	Very high	101 Å²	101	91 Å²	91	47%	0.472	44%	0.443	S	S	.	.	H	α-helix	trans	-59.9	-49.5	174.4	-179.6	176.9	-3.7	0	0	111.7	R58 K59 F60 L64 G65 E66	R58-Q62 PolarHBondContact O-N 2.71Å; K59-Q62 WeakPolarHBondContact O-CB 3.5Å; K59-Q62 PolarHBondContact O-N 3.08Å; F60-Q62 VanDerWaalsContact C-N 3.3Å; F60-Q62 PolarHBondContact O-N 2.7Å; Q62-L64 VanDerWaalsContact C-N 3.27Å; Q62-L64 PolarHBondContact O-N 2.92Å; Q62-G65 PolarHBondContact O-N 3.19Å; Q62-E66 HydrophobicContact CG-CG 4.41Å; Q62-E66 VanDerWaalsContact CG-OE1 3.23Å; Q62-E66 WeakPolarHBondContact CG-OE1 3.35Å; Q62-E66 PolarHBondContact NE2-OE1 3.18Å; Q62-E66 PolarHBondContact O-N 3.5Å; Q62-E66 VanDerWaalsContact O-N 3.13Å
63	C	96.5	Very high	93	Very high	70 Å²	70	87.2 Å²	87.2	47%	0.473	44%	0.436	S	S	.	.	H	α-helix	trans	-59.5	-34.9	179.2	-62.9	0	0	0	0	113.3	K59 F60	K59-C63 PolarHBondContact O-N 3.09Å; K59-C63 VanDerWaalsContact O-N 3.11Å; K59-C63 PolarHBondContact O-SG 2.9Å; K59-C63 VanDerWaalsContact O-SG 3.4Å; F60-C63 PolarHBondContact O-N 3.18Å
64	L	95.6	Very high	92.4	Very high	30 Å²	30	88.6 Å²	88.6	16%	0.157	44%	0.443	C	S	.	.	H	α-helix	trans	-65.3	-40.6	173.7	-65.5	175.4	0	0	0	112.2	F60 A61 Q62 L87 F90 L94	F60-L64 HydrophobicContact CD1-CD1 4.2Å; F60-L64 HydrophobicContact CE1-CD1 3.79Å; F60-L64 HydrophobicContact CE1-CG 4.38Å; F60-L64 HydrophobicContact CE2-CD2 4.4Å; F60-L64 HydrophobicContact CZ-CD1 4.08Å; F60-L64 HydrophobicContact CZ-CD2 4.14Å; F60-L64 HydrophobicContact CZ-CG 4.27Å; F60-L64 PolarHBondContact O-N 3.49Å; F60-L64 VanDerWaalsContact O-N 3.12Å; A61-L64 PolarHBondContact O-N 3.11Å; Q62-L64 VanDerWaalsContact C-N 3.27Å; Q62-L64 PolarHBondContact O-N 2.92Å; L64-L87 HydrophobicContact CB-CB 4.34Å; L64-L87 WeakPolarHBondContact CB-O 3.43Å; L64-L87 HydrophobicContact CD2-CD2 4.41Å; L64-L87 WeakPolarHBondContact O-CB 3.5Å; L64-F90 HydrophobicContact CD1-CB 4.12Å; L64-L94 HydrophobicContact CD1-CD1 3.93Å
65	G	93.6	Very high	92	Very high	26 Å²	26	89.1 Å²	89.1	27%	0.268	45%	0.448	S	S	.	.	H	α-helix	trans	-80.5	-10.6	-176.7	0	0	0	0	0	115.6	A61 Q62 Q88	A61-G65 PolarHBondContact O-N 3.39Å; Q62-G65 PolarHBondContact O-N 3.19Å; G65-Q88 PolarHBondContact O-OE1 2.88Å
66	E	93.2	Very high	91.7	Very high	129 Å²	129	85.7 Å²	85.7	60%	0.603	43%	0.43	S	S	*	.	H	α-helix	trans	-92.8	-12.9	175	-71.9	172.5	178.6	0	0	112.7	Q62	Q62-E66 HydrophobicContact CG-CG 4.41Å; Q62-E66 VanDerWaalsContact CG-OE1 3.23Å; Q62-E66 WeakPolarHBondContact CG-OE1 3.35Å; Q62-E66 PolarHBondContact NE2-OE1 3.18Å; Q62-E66 PolarHBondContact O-N 3.5Å; Q62-E66 VanDerWaalsContact O-N 3.13Å
67	F	90.9	Very high	91.4	Very high	111 Å²	111	83 Å²	83	49%	0.487	41%	0.408	S	S	.	.			trans	-80	140.9	-179.7	-169.6	-84.4	0	0	0	111.8	F69 L87	F67-F69 HydrophobicContact CD1-CD2 4.02Å; F67-F69 AromaticContact CD1-CE2 3.92Å; F67-F69 HydrophobicContact CD1-CE2 3.92Å; F67-F69 HydrophobicContact CD1-CG 4.48Å; F67-F69 HydrophobicContact CD1-CZ 4.27Å; F67-F69 AromaticContact CE1-CD1 3.82Å; F67-F69 HydrophobicContact CE1-CD1 3.82Å; F67-F69 AromaticContact CE1-CD2 3.78Å; F67-F69 HydrophobicContact CE1-CD2 3.78Å; F67-F69 AromaticContact CE1-CE1 3.81Å; F67-F69 HydrophobicContact CE1-CE1 3.81Å; F67-F69 AromaticContact CE1-CE2 3.8Å; F67-F69 HydrophobicContact CE1-CE2 3.8Å; F67-F69 AromaticContact CE1-CG 3.81Å; F67-F69 HydrophobicContact CE1-CG 3.81Å; F67-F69 AromaticContact CE1-CZ 3.81Å; F67-F69 HydrophobicContact CE1-CZ 3.81Å; F67-L87 HydrophobicContact CB-CD1 3.94Å; F67-L87 HydrophobicContact CD1-CD1 3.52Å; F67-L87 HydrophobicContact CE1-CD1 4.29Å; F67-L87 HydrophobicContact CG-CD1 3.9Å
68	Q	87.1	Confident	91	Very high	164 Å²	164	83.8 Å²	83.8	77%	0.766	41%	0.413	S	S	*	.			trans	-135.8	139.5	174.5	-63.8	-177.4	-3.3	0	0	109.2
69	F	87.4	Confident	90.7	Very high	82 Å²	82	81 Å²	81	36%	0.36	40%	0.404	S	S	.	.			trans	-87	116.9	178.4	-65.7	-100.6	0	0	0	110.9	F67 K76 D84 L87	F67-F69 HydrophobicContact CD1-CD2 4.02Å; F67-F69 AromaticContact CD1-CE2 3.92Å; F67-F69 HydrophobicContact CD1-CE2 3.92Å; F67-F69 HydrophobicContact CD1-CG 4.48Å; F67-F69 HydrophobicContact CD1-CZ 4.27Å; F67-F69 AromaticContact CE1-CD1 3.82Å; F67-F69 HydrophobicContact CE1-CD1 3.82Å; F67-F69 AromaticContact CE1-CD2 3.78Å; F67-F69 HydrophobicContact CE1-CD2 3.78Å; F67-F69 AromaticContact CE1-CE1 3.81Å; F67-F69 HydrophobicContact CE1-CE1 3.81Å; F67-F69 AromaticContact CE1-CE2 3.8Å; F67-F69 HydrophobicContact CE1-CE2 3.8Å; F67-F69 AromaticContact CE1-CG 3.81Å; F67-F69 HydrophobicContact CE1-CG 3.81Å; F67-F69 AromaticContact CE1-CZ 3.81Å; F67-F69 HydrophobicContact CE1-CZ 3.81Å; F69-K76 PolarHBondContact O-NZ 2.9Å; F69-D84 WeakPolarHBondContact CB-OD1 3.41Å; F69-D84 HydrophobicContact CD2-CB 4.38Å; F69-D84 WeakPolarHBondContact CD2-OD1 3.28Å; F69-D84 PolarHBondContact N-OD1 3.06Å; F69-L87 HydrophobicContact CE2-CD1 3.79Å; F69-L87 HydrophobicContact CE2-CG 4.07Å; F69-L87 HydrophobicContact CZ-CD1 4Å; F69-L87 HydrophobicContact CZ-CG 4.44Å
70	E	87.2	Confident	90.4	Very high	196 Å²	196	76.3 Å²	76.3	92%	0.916	39%	0.385	S	S	*	.			trans	-60.4	149	158.2	-65.3	-172.1	173.1	0	0	110.2
71	Y	84	Confident	90.1	Very high	115 Å²	115	73.7 Å²	73.7	45%	0.451	37%	0.373	S	S	.	.			trans	-142.6	159.3	-176.9	72.5	-77.1	0	0	0	111.5	A75 K76	Y71-A75 VanDerWaalsContact CE2-C 3.45Å; Y71-K76 HydrophobicContact CD1-CD 4.1Å; Y71-K76 HydrophobicContact CD1-CG 3.91Å; Y71-K76 HydrophobicContact CD2-CG 3.71Å; Y71-K76 HydrophobicContact CE1-CD 4.35Å; Y71-K76 HydrophobicContact CE1-CG 4Å; Y71-K76 HydrophobicContact CE2-CG 3.82Å; Y71-K76 HydrophobicContact CG-CD 4.25Å; Y71-K76 VanDerWaalsContact CG-CE 3.49Å; Y71-K76 HydrophobicContact CG-CG 3.73Å
72	I	80.1	Confident	89.8	Confident	130 Å²	130	74.7 Å²	74.7	67%	0.667	38%	0.38	S	S	*	.	S	Bend	trans	-107.5	133.6	-178.3	-53.5	176.7	0	0	0	108.9	M553	I72-M553 HydrophobicContact CG2-CE 3.38Å; I72-M553 HydrophobicContact CG2-SD 3.82Å
73	G	83.3	Confident	89.6	Confident	40 Å²	40	71.6 Å²	71.6	41%	0.412	37%	0.366	S	S	.	.	S	Bend	trans	112.6	-175.9	-175.5	0	0	0	0	0	112.3
74	D	84.2	Confident	89.4	Confident	110 Å²	110	70.1 Å²	70.1	59%	0.588	35%	0.353	S	S	*	.	S	Bend	trans	-95	-10.3	-178.3	61.5	-18.2	0	0	0	114	K483	D74-K483 WeakPolarHBondContact OD1-CE 3.33Å; D74-K483 IonicContact OD1-NZ 2.63Å; D74-K483 PolarHBondContact OD1-NZ 2.99Å; D74-K483 IonicContact OD2-NZ 3.76Å; D74-K483 PolarHBondContact OD2-NZ 3.47Å
75	A	88.9	Confident	89.2	Confident	13 Å²	13	74.6 Å²	74.6	11%	0.107	37%	0.373	C	S	.	.			trans	-151.4	158.2	174.8	0	0	0	0	0	113.7	Y71 K483 K556 F557	Y71-A75 VanDerWaalsContact CE2-C 3.45Å; A75-K483 HydrophobicContact CB-CB 3.89Å; A75-K483 HydrophobicContact CB-CD 4.45Å; A75-K483 HydrophobicContact CB-CG 4.19Å; A75-K556 WeakPolarHBondContact O-CE 3.24Å; A75-K556 PolarHBondContact O-NZ 3.27Å; A75-F557 HydrophobicContact CB-CE1 4.3Å; A75-F557 HydrophobicContact CB-CZ 3.72Å
76	K	90.1	Very high	89.4	Confident	28 Å²	28	73.7 Å²	73.7	12%	0.122	36%	0.363	C	S	.	.			trans	-94.2	137.6	165.6	-64.2	-169.6	-176.8	-168.9	0	110.3	F69 Y71 E80 K81 D84	F69-K76 PolarHBondContact O-NZ 2.9Å; Y71-K76 HydrophobicContact CD1-CD 4.1Å; Y71-K76 HydrophobicContact CD1-CG 3.91Å; Y71-K76 HydrophobicContact CD2-CG 3.71Å; Y71-K76 HydrophobicContact CE1-CD 4.35Å; Y71-K76 HydrophobicContact CE1-CG 4Å; Y71-K76 HydrophobicContact CE2-CG 3.82Å; Y71-K76 HydrophobicContact CG-CD 4.25Å; Y71-K76 VanDerWaalsContact CG-CE 3.49Å; Y71-K76 HydrophobicContact CG-CG 3.73Å; K76-E80 HydrophobicContact CB-CB 4.06Å; K76-E80 HydrophobicContact CG-CB 4.47Å; K76-K81 HydrophobicContact CB-CG 3.88Å; K76-K81 HydrophobicContact CD-CG 4.47Å; K76-K81 WeakPolarHBondContact O-CE 3.43Å; K76-K81 PolarHBondContact O-NZ 3.24Å; K76-D84 IonicContact NZ-OD1 2.74Å; K76-D84 PolarHBondContact NZ-OD1 3.4Å; K76-D84 IonicContact NZ-OD2 3.18Å; K76-D84 PolarHBondContact NZ-OD2 3.16Å
77	T	90.9	Very high	89.5	Confident	3 Å²	3	69.2 Å²	69.2	2%	0.018	34%	0.343	C	S	.	.			trans	-66.4	166.2	162.6	61.2	0	0	0	0	110.7	E80 K81 K556 F557 I560	T77-E80 WeakPolarHBondContact CB-OE2 3.45Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.41Å; T77-E80 PolarHBondContact N-OE2 3.29Å; T77-E80 PolarHBondContact O-N 3.05Å; T77-E80 WeakPolarHBondContact OG1-CB 3.24Å; T77-E80 VanDerWaalsContact OG1-CD 3.29Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-N 2.99Å; T77-E80 PolarHBondContact OG1-OE2 3.34Å; T77-K81 WeakPolarHBondContact O-CG 3.23Å; T77-K81 PolarHBondContact O-N 2.95Å; T77-K556 HydrophobicContact CG2-CB 4.09Å; T77-K556 HydrophobicContact CG2-CD 3.85Å; T77-K556 HydrophobicContact CG2-CG 3.75Å; T77-F557 HydrophobicContact CG2-CD1 4.23Å; T77-F557 HydrophobicContact CG2-CE1 3.84Å; T77-F557 HydrophobicContact CG2-CZ 4.46Å; T77-I560 HydrophobicContact CG2-CD1 3.47Å; T77-I560 VanDerWaalsContact CG2-CD1 3.47Å
78	D	90.6	Very high	89.7	Confident	60 Å²	60	67.8 Å²	67.8	32%	0.321	34%	0.338	S	S	.	.	H	α-helix	trans	-69.9	-34.3	-178.9	-61.1	-25.9	0	0	0	112.3	K81 C82 R490	D78-K81 PolarHBondContact O-N 3.03Å; D78-K81 IonicContact OD1-NZ 3.64Å; D78-K81 PolarHBondContact OD1-NZ 3.08Å; D78-C82 WeakPolarHBondContact O-CB 3.44Å; D78-C82 PolarHBondContact O-N 3.45Å; D78-R490 IonicContact OD1-NH1 2.8Å; D78-R490 IonicContact OD2-CZ 2.84Å; D78-R490 IonicContact OD2-NH1 3.23Å; D78-R490 PolarHBondContact OD2-NH1 3.23Å; D78-R490 IonicContact OD2-NH2 2.84Å; D78-R490 PolarHBondContact OD2-NH2 3.02Å
79	D	91.9	Very high	90.1	Very high	20 Å²	20	63 Å²	63	11%	0.107	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-44.2	171.5	-61.8	-15.6	0	0	0	111.2	K81 C82 I83 N231 N234 R238	D79-K81 VanDerWaalsContact C-N 3.3Å; D79-K81 PolarHBondContact O-N 2.99Å; D79-C82 PolarHBondContact O-N 2.92Å; D79-I83 WeakPolarHBondContact O-CD1 3.41Å; D79-I83 VanDerWaalsContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG1 3.24Å; D79-I83 PolarHBondContact O-N 2.93Å; D79-N231 HydrophobicContact CB-CB 4.09Å; D79-N231 PolarHBondContact OD1-OD1 2.97Å; D79-N234 WeakPolarHBondContact OD2-CB 3.41Å; D79-R238 IonicContact OD2-CZ 2.73Å; D79-R238 IonicContact OD2-NH1 2.7Å; D79-R238 PolarHBondContact OD2-NH1 2.96Å; D79-R238 IonicContact OD2-NH2 3.15Å; D79-R238 PolarHBondContact OD2-NH2 2.65Å
80	E	90.9	Very high	90.5	Very high	50 Å²	50	62.4 Å²	62.4	23%	0.234	31%	0.313	C	S	.	.	H	α-helix	trans	-62.4	-34.8	175.7	-76	166.9	138.9	0	0	112.2	K76 T77 D84 K556	K76-E80 HydrophobicContact CB-CB 4.06Å; K76-E80 HydrophobicContact CG-CB 4.47Å; T77-E80 WeakPolarHBondContact CB-OE2 3.45Å; T77-E80 WeakPolarHBondContact CG2-OE2 3.41Å; T77-E80 PolarHBondContact N-OE2 3.29Å; T77-E80 PolarHBondContact O-N 3.05Å; T77-E80 WeakPolarHBondContact OG1-CB 3.24Å; T77-E80 VanDerWaalsContact OG1-CD 3.29Å; T77-E80 WeakPolarHBondContact OG1-CG 3.43Å; T77-E80 PolarHBondContact OG1-N 2.99Å; T77-E80 PolarHBondContact OG1-OE2 3.34Å; E80-D84 VanDerWaalsContact O-CB 3.29Å; E80-D84 WeakPolarHBondContact O-CB 3.43Å; E80-D84 PolarHBondContact O-N 2.93Å; E80-K556 VanDerWaalsContact CD-NZ 3.27Å; E80-K556 IonicContact OE1-NZ 3.16Å; E80-K556 PolarHBondContact OE1-NZ 2.97Å; E80-K556 IonicContact OE2-NZ 3.31Å; E80-K556 PolarHBondContact OE2-NZ 3.02Å
81	K	90.9	Very high	91	Very high	69 Å²	69	53 Å²	53	30%	0.3	27%	0.269	S	S	.	.	H	α-helix	trans	-69.6	-44.6	173.6	-65.4	165.5	-157.3	155.4	0	111.6	K76 T77 D78 D79 I83 D84 E85	K76-K81 HydrophobicContact CB-CG 3.88Å; K76-K81 HydrophobicContact CD-CG 4.47Å; K76-K81 WeakPolarHBondContact O-CE 3.43Å; K76-K81 PolarHBondContact O-NZ 3.24Å; T77-K81 WeakPolarHBondContact O-CG 3.23Å; T77-K81 PolarHBondContact O-N 2.95Å; D78-K81 PolarHBondContact O-N 3.03Å; D78-K81 IonicContact OD1-NZ 3.64Å; D78-K81 PolarHBondContact OD1-NZ 3.08Å; D79-K81 VanDerWaalsContact C-N 3.3Å; D79-K81 PolarHBondContact O-N 2.99Å; K81-I83 VanDerWaalsContact C-N 3.28Å; K81-I83 PolarHBondContact O-N 3.28Å; K81-D84 WeakPolarHBondContact O-CB 3.45Å; K81-D84 PolarHBondContact O-N 3.36Å; K81-D84 VanDerWaalsContact O-N 3.17Å; K81-E85 WeakPolarHBondContact O-CB 3.38Å; K81-E85 WeakPolarHBondContact O-CG 3.41Å; K81-E85 PolarHBondContact O-N 3.24Å
82	C	92.4	Very high	91.6	Very high	22 Å²	22	50.7 Å²	50.7	15%	0.149	26%	0.263	C	S	.	.	H	α-helix	trans	-60.2	-39.5	177.6	-177.8	0	0	0	0	111.8	D78 D79 S86 N231	D78-C82 WeakPolarHBondContact O-CB 3.44Å; D78-C82 PolarHBondContact O-N 3.45Å; D79-C82 PolarHBondContact O-N 2.92Å; C82-S86 PolarHBondContact O-N 2.91Å; C82-N231 PolarHBondContact SG-ND2 3.34Å
83	I	92.6	Very high	92.5	Very high	35 Å²	35	46.5 Å²	46.5	18%	0.179	24%	0.24	C	C	.	.	H	α-helix	trans	-68.5	-42.4	174.6	-66.6	164.7	0	0	0	111	D79 K81 E85 S86 L228 I232 T235	D79-I83 WeakPolarHBondContact O-CD1 3.41Å; D79-I83 VanDerWaalsContact O-CG1 3.26Å; D79-I83 WeakPolarHBondContact O-CG1 3.24Å; D79-I83 PolarHBondContact O-N 2.93Å; K81-I83 VanDerWaalsContact C-N 3.28Å; K81-I83 PolarHBondContact O-N 3.28Å; I83-E85 PolarHBondContact O-N 2.92Å; I83-S86 WeakPolarHBondContact O-CB 3.39Å; I83-S86 PolarHBondContact O-N 3.28Å; I83-S86 VanDerWaalsContact O-N 3.16Å; I83-S86 PolarHBondContact O-OG 3.45Å; I83-L228 HydrophobicContact CG1-CD1 4.06Å; I83-I232 HydrophobicContact CD1-CG1 4.01Å; I83-I232 HydrophobicContact CG1-CG1 3.93Å; I83-T235 HydrophobicContact CD1-CG2 4.14Å; I83-T235 WeakPolarHBondContact CD1-OG1 3.38Å
84	D	90.7	Very high	93.2	Very high	39 Å²	39	46 Å²	46	21%	0.209	23%	0.228	C	C	.	.	H	α-helix	trans	-59.9	-44.6	176.9	-172.2	46.1	0	0	0	112.2	F69 K76 E80 K81 S86	F69-D84 WeakPolarHBondContact CB-OD1 3.41Å; F69-D84 HydrophobicContact CD2-CB 4.38Å; F69-D84 WeakPolarHBondContact CD2-OD1 3.28Å; F69-D84 PolarHBondContact N-OD1 3.06Å; K76-D84 IonicContact NZ-OD1 2.74Å; K76-D84 PolarHBondContact NZ-OD1 3.4Å; K76-D84 IonicContact NZ-OD2 3.18Å; K76-D84 PolarHBondContact NZ-OD2 3.16Å; E80-D84 VanDerWaalsContact O-CB 3.29Å; E80-D84 WeakPolarHBondContact O-CB 3.43Å; E80-D84 PolarHBondContact O-N 2.93Å; K81-D84 WeakPolarHBondContact O-CB 3.45Å; K81-D84 PolarHBondContact O-N 3.36Å; K81-D84 VanDerWaalsContact O-N 3.17Å; D84-S86 VanDerWaalsContact C-N 3.26Å; D84-S86 PolarHBondContact O-N 3.2Å
85	E	92.9	Very high	93.8	Very high	124 Å²	124	44.5 Å²	44.5	58%	0.579	22%	0.216	S	C	*	.	H	α-helix	trans	-73.1	-13.6	177.4	-67.8	174.3	-176.5	0	0	113.2	K81 I83 L87 Q88 E89	K81-E85 WeakPolarHBondContact O-CB 3.38Å; K81-E85 WeakPolarHBondContact O-CG 3.41Å; K81-E85 PolarHBondContact O-N 3.24Å; I83-E85 PolarHBondContact O-N 2.92Å; E85-L87 PolarHBondContact O-N 3.44Å; E85-Q88 WeakPolarHBondContact O-CB 3.46Å; E85-Q88 PolarHBondContact O-N 3Å; E85-E89 PolarHBondContact O-N 3.25Å; E85-E89 VanDerWaalsContact O-N 3.14Å
86	S	96.1	Very high	94.2	Very high	8 Å²	8	47.2 Å²	47.2	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-33.3	-170.4	70.5	0	0	0	0	115.2	C82 I83 D84 Q88 E89 F90 Y224	C82-S86 PolarHBondContact O-N 2.91Å; I83-S86 WeakPolarHBondContact O-CB 3.39Å; I83-S86 PolarHBondContact O-N 3.28Å; I83-S86 VanDerWaalsContact O-N 3.16Å; I83-S86 PolarHBondContact O-OG 3.45Å; D84-S86 VanDerWaalsContact C-N 3.26Å; D84-S86 PolarHBondContact O-N 3.2Å; S86-Q88 VanDerWaalsContact C-N 3.26Å; S86-Q88 PolarHBondContact O-N 3.08Å; S86-E89 PolarHBondContact O-N 3.27Å; S86-F90 WeakPolarHBondContact O-CD2 3.3Å; S86-F90 WeakPolarHBondContact O-CG 3.38Å; S86-F90 PolarHBondContact O-N 3.21Å; S86-Y224 WeakPolarHBondContact CA-OH 3.41Å; S86-Y224 VanDerWaalsContact CB-OH 3.23Å; S86-Y224 WeakPolarHBondContact CB-OH 3.32Å
87	L	95.4	Very high	94.6	Very high	34 Å²	34	47.2 Å²	47.2	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-69	-29.3	176.6	-54.7	-173.9	0	0	0	111.7	L64 F67 F69 E85 F90 S91	L64-L87 HydrophobicContact CB-CB 4.34Å; L64-L87 WeakPolarHBondContact CB-O 3.43Å; L64-L87 HydrophobicContact CD2-CD2 4.41Å; L64-L87 WeakPolarHBondContact O-CB 3.5Å; F67-L87 HydrophobicContact CB-CD1 3.94Å; F67-L87 HydrophobicContact CD1-CD1 3.52Å; F67-L87 HydrophobicContact CE1-CD1 4.29Å; F67-L87 HydrophobicContact CG-CD1 3.9Å; F69-L87 HydrophobicContact CE2-CD1 3.79Å; F69-L87 HydrophobicContact CE2-CG 4.07Å; F69-L87 HydrophobicContact CZ-CD1 4Å; F69-L87 HydrophobicContact CZ-CG 4.44Å; E85-L87 PolarHBondContact O-N 3.44Å; L87-F90 HydrophobicContact CD2-CD2 4.01Å; L87-F90 HydrophobicContact CD2-CE2 4.35Å; L87-S91 VanDerWaalsContact O-CB 3.32Å; L87-S91 WeakPolarHBondContact O-CB 3.38Å; L87-S91 PolarHBondContact O-N 3.03Å
88	Q	95.1	Very high	94.9	Very high	82 Å²	82	47 Å²	47	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-72.2	-38.2	172.5	-177.5	67.1	-12.6	0	0	111.7	G65 E85 S86 S91 M92	G65-Q88 PolarHBondContact O-OE1 2.88Å; E85-Q88 WeakPolarHBondContact O-CB 3.46Å; E85-Q88 PolarHBondContact O-N 3Å; S86-Q88 VanDerWaalsContact C-N 3.26Å; S86-Q88 PolarHBondContact O-N 3.08Å; Q88-S91 VanDerWaalsContact O-CB 3.28Å; Q88-S91 WeakPolarHBondContact O-CB 3.46Å; Q88-S91 PolarHBondContact O-N 3.19Å; Q88-M92 HydrophobicContact CG-CE 4.38Å; Q88-M92 WeakPolarHBondContact O-CG 3.49Å; Q88-M92 PolarHBondContact O-N 3.35Å
89	E	96.1	Very high	95.2	Very high	63 Å²	63	49.5 Å²	49.5	29%	0.294	24%	0.239	S	C	.	.	H	α-helix	trans	-65.3	-42.9	172.9	-70.9	-64.4	156.1	0	0	111.8	E85 S86 S91 M92 F93 Y224	E85-E89 PolarHBondContact O-N 3.25Å; E85-E89 VanDerWaalsContact O-N 3.14Å; S86-E89 PolarHBondContact O-N 3.27Å; E89-S91 VanDerWaalsContact C-N 3.32Å; E89-S91 PolarHBondContact O-N 3.22Å; E89-M92 HydrophobicContact CG-CE 4.23Å; E89-M92 PolarHBondContact O-N 2.72Å; E89-M92 WeakPolarHBondContact OE1-CE 3.34Å; E89-M92 VanDerWaalsContact OE2-CE 3.29Å; E89-M92 WeakPolarHBondContact OE2-CE 3.31Å; E89-F93 PolarHBondContact O-N 3.39Å; E89-Y224 HydrophobicContact CB-CD1 4.44Å; E89-Y224 HydrophobicContact CB-CE1 3.75Å; E89-Y224 HydrophobicContact CB-CE2 4.44Å; E89-Y224 HydrophobicContact CG-CE1 4.26Å; E89-Y224 HydrophobicContact CG-CE2 4.03Å
90	F	97.1	Very high	95.4	Very high	69 Å²	69	51.1 Å²	51.1	30%	0.303	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-38.6	171.1	-62	-46.3	0	0	0	112.5	L64 S86 L87 F93 L94 F221 L228	L64-F90 HydrophobicContact CD1-CB 4.12Å; S86-F90 WeakPolarHBondContact O-CD2 3.3Å; S86-F90 WeakPolarHBondContact O-CG 3.38Å; S86-F90 PolarHBondContact O-N 3.21Å; L87-F90 HydrophobicContact CD2-CD2 4.01Å; L87-F90 HydrophobicContact CD2-CE2 4.35Å; F90-F93 PolarHBondContact O-N 3.01Å; F90-L94 WeakPolarHBondContact O-CG 3.13Å; F90-L94 PolarHBondContact O-N 3.16Å; F90-F221 AromaticContact CD1-CE1 3.92Å; F90-F221 HydrophobicContact CD1-CE1 3.92Å; F90-F221 AromaticContact CD1-CZ 3.5Å; F90-F221 HydrophobicContact CD1-CZ 3.5Å; F90-F221 VanDerWaalsContact CD1-CZ 3.5Å; F90-F221 AromaticContact CE1-CE1 3.79Å; F90-F221 HydrophobicContact CE1-CE1 3.79Å; F90-F221 AromaticContact CE1-CZ 3.62Å; F90-F221 HydrophobicContact CE1-CZ 3.62Å; F90-L228 HydrophobicContact CE1-CD2 4.34Å; F90-L228 HydrophobicContact CE2-CD2 4.13Å; F90-L228 HydrophobicContact CZ-CD2 3.54Å
91	S	97.5	Very high	95.7	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-57.9	-47.9	173.6	-174.9	0	0	0	0	111.6	A61 L87 Q88 E89 L94 K95	A61-S91 VanDerWaalsContact O-CB 3.22Å; A61-S91 WeakPolarHBondContact O-CB 3.5Å; A61-S91 PolarHBondContact O-OG 3.31Å; L87-S91 VanDerWaalsContact O-CB 3.32Å; L87-S91 WeakPolarHBondContact O-CB 3.38Å; L87-S91 PolarHBondContact O-N 3.03Å; Q88-S91 VanDerWaalsContact O-CB 3.28Å; Q88-S91 WeakPolarHBondContact O-CB 3.46Å; Q88-S91 PolarHBondContact O-N 3.19Å; E89-S91 VanDerWaalsContact C-N 3.32Å; E89-S91 PolarHBondContact O-N 3.22Å; S91-L94 PolarHBondContact O-N 2.91Å; S91-K95 WeakPolarHBondContact O-CB 3.26Å; S91-K95 WeakPolarHBondContact O-CD 3.47Å; S91-K95 VanDerWaalsContact O-CG 3.27Å; S91-K95 WeakPolarHBondContact O-CG 3.28Å; S91-K95 PolarHBondContact O-N 3.18Å; S91-K95 VanDerWaalsContact OG-CE 3.32Å; S91-K95 WeakPolarHBondContact OG-CE 3.41Å; S91-K95 PolarHBondContact OG-NZ 3.44Å
92	M	96.8	Very high	96	Very high	65 Å²	65	50.6 Å²	50.6	32%	0.32	24%	0.243	S	C	.	.	H	α-helix	trans	-66.9	-41.7	179.5	-70.4	-173	-62.8	0	0	112.1	Q88 E89 L94 K95 N96	Q88-M92 HydrophobicContact CG-CE 4.38Å; Q88-M92 WeakPolarHBondContact O-CG 3.49Å; Q88-M92 PolarHBondContact O-N 3.35Å; E89-M92 HydrophobicContact CG-CE 4.23Å; E89-M92 PolarHBondContact O-N 2.72Å; E89-M92 WeakPolarHBondContact OE1-CE 3.34Å; E89-M92 VanDerWaalsContact OE2-CE 3.29Å; E89-M92 WeakPolarHBondContact OE2-CE 3.31Å; M92-L94 PolarHBondContact O-N 3.16Å; M92-K95 PolarHBondContact O-N 2.85Å; M92-N96 PolarHBondContact O-N 3.36Å; M92-N96 PolarHBondContact O-ND2 2.77Å
93	F	97.6	Very high	96.2	Very high	43 Å²	43	52 Å²	52	19%	0.189	25%	0.249	C	C	.	.	H	α-helix	trans	-56.3	-49.7	174.3	177.8	-92.2	0	0	0	112.1	E89 F90 K95 N96 L97 L217 A218 F221	E89-F93 PolarHBondContact O-N 3.39Å; F90-F93 PolarHBondContact O-N 3.01Å; F93-K95 PolarHBondContact O-N 3.41Å; F93-N96 PolarHBondContact O-N 2.74Å; F93-L97 PolarHBondContact O-N 2.84Å; F93-L217 HydrophobicContact CE2-CB 4.12Å; F93-A218 HydrophobicContact CZ-CB 4.33Å; F93-F221 HydrophobicContact CB-CD2 4.24Å; F93-F221 HydrophobicContact CB-CE2 4.14Å; F93-F221 HydrophobicContact CD2-CB 3.84Å; F93-F221 HydrophobicContact CD2-CD1 4.33Å; F93-F221 AromaticContact CD2-CD2 3.83Å; F93-F221 HydrophobicContact CD2-CD2 3.83Å; F93-F221 AromaticContact CD2-CG 3.74Å; F93-F221 HydrophobicContact CD2-CG 3.74Å; F93-F221 HydrophobicContact CE2-CB 3.87Å; F93-F221 HydrophobicContact CE2-CG 4.15Å; F93-F221 HydrophobicContact CG-CD2 4.3Å; F93-F221 HydrophobicContact CG-CG 4.38Å
94	L	97.8	Very high	96.4	Very high	30 Å²	30	51.2 Å²	51.2	16%	0.157	25%	0.245	C	C	.	.	H	α-helix	trans	-65.2	-39.2	179.8	-72.6	171.7	0	0	0	112.4	F60 A61 L64 F90 S91 M92 L97 E98	F60-L94 HydrophobicContact CD1-CD1 3.86Å; F60-L94 HydrophobicContact CE1-CD1 4.14Å; A61-L94 HydrophobicContact CB-CB 3.7Å; A61-L94 HydrophobicContact CB-CD1 4.16Å; L64-L94 HydrophobicContact CD1-CD1 3.93Å; F90-L94 WeakPolarHBondContact O-CG 3.13Å; F90-L94 PolarHBondContact O-N 3.16Å; S91-L94 PolarHBondContact O-N 2.91Å; M92-L94 PolarHBondContact O-N 3.16Å; L94-L97 PolarHBondContact O-N 3.26Å; L94-E98 WeakPolarHBondContact O-CB 3.4Å; L94-E98 WeakPolarHBondContact O-CG 3.21Å; L94-E98 PolarHBondContact O-N 3.48Å
95	K	97.3	Very high	96.7	Very high	77 Å²	77	50.4 Å²	50.4	34%	0.335	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-48.1	174.2	-74.7	162.2	-179.9	160	0	111.2	A61 S91 M92 F93 L97 E98 E99	A61-K95 HydrophobicContact CB-CG 4.16Å; S91-K95 WeakPolarHBondContact O-CB 3.26Å; S91-K95 WeakPolarHBondContact O-CD 3.47Å; S91-K95 VanDerWaalsContact O-CG 3.27Å; S91-K95 WeakPolarHBondContact O-CG 3.28Å; S91-K95 PolarHBondContact O-N 3.18Å; S91-K95 VanDerWaalsContact OG-CE 3.32Å; S91-K95 WeakPolarHBondContact OG-CE 3.41Å; S91-K95 PolarHBondContact OG-NZ 3.44Å; M92-K95 PolarHBondContact O-N 2.85Å; F93-K95 PolarHBondContact O-N 3.41Å; K95-L97 PolarHBondContact O-N 3.31Å; K95-E98 PolarHBondContact O-N 3.13Å; K95-E98 VanDerWaalsContact O-N 3.11Å; K95-E99 PolarHBondContact O-N 3.44Å
96	N	97.3	Very high	96.8	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.374	23%	0.234	S	C	.	.	H	α-helix	trans	-59.9	-43.5	178.1	-66.4	-20.8	0	0	0	112.2	M92 F93 E98 E99 Q100 L217	M92-N96 PolarHBondContact O-N 3.36Å; M92-N96 PolarHBondContact O-ND2 2.77Å; F93-N96 PolarHBondContact O-N 2.74Å; N96-E98 VanDerWaalsContact C-N 3.28Å; N96-E98 PolarHBondContact O-N 3.3Å; N96-E99 PolarHBondContact O-N 2.88Å; N96-Q100 WeakPolarHBondContact O-CG 3.25Å; N96-Q100 PolarHBondContact O-N 2.74Å; N96-L217 HydrophobicContact CB-CD2 4.42Å
97	L	97.6	Very high	96.8	Very high	28 Å²	28	52.8 Å²	52.8	15%	0.147	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-38.7	175.9	-179.4	62.9	0	0	0	111.8	F93 L94 K95 Q100 R101 F210	F93-L97 PolarHBondContact O-N 2.84Å; L94-L97 PolarHBondContact O-N 3.26Å; K95-L97 PolarHBondContact O-N 3.31Å; L97-Q100 PolarHBondContact O-N 2.91Å; L97-R101 PolarHBondContact O-N 3.24Å; L97-F210 HydrophobicContact CD1-CE2 4.33Å; L97-F210 HydrophobicContact CD1-CZ 4.36Å
98	E	97.4	Very high	96.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-75.7	-25.1	-178.6	-80	-46.6	125.5	0	0	115	G54 Q57 R58 L94 K95 N96 R101 E102	G54-E98 WeakPolarHBondContact CA-OE2 3.33Å; Q57-E98 HydrophobicContact CB-CG 3.79Å; Q57-E98 PolarHBondContact OE1-OE1 3.29Å; R58-E98 HydrophobicContact CG-CB 4.13Å; R58-E98 HydrophobicContact CG-CG 4.36Å; R58-E98 IonicContact NH1-OE2 2.76Å; R58-E98 PolarHBondContact NH1-OE2 2.95Å; R58-E98 PolarHBondContact NH2-O 3.48Å; L94-E98 WeakPolarHBondContact O-CB 3.4Å; L94-E98 WeakPolarHBondContact O-CG 3.21Å; L94-E98 PolarHBondContact O-N 3.48Å; K95-E98 PolarHBondContact O-N 3.13Å; K95-E98 VanDerWaalsContact O-N 3.11Å; N96-E98 VanDerWaalsContact C-N 3.28Å; N96-E98 PolarHBondContact O-N 3.3Å; E98-R101 VanDerWaalsContact CD-NE 3.32Å; E98-R101 IonicContact OE1-CZ 3.34Å; E98-R101 VanDerWaalsContact OE1-CZ 3.23Å; E98-R101 IonicContact OE1-NE 2.83Å; E98-R101 PolarHBondContact OE1-NE 3.06Å; E98-R101 IonicContact OE1-NH2 3.39Å; E98-R101 PolarHBondContact OE1-NH2 2.93Å; E98-R101 WeakPolarHBondContact OE2-CD 3.34Å; E98-R101 IonicContact OE2-NE 3.89Å; E98-R101 PolarHBondContact OE2-NE 3.36Å; E98-R101 VanDerWaalsContact OE2-NE 3.15Å; E98-E102 PolarHBondContact O-N 3.46Å; E98-E102 VanDerWaalsContact O-N 3.1Å
99	E	96.9	Very high	96.9	Very high	111 Å²	111	50 Å²	50	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-64.8	-41	165.8	-70.6	173.8	-175.2	0	0	111.3	K95 N96 E102 L103	K95-E99 PolarHBondContact O-N 3.44Å; N96-E99 PolarHBondContact O-N 2.88Å; E99-E102 WeakPolarHBondContact O-CB 3.32Å; E99-E102 PolarHBondContact O-N 3.27Å; E99-L103 PolarHBondContact O-N 3.41Å
100	Q	97.6	Very high	96.9	Very high	54 Å²	54	51.4 Å²	51.4	25%	0.252	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-37.2	176.8	-57.5	-55.8	-40.1	0	0	112	N96 L97 E102 L103 M104 F210 Q213 L217	N96-Q100 WeakPolarHBondContact O-CG 3.25Å; N96-Q100 PolarHBondContact O-N 2.74Å; L97-Q100 PolarHBondContact O-N 2.91Å; Q100-E102 VanDerWaalsContact C-N 3.29Å; Q100-E102 PolarHBondContact O-N 3.24Å; Q100-L103 PolarHBondContact O-N 2.87Å; Q100-M104 PolarHBondContact O-N 3.44Å; Q100-F210 HydrophobicContact CB-CD2 4.17Å; Q100-F210 HydrophobicContact CB-CE2 4.27Å; Q100-Q213 HydrophobicContact CB-CG 4.32Å; Q100-Q213 HydrophobicContact CG-CG 3.68Å; Q100-L217 HydrophobicContact CG-CD1 4.15Å
101	R	97.3	Very high	96.8	Very high	28 Å²	28	50.3 Å²	50.3	11%	0.106	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-37.1	172.5	-166.8	-172.4	-53.4	-72.4	-1.8	111.8	T50 L97 E98 M104 M105 F210	T50-R101 HydrophobicContact CG2-CG 3.67Å; L97-R101 PolarHBondContact O-N 3.24Å; E98-R101 VanDerWaalsContact CD-NE 3.32Å; E98-R101 IonicContact OE1-CZ 3.34Å; E98-R101 VanDerWaalsContact OE1-CZ 3.23Å; E98-R101 IonicContact OE1-NE 2.83Å; E98-R101 PolarHBondContact OE1-NE 3.06Å; E98-R101 IonicContact OE1-NH2 3.39Å; E98-R101 PolarHBondContact OE1-NH2 2.93Å; E98-R101 WeakPolarHBondContact OE2-CD 3.34Å; E98-R101 IonicContact OE2-NE 3.89Å; E98-R101 PolarHBondContact OE2-NE 3.36Å; E98-R101 VanDerWaalsContact OE2-NE 3.15Å; R101-M104 HydrophobicContact CG-CE 4.22Å; R101-M104 WeakPolarHBondContact O-CB 3.42Å; R101-M104 PolarHBondContact O-N 3.25Å; R101-M105 WeakPolarHBondContact O-CG 3.34Å; R101-M105 PolarHBondContact O-N 2.91Å; R101-F210 HydrophobicContact CB-CE2 3.78Å; R101-F210 HydrophobicContact CB-CZ 4.21Å; R101-F210 HydrophobicContact CG-CE2 4.34Å; R101-F210 HydrophobicContact CG-CZ 4.39Å
102	E	96.4	Very high	96.7	Very high	81 Å²	81	50.9 Å²	50.9	38%	0.379	25%	0.245	S	C	.	.	H	α-helix	trans	-68.3	-42.4	176.9	-161.4	-172	128	0	0	112.3	R58 E98 E99 Q100 M104 M105 R106	R58-E102 IonicContact CZ-OE2 2.64Å; R58-E102 IonicContact NH2-OE2 4Å; R58-E102 PolarHBondContact NH2-OE2 2.98Å; E98-E102 PolarHBondContact O-N 3.46Å; E98-E102 VanDerWaalsContact O-N 3.1Å; E99-E102 WeakPolarHBondContact O-CB 3.32Å; E99-E102 PolarHBondContact O-N 3.27Å; Q100-E102 VanDerWaalsContact C-N 3.29Å; Q100-E102 PolarHBondContact O-N 3.24Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 2.92Å; E102-M105 HydrophobicContact CB-CE 4.48Å; E102-M105 HydrophobicContact CG-CE 4.45Å; E102-M105 PolarHBondContact O-N 3.23Å; E102-R106 WeakPolarHBondContact O-CB 3.43Å; E102-R106 PolarHBondContact O-N 3.19Å; E102-R106 IonicContact OE1-NH2 2.72Å; E102-R106 PolarHBondContact OE1-NH2 3.24Å
103	L	96.3	Very high	96.7	Very high	50 Å²	50	48.2 Å²	48.2	26%	0.262	23%	0.232	S	C	.	.	H	α-helix	trans	-59.5	-43.2	172.6	-177.7	61.6	0	0	0	111.3	E99 Q100 R106 N107	E99-L103 PolarHBondContact O-N 3.41Å; Q100-L103 PolarHBondContact O-N 2.87Å; L103-R106 PolarHBondContact O-N 3.48Å; L103-N107 WeakPolarHBondContact O-CB 3.34Å; L103-N107 VanDerWaalsContact O-CG 3.23Å; L103-N107 PolarHBondContact O-N 3.14Å; L103-N107 PolarHBondContact O-OD1 3.06Å
104	M	97.2	Very high	96.7	Very high	20 Å²	20	51.3 Å²	51.3	10%	0.099	25%	0.245	C	C	.	.	H	α-helix	trans	-57.7	-50.3	174.1	-173.7	-162.8	65.4	0	0	111.8	T50 Q100 R101 E102 R106 N107 I108 T206 F210	T50-M104 HydrophobicContact CG2-CE 3.91Å; Q100-M104 PolarHBondContact O-N 3.44Å; R101-M104 HydrophobicContact CG-CE 4.22Å; R101-M104 WeakPolarHBondContact O-CB 3.42Å; R101-M104 PolarHBondContact O-N 3.25Å; E102-M104 VanDerWaalsContact C-N 3.32Å; E102-M104 PolarHBondContact O-N 2.92Å; M104-R106 VanDerWaalsContact C-N 3.32Å; M104-R106 PolarHBondContact O-N 2.77Å; M104-N107 PolarHBondContact O-N 2.83Å; M104-I108 HydrophobicContact CE-CD1 4.3Å; M104-I108 HydrophobicContact CG-CD1 3.88Å; M104-I108 VanDerWaalsContact O-CG1 3.27Å; M104-I108 WeakPolarHBondContact O-CG1 3.5Å; M104-I108 PolarHBondContact O-N 2.95Å; M104-I108 HydrophobicContact SD-CD1 4.36Å; M104-T206 HydrophobicContact CG-CG2 3.94Å; M104-F210 HydrophobicContact CB-CB 4.01Å; M104-F210 HydrophobicContact CB-CD2 4.25Å; M104-F210 HydrophobicContact CB-CG 4.23Å; M104-F210 HydrophobicContact CG-CB 3.81Å; M104-F210 HydrophobicContact CG-CG 4.22Å; M104-F210 HydrophobicContact SD-CB 3.54Å; M104-F210 VanDerWaalsContact SD-CB 3.54Å; M104-F210 HydrophobicContact SD-CD1 3.61Å; M104-F210 HydrophobicContact SD-CD2 4.27Å; M104-F210 HydrophobicContact SD-CE1 4.43Å; M104-F210 HydrophobicContact SD-CG 3.51Å; M104-F210 VanDerWaalsContact SD-CG 3.51Å
105	M	96.3	Very high	96.7	Very high	21 Å²	21	51.9 Å²	51.9	10%	0.103	25%	0.251	C	S	.	.	H	α-helix	trans	-60.8	-39.4	178.1	-73.1	-172	-68.9	0	0	112.8	T50 K51 R101 E102 T109	T50-M105 HydrophobicContact CG2-CE 4.49Å; T50-M105 HydrophobicContact CG2-CG 3.62Å; T50-M105 HydrophobicContact CG2-SD 3.56Å; T50-M105 VanDerWaalsContact CG2-SD 3.56Å; K51-M105 HydrophobicContact CB-SD 4.11Å; R101-M105 WeakPolarHBondContact O-CG 3.34Å; R101-M105 PolarHBondContact O-N 2.91Å; E102-M105 HydrophobicContact CB-CE 4.48Å; E102-M105 HydrophobicContact CG-CE 4.45Å; E102-M105 PolarHBondContact O-N 3.23Å; M105-T109 PolarHBondContact O-N 2.91Å; M105-T109 PolarHBondContact O-OG1 2.57Å
106	R	96.1	Very high	96.6	Very high	119 Å²	119	48.3 Å²	48.3	45%	0.449	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-49	176.6	-163	-177.7	-54.7	121.6	2.8	110.4	E102 L103 M104 I108 T109 E110	E102-R106 WeakPolarHBondContact O-CB 3.43Å; E102-R106 PolarHBondContact O-N 3.19Å; E102-R106 IonicContact OE1-NH2 2.72Å; E102-R106 PolarHBondContact OE1-NH2 3.24Å; L103-R106 PolarHBondContact O-N 3.48Å; M104-R106 VanDerWaalsContact C-N 3.32Å; M104-R106 PolarHBondContact O-N 2.77Å; R106-I108 PolarHBondContact O-N 2.69Å; R106-T109 WeakPolarHBondContact O-CB 3.4Å; R106-T109 PolarHBondContact O-N 3.47Å; R106-T109 VanDerWaalsContact O-N 3.1Å; R106-E110 PolarHBondContact O-N 3.39Å; R106-E110 VanDerWaalsContact O-N 3.09Å
107	N	96.1	Very high	96.5	Very high	63 Å²	63	47.8 Å²	47.8	34%	0.337	23%	0.231	S	C	.	.	H	α-helix	trans	-60.6	-46.6	178	-70.9	0.9	0	0	0	111.6	L103 M104 T109 E110 T111 T206	L103-N107 WeakPolarHBondContact O-CB 3.34Å; L103-N107 VanDerWaalsContact O-CG 3.23Å; L103-N107 PolarHBondContact O-N 3.14Å; L103-N107 PolarHBondContact O-OD1 3.06Å; M104-N107 PolarHBondContact O-N 2.83Å; N107-T109 PolarHBondContact O-N 2.83Å; N107-E110 PolarHBondContact O-N 2.63Å; N107-E110 VanDerWaalsContact O-N 3.08Å; N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.35Å; N107-T111 PolarHBondContact O-OG1 3.11Å; N107-T206 HydrophobicContact CB-CG2 3.52Å
108	I	96.2	Very high	96.4	Very high	8 Å²	8	52.1 Å²	52.1	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-38.6	174.8	-66.7	165.9	0	0	0	111.3	I47 M104 R106 L112 M113 F203 T206 V207	I47-I108 HydrophobicContact CD1-CG2 4.19Å; I47-I108 HydrophobicContact CG1-CG2 4.4Å; M104-I108 HydrophobicContact CE-CD1 4.3Å; M104-I108 HydrophobicContact CG-CD1 3.88Å; M104-I108 VanDerWaalsContact O-CG1 3.27Å; M104-I108 WeakPolarHBondContact O-CG1 3.5Å; M104-I108 PolarHBondContact O-N 2.95Å; M104-I108 HydrophobicContact SD-CD1 4.36Å; R106-I108 PolarHBondContact O-N 2.69Å; I108-L112 HydrophobicContact CG2-CB 4.25Å; I108-L112 HydrophobicContact CG2-CD2 4.2Å; I108-L112 WeakPolarHBondContact O-CA 3.4Å; I108-L112 VanDerWaalsContact O-CB 3.3Å; I108-L112 WeakPolarHBondContact O-CB 3.17Å; I108-L112 PolarHBondContact O-N 3.02Å; I108-M113 PolarHBondContact O-N 3.18Å; I108-M113 VanDerWaalsContact O-N 3.16Å; I108-F203 HydrophobicContact CD1-CD2 4.12Å; I108-F203 HydrophobicContact CD1-CE2 3.91Å; I108-F203 HydrophobicContact CG1-CD2 3.88Å; I108-F203 HydrophobicContact CG1-CE2 4.2Å; I108-F203 HydrophobicContact CG2-CD2 3.93Å; I108-F203 HydrophobicContact CG2-CE2 4.25Å; I108-T206 HydrophobicContact CG1-CG2 3.89Å; I108-V207 HydrophobicContact CD1-CG2 4.38Å
109	T	96.8	Very high	96.4	Very high	49 Å²	49	52.2 Å²	52.2	30%	0.301	25%	0.249	S	C	.	.	I	π-helix	trans	-63.6	-42.1	177.1	-55.9	0	0	0	0	111.8	M105 R106 N107 M113 K114	M105-T109 PolarHBondContact O-N 2.91Å; M105-T109 PolarHBondContact O-OG1 2.57Å; R106-T109 WeakPolarHBondContact O-CB 3.4Å; R106-T109 PolarHBondContact O-N 3.47Å; R106-T109 VanDerWaalsContact O-N 3.1Å; N107-T109 PolarHBondContact O-N 2.83Å; T109-M113 WeakPolarHBondContact O-CB 3.41Å; T109-K114 PolarHBondContact O-N 3.39Å; T109-K114 VanDerWaalsContact O-N 3.11Å
110	E	96.4	Very high	96.3	Very high	94 Å²	94	50.5 Å²	50.5	44%	0.439	24%	0.238	S	C	.	.	I	π-helix	trans	-75.2	-40.8	179.3	-62.2	-56	138.4	0	0	113.5	R106 N107 K114 P115	R106-E110 PolarHBondContact O-N 3.39Å; R106-E110 VanDerWaalsContact O-N 3.09Å; N107-E110 PolarHBondContact O-N 2.63Å; N107-E110 VanDerWaalsContact O-N 3.08Å; E110-K114 VanDerWaalsContact OE1-CE 3.24Å; E110-K114 WeakPolarHBondContact OE1-CE 3.1Å; E110-K114 IonicContact OE1-NZ 2.74Å; E110-K114 PolarHBondContact OE1-NZ 3.21Å; E110-K114 WeakPolarHBondContact OE2-CD 3.1Å; E110-K114 WeakPolarHBondContact OE2-CE 3.38Å; E110-K114 IonicContact OE2-NZ 2.74Å; E110-K114 PolarHBondContact OE2-NZ 2.92Å; E110-P115 VanDerWaalsContact O-CD 3.3Å; E110-P115 WeakPolarHBondContact O-CD 3.43Å
111	T	94.9	Very high	96.2	Very high	46 Å²	46	54.3 Å²	54.3	28%	0.282	25%	0.253	S	S	.	.	I	π-helix	trans	-95.7	-24.7	-170.4	63.6	0	0	0	0	114.6	N107 P115 P199 A202	N107-T111 WeakPolarHBondContact O-CG2 3.2Å; N107-T111 PolarHBondContact O-N 3.35Å; N107-T111 PolarHBondContact O-OG1 3.11Å; T111-P115 WeakPolarHBondContact O-CG 3.35Å; T111-P199 WeakPolarHBondContact O-CA 3.47Å; T111-P199 WeakPolarHBondContact O-CB 3.49Å; T111-A202 HydrophobicContact CG2-CB 4.47Å
112	L	95.6	Very high	96.1	Very high	12 Å²	12	57.4 Å²	57.4	6%	0.063	27%	0.269	C	S	.	.	I	π-helix	trans	-108.7	-56	177.4	-177.2	69.3	0	0	0	111.7	I108 L116 P199 M200 F203	I108-L112 HydrophobicContact CG2-CB 4.25Å; I108-L112 HydrophobicContact CG2-CD2 4.2Å; I108-L112 WeakPolarHBondContact O-CA 3.4Å; I108-L112 VanDerWaalsContact O-CB 3.3Å; I108-L112 WeakPolarHBondContact O-CB 3.17Å; I108-L112 PolarHBondContact O-N 3.02Å; L112-L116 HydrophobicContact CD1-CD1 3.7Å; L112-L116 HydrophobicContact CD1-CG 4.33Å; L112-L116 HydrophobicContact CG-CD1 3.97Å; L112-L116 WeakPolarHBondContact O-CB 3.49Å; L112-L116 VanDerWaalsContact O-CG 3.27Å; L112-L116 WeakPolarHBondContact O-CG 3.29Å; L112-L116 PolarHBondContact O-N 3.22Å; L112-P199 HydrophobicContact CD1-CB 3.97Å; L112-P199 WeakPolarHBondContact CD1-O 3.45Å; L112-M200 HydrophobicContact CD1-CE 3.57Å; L112-M200 HydrophobicContact CD1-SD 3.78Å; L112-F203 HydrophobicContact CB-CB 4.29Å; L112-F203 HydrophobicContact CD1-CB 4.21Å; L112-F203 HydrophobicContact CD2-CB 4.12Å; L112-F203 HydrophobicContact CD2-CD2 3.71Å; L112-F203 HydrophobicContact CD2-CE2 4.37Å; L112-F203 HydrophobicContact CD2-CG 4Å; L112-F203 HydrophobicContact CG-CB 4.44Å
113	M	96.7	Very high	96	Very high	9 Å²	9	54.9 Å²	54.9	4%	0.044	26%	0.258	C	S	.	.	I	π-helix	trans	-70.8	-47.4	-166	-52.6	-55.4	-65.1	0	0	112.3	Y40 K44 I47 I108 T109 E117	Y40-M113 HydrophobicContact CD2-CE 3.71Å; Y40-M113 HydrophobicContact CE2-CB 4.27Å; Y40-M113 HydrophobicContact CE2-CE 3.97Å; Y40-M113 WeakPolarHBondContact CE2-O 3.36Å; Y40-M113 HydrophobicContact CG-CE 4.07Å; Y40-M113 WeakPolarHBondContact O-CE 3.44Å; K44-M113 HydrophobicContact CG-CE 3.78Å; I47-M113 HydrophobicContact CD1-CG 3.69Å; I47-M113 HydrophobicContact CD1-SD 4.11Å; I108-M113 PolarHBondContact O-N 3.18Å; I108-M113 VanDerWaalsContact O-N 3.16Å; T109-M113 WeakPolarHBondContact O-CB 3.41Å; M113-E117 WeakPolarHBondContact O-CB 3.44Å; M113-E117 PolarHBondContact O-N 3.48Å; M113-E117 VanDerWaalsContact O-N 3.13Å
114	K	96.6	Very high	95.9	Very high	107 Å²	107	52.9 Å²	52.9	47%	0.465	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-47.2	178.7	-71.5	-177.7	-170.4	174.9	0	113	T109 E110 L116 E117 K118	T109-K114 PolarHBondContact O-N 3.39Å; T109-K114 VanDerWaalsContact O-N 3.11Å; E110-K114 VanDerWaalsContact OE1-CE 3.24Å; E110-K114 WeakPolarHBondContact OE1-CE 3.1Å; E110-K114 IonicContact OE1-NZ 2.74Å; E110-K114 PolarHBondContact OE1-NZ 3.21Å; E110-K114 WeakPolarHBondContact OE2-CD 3.1Å; E110-K114 WeakPolarHBondContact OE2-CE 3.38Å; E110-K114 IonicContact OE2-NZ 2.74Å; E110-K114 PolarHBondContact OE2-NZ 2.92Å; K114-L116 PolarHBondContact O-N 2.98Å; K114-E117 PolarHBondContact O-N 3.1Å; K114-K118 WeakPolarHBondContact O-CB 3.48Å; K114-K118 PolarHBondContact O-N 2.81Å
115	P	97	Very high	95.8	Very high	43 Å²	43	53.2 Å²	53.2	28%	0.279	26%	0.255	S	S	.	.	H	α-helix	trans	-61.7	-43	178.9	-29.5	39.7	0	0	0	113.7	E110 T111 E117 K118 F119 P199	E110-P115 VanDerWaalsContact O-CD 3.3Å; E110-P115 WeakPolarHBondContact O-CD 3.43Å; T111-P115 WeakPolarHBondContact O-CG 3.35Å; P115-E117 PolarHBondContact O-N 3.35Å; P115-K118 WeakPolarHBondContact O-CB 3.18Å; P115-K118 PolarHBondContact O-N 2.88Å; P115-F119 WeakPolarHBondContact O-CB 3.2Å; P115-F119 PolarHBondContact O-N 2.96Å; P115-P199 HydrophobicContact CB-CB 4.29Å; P115-P199 HydrophobicContact CB-CG 3.69Å; P115-P199 HydrophobicContact CG-CG 4.48Å
116	L	95.8	Very high	95.7	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-40.7	176.2	-70	176.9	0	0	0	112.5	I36 L39 L112 K114 R120 M200	I36-L116 HydrophobicContact CG2-CB 4.08Å; I36-L116 HydrophobicContact CG2-CD2 4.28Å; L39-L116 HydrophobicContact CG-CD1 4.5Å; L112-L116 HydrophobicContact CD1-CD1 3.7Å; L112-L116 HydrophobicContact CD1-CG 4.33Å; L112-L116 HydrophobicContact CG-CD1 3.97Å; L112-L116 WeakPolarHBondContact O-CB 3.49Å; L112-L116 VanDerWaalsContact O-CG 3.27Å; L112-L116 WeakPolarHBondContact O-CG 3.29Å; L112-L116 PolarHBondContact O-N 3.22Å; K114-L116 PolarHBondContact O-N 2.98Å; L116-R120 WeakPolarHBondContact O-CB 3.49Å; L116-R120 PolarHBondContact O-N 3.26Å; L116-M200 HydrophobicContact CD1-CE 3.7Å; L116-M200 HydrophobicContact CD2-CE 3.76Å; L116-M200 HydrophobicContact CG-CE 4.21Å
117	E	95.9	Very high	95.6	Very high	58 Å²	58	50.9 Å²	50.9	27%	0.271	25%	0.253	S	S	.	.	H	α-helix	trans	-67.3	-39.3	175.8	-173	163.7	-160.3	0	0	112	Y40 M113 K114 P115 R120 K121	Y40-E117 HydrophobicContact CD2-CB 4.16Å; Y40-E117 HydrophobicContact CE2-CB 3.65Å; Y40-E117 HydrophobicContact CE2-CG 4.21Å; Y40-E117 WeakPolarHBondContact CE2-OE2 3.44Å; Y40-E117 VanDerWaalsContact CZ-OE2 3.27Å; Y40-E117 PolarHBondContact OH-OE1 2.68Å; Y40-E117 PolarHBondContact OH-OE2 2.62Å; M113-E117 WeakPolarHBondContact O-CB 3.44Å; M113-E117 PolarHBondContact O-N 3.48Å; M113-E117 VanDerWaalsContact O-N 3.13Å; K114-E117 PolarHBondContact O-N 3.1Å; P115-E117 PolarHBondContact O-N 3.35Å; E117-R120 PolarHBondContact O-N 3.27Å; E117-K121 HydrophobicContact CG-CD 3.97Å; E117-K121 HydrophobicContact CG-CG 4.39Å; E117-K121 WeakPolarHBondContact O-CB 3.48Å; E117-K121 WeakPolarHBondContact O-CG 3.47Å; E117-K121 PolarHBondContact O-N 2.66Å; E117-K121 WeakPolarHBondContact OE1-CE 3.32Å; E117-K121 IonicContact OE1-NZ 3.47Å; E117-K121 PolarHBondContact OE1-NZ 3.44Å
118	K	95.9	Very high	95.5	Very high	119 Å²	119	52.6 Å²	52.6	52%	0.517	25%	0.254	S	S	.	.	H	α-helix	trans	-61.4	-56.3	175.3	-169.8	-174.2	179.4	-174.7	0	111.1	K114 P115 R120 K121 E122	K114-K118 WeakPolarHBondContact O-CB 3.48Å; K114-K118 PolarHBondContact O-N 2.81Å; P115-K118 WeakPolarHBondContact O-CB 3.18Å; P115-K118 PolarHBondContact O-N 2.88Å; K118-R120 VanDerWaalsContact C-N 3.25Å; K118-R120 PolarHBondContact O-N 3.44Å; K118-K121 PolarHBondContact O-N 3.38Å; K118-E122 WeakPolarHBondContact CE-OE2 3.37Å; K118-E122 VanDerWaalsContact CG-CD 3.44Å; K118-E122 HydrophobicContact CG-CG 4.29Å; K118-E122 WeakPolarHBondContact CG-OE1 3.25Å; K118-E122 WeakPolarHBondContact CG-OE2 3.19Å; K118-E122 IonicContact NZ-OE2 3.4Å; K118-E122 WeakPolarHBondContact O-CB 3.41Å; K118-E122 PolarHBondContact O-N 3.12Å
119	F	96.4	Very high	95.5	Very high	2 Å²	2	54 Å²	54	1%	0.009	27%	0.267	C	S	.	.	I	π-helix	trans	-54.5	-43.6	177.7	-178.3	-93.7	0	0	0	111.7	I36 P115 Q123 L124 I188 R191 K192 E195 C196	I36-F119 HydrophobicContact CD1-CD1 3.61Å; I36-F119 HydrophobicContact CD1-CE1 3.81Å; P115-F119 WeakPolarHBondContact O-CB 3.2Å; P115-F119 PolarHBondContact O-N 2.96Å; F119-Q123 HydrophobicContact CD2-CB 3.92Å; F119-Q123 HydrophobicContact CD2-CG 3.77Å; F119-Q123 HydrophobicContact CE2-CB 4.01Å; F119-Q123 HydrophobicContact CE2-CG 4.17Å; F119-Q123 HydrophobicContact CG-CB 4.42Å; F119-Q123 HydrophobicContact CG-CG 4.47Å; F119-Q123 WeakPolarHBondContact O-CA 3.35Å; F119-Q123 WeakPolarHBondContact O-CB 3.22Å; F119-Q123 PolarHBondContact O-N 3.2Å; F119-Q123 VanDerWaalsContact O-N 3.1Å; F119-L124 HydrophobicContact CD1-CD1 4.13Å; F119-L124 HydrophobicContact CD1-CG 4.1Å; F119-L124 HydrophobicContact CE1-CD1 3.81Å; F119-L124 HydrophobicContact CE1-CD2 3.95Å; F119-L124 HydrophobicContact CE1-CG 3.68Å; F119-L124 HydrophobicContact CZ-CD2 4.26Å; F119-L124 HydrophobicContact CZ-CG 4.36Å; F119-L124 PolarHBondContact O-N 3.07Å; F119-I188 HydrophobicContact CE2-CD1 3.58Å; F119-I188 HydrophobicContact CZ-CD1 3.48Å; F119-I188 VanDerWaalsContact CZ-CD1 3.48Å; F119-I188 HydrophobicContact CZ-CG1 4.33Å; F119-R191 HydrophobicContact CE2-CB 4.31Å; F119-K192 HydrophobicContact CE1-CB 4.31Å; F119-K192 HydrophobicContact CE2-CB 4.38Å; F119-K192 HydrophobicContact CZ-CB 3.63Å; F119-E195 HydrophobicContact CD2-CB 3.55Å; F119-E195 HydrophobicContact CD2-CG 4.32Å; F119-E195 WeakPolarHBondContact CD2-OE2 3.36Å; F119-E195 HydrophobicContact CE2-CB 3.91Å; F119-E195 HydrophobicContact CG-CB 4.44Å; F119-C196 VanDerWaalsContact CD1-SG 3.54Å; F119-C196 WeakPolarHBondContact CE1-SG 3.5Å
120	R	95.3	Very high	95.4	Very high	75 Å²	75	53.6 Å²	53.6	28%	0.283	26%	0.262	S	S	.	.	I	π-helix	trans	-70.1	-37.1	-179.4	-176.6	173.4	166.5	-115.3	-16.2	114	N33 I36 L116 E117 K118	N33-R120 WeakPolarHBondContact OD1-CG 3.33Å; N33-R120 PolarHBondContact OD1-NE 3Å; I36-R120 HydrophobicContact CG2-CB 4.01Å; I36-R120 HydrophobicContact CG2-CG 4.48Å; L116-R120 WeakPolarHBondContact O-CB 3.49Å; L116-R120 PolarHBondContact O-N 3.26Å; E117-R120 PolarHBondContact O-N 3.27Å; K118-R120 VanDerWaalsContact C-N 3.25Å; K118-R120 PolarHBondContact O-N 3.44Å
121	K	94.9	Very high	95.4	Very high	134 Å²	134	52.3 Å²	52.3	58%	0.583	25%	0.253	S	S	*	.	I	π-helix	trans	-84.4	-44	-179.2	-74	-177.4	-175.4	171.1	0	112.9	E117 K118 G125	E117-K121 HydrophobicContact CG-CD 3.97Å; E117-K121 HydrophobicContact CG-CG 4.39Å; E117-K121 WeakPolarHBondContact O-CB 3.48Å; E117-K121 WeakPolarHBondContact O-CG 3.47Å; E117-K121 PolarHBondContact O-N 2.66Å; E117-K121 WeakPolarHBondContact OE1-CE 3.32Å; E117-K121 IonicContact OE1-NZ 3.47Å; E117-K121 PolarHBondContact OE1-NZ 3.44Å; K118-K121 PolarHBondContact O-N 3.38Å; K121-G125 WeakPolarHBondContact O-CA 3.47Å
122	E	94.8	Very high	95.5	Very high	93 Å²	93	57.2 Å²	57.2	44%	0.435	27%	0.27	S	S	.	.	I	π-helix	trans	-86.4	-63.4	-175.2	-62.3	174.7	-164.4	0	0	109.8	K118 G125 N126	K118-E122 WeakPolarHBondContact CE-OE2 3.37Å; K118-E122 VanDerWaalsContact CG-CD 3.44Å; K118-E122 HydrophobicContact CG-CG 4.29Å; K118-E122 WeakPolarHBondContact CG-OE1 3.25Å; K118-E122 WeakPolarHBondContact CG-OE2 3.19Å; K118-E122 IonicContact NZ-OE2 3.4Å; K118-E122 WeakPolarHBondContact O-CB 3.41Å; K118-E122 PolarHBondContact O-N 3.12Å; E122-G125 PolarHBondContact O-N 3.46Å; E122-N126 WeakPolarHBondContact O-CB 3.42Å; E122-N126 PolarHBondContact O-N 3.34Å; E122-N126 PolarHBondContact O-ND2 3.18Å; E122-N126 PolarHBondContact O-OD1 2.89Å
123	Q	94.8	Very high	95.5	Very high	29 Å²	29	61.7 Å²	61.7	14%	0.136	29%	0.286	C	S	.	.	I	π-helix	trans	-68.3	-56	-173.1	-52.7	-61.6	-10.1	0	0	112.2	F119 G125 N126 V127 I188	F119-Q123 HydrophobicContact CD2-CB 3.92Å; F119-Q123 HydrophobicContact CD2-CG 3.77Å; F119-Q123 HydrophobicContact CE2-CB 4.01Å; F119-Q123 HydrophobicContact CE2-CG 4.17Å; F119-Q123 HydrophobicContact CG-CB 4.42Å; F119-Q123 HydrophobicContact CG-CG 4.47Å; F119-Q123 WeakPolarHBondContact O-CA 3.35Å; F119-Q123 WeakPolarHBondContact O-CB 3.22Å; F119-Q123 PolarHBondContact O-N 3.2Å; F119-Q123 VanDerWaalsContact O-N 3.1Å; Q123-G125 VanDerWaalsContact C-N 3.26Å; Q123-G125 PolarHBondContact O-N 3.37Å; Q123-N126 PolarHBondContact O-N 2.97Å; Q123-V127 WeakPolarHBondContact O-CG2 3.42Å; Q123-V127 PolarHBondContact O-N 3.17Å; Q123-I188 HydrophobicContact CB-CD1 3.61Å
124	L	94.9	Very high	95.5	Very high	7 Å²	7	61.4 Å²	61.4	4%	0.037	29%	0.285	C	S	.	.	H	α-helix	trans	-71.6	-19.6	177.8	-60.6	-179.4	0	0	0	113.2	L29 T32 N33 I36 F119 R128 I188	L29-L124 HydrophobicContact CD2-CD2 4.27Å; T32-L124 HydrophobicContact CG2-CD1 4.5Å; N33-L124 HydrophobicContact CB-CD1 3.93Å; I36-L124 HydrophobicContact CD1-CD1 4.25Å; F119-L124 HydrophobicContact CD1-CD1 4.13Å; F119-L124 HydrophobicContact CD1-CG 4.1Å; F119-L124 HydrophobicContact CE1-CD1 3.81Å; F119-L124 HydrophobicContact CE1-CD2 3.95Å; F119-L124 HydrophobicContact CE1-CG 3.68Å; F119-L124 HydrophobicContact CZ-CD2 4.26Å; F119-L124 HydrophobicContact CZ-CG 4.36Å; F119-L124 PolarHBondContact O-N 3.07Å; L124-R128 WeakPolarHBondContact O-CG 3.35Å; L124-I188 HydrophobicContact CD2-CD1 4.2Å; L124-I188 HydrophobicContact CD2-CG1 3.85Å
125	G	94	Very high	95.5	Very high	27 Å²	27	60.2 Å²	60.2	28%	0.278	28%	0.281	S	S	.	.	H	α-helix	trans	-74.4	-46.2	172.5	0	0	0	0	0	112	K121 E122 Q123 V127 R128 A129	K121-G125 WeakPolarHBondContact O-CA 3.47Å; E122-G125 PolarHBondContact O-N 3.46Å; Q123-G125 VanDerWaalsContact C-N 3.26Å; Q123-G125 PolarHBondContact O-N 3.37Å; G125-V127 PolarHBondContact O-N 2.65Å; G125-R128 WeakPolarHBondContact O-CB 3.46Å; G125-R128 PolarHBondContact O-N 2.64Å; G125-R128 VanDerWaalsContact O-N 3.16Å; G125-A129 PolarHBondContact O-N 3.4Å
126	N	93.9	Very high	95.5	Very high	82 Å²	82	63.7 Å²	63.7	44%	0.439	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-42.2	178.1	-69.3	-10.8	0	0	0	111.5	E122 Q123 R128 A129 E130	E122-N126 WeakPolarHBondContact O-CB 3.42Å; E122-N126 PolarHBondContact O-N 3.34Å; E122-N126 PolarHBondContact O-ND2 3.18Å; E122-N126 PolarHBondContact O-OD1 2.89Å; Q123-N126 PolarHBondContact O-N 2.97Å; N126-R128 VanDerWaalsContact C-N 3.25Å; N126-R128 PolarHBondContact O-N 3.36Å; N126-A129 CarbonylContact O-C 3.51Å; N126-A129 WeakPolarHBondContact O-CA 3.39Å; N126-A129 VanDerWaalsContact O-CB 3.32Å; N126-A129 WeakPolarHBondContact O-CB 3.45Å; N126-A129 PolarHBondContact O-N 2.92Å; N126-E130 PolarHBondContact O-N 3.33Å
127	V	95.2	Very high	95.5	Very high	9 Å²	9	64.4 Å²	64.4	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-32.9	176	176	0	0	0	0	112.4	L29 Q123 G125 A129 R131 K184 L185 I188	L29-V127 HydrophobicContact CD1-CG1 4.01Å; Q123-V127 WeakPolarHBondContact O-CG2 3.42Å; Q123-V127 PolarHBondContact O-N 3.17Å; G125-V127 PolarHBondContact O-N 2.65Å; V127-A129 VanDerWaalsContact C-N 3.31Å; V127-R131 WeakPolarHBondContact O-CB 3.4Å; V127-R131 PolarHBondContact O-N 2.96Å; V127-K184 HydrophobicContact CG2-CG 4.03Å; V127-L185 HydrophobicContact CG1-CD2 4.12Å; V127-I188 HydrophobicContact CG1-CG2 4.47Å; V127-I188 HydrophobicContact CG2-CB 3.96Å; V127-I188 HydrophobicContact CG2-CG1 4.11Å; V127-I188 HydrophobicContact CG2-CG2 3.88Å
128	R	94.4	Very high	95.6	Very high	99 Å²	99	62.6 Å²	62.6	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-71	-24.9	171.5	-69.8	178.4	-167	-82.5	-16.8	113.2	D30 N33 L124 G125 N126 K132	D30-R128 IonicContact OD1-CZ 3.38Å; D30-R128 VanDerWaalsContact OD1-CZ 3.22Å; D30-R128 IonicContact OD1-NH1 2.78Å; D30-R128 PolarHBondContact OD1-NH1 2.94Å; D30-R128 IonicContact OD1-NH2 2.72Å; D30-R128 PolarHBondContact OD1-NH2 3.37Å; N33-R128 PolarHBondContact ND2-NH2 3.02Å; L124-R128 WeakPolarHBondContact O-CG 3.35Å; G125-R128 WeakPolarHBondContact O-CB 3.46Å; G125-R128 PolarHBondContact O-N 2.64Å; G125-R128 VanDerWaalsContact O-N 3.16Å; N126-R128 VanDerWaalsContact C-N 3.25Å; N126-R128 PolarHBondContact O-N 3.36Å; R128-K132 WeakPolarHBondContact O-CG 3.45Å; R128-K132 PolarHBondContact O-N 3.3Å
129	A	94.6	Very high	95.6	Very high	38 Å²	38	63.8 Å²	63.8	31%	0.314	30%	0.295	S	S	.	.	H	α-helix	trans	-76.8	-43.9	173.1	0	0	0	0	0	111	G125 N126 V127 R131 K132 R133	G125-A129 PolarHBondContact O-N 3.4Å; N126-A129 CarbonylContact O-C 3.51Å; N126-A129 WeakPolarHBondContact O-CA 3.39Å; N126-A129 VanDerWaalsContact O-CB 3.32Å; N126-A129 WeakPolarHBondContact O-CB 3.45Å; N126-A129 PolarHBondContact O-N 2.92Å; V127-A129 VanDerWaalsContact C-N 3.31Å; A129-R131 PolarHBondContact O-N 3.3Å; A129-K132 PolarHBondContact O-N 3.13Å; A129-R133 PolarHBondContact O-N 3.48Å; A129-R133 VanDerWaalsContact O-N 3.11Å
130	E	95.3	Very high	95.6	Very high	40 Å²	40	68 Å²	68	19%	0.187	31%	0.313	C	S	.	.	H	α-helix	trans	-58.9	-47	173.3	-56.7	-44.9	147.5	0	0	111.6	N126 K132 R133 Y134 Y181 K184	N126-E130 PolarHBondContact O-N 3.33Å; E130-K132 PolarHBondContact O-N 3.45Å; E130-R133 WeakPolarHBondContact O-CA 3.49Å; E130-R133 WeakPolarHBondContact O-CB 3.37Å; E130-R133 PolarHBondContact O-N 3.48Å; E130-R133 IonicContact OE1-CZ 2.73Å; E130-R133 IonicContact OE1-NH2 3.29Å; E130-R133 PolarHBondContact OE1-NH2 2.86Å; E130-R133 IonicContact OE2-CZ 2.95Å; E130-R133 IonicContact OE2-NE 2.71Å; E130-R133 PolarHBondContact OE2-NE 3.11Å; E130-R133 IonicContact OE2-NH2 3.58Å; E130-R133 PolarHBondContact OE2-NH2 3.25Å; E130-Y134 PolarHBondContact O-N 3.24Å; E130-Y181 HydrophobicContact CB-CD2 3.62Å; E130-Y181 HydrophobicContact CB-CE2 4.14Å; E130-K184 HydrophobicContact CG-CB 4.38Å; E130-K184 HydrophobicContact CG-CG 3.99Å
131	R	96.3	Very high	95.7	Very high	68 Å²	68	65.8 Å²	65.8	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-49.8	-45.5	175.2	179.4	-172.5	168.7	114.5	39.8	112	E26 V127 A129 Y134 E135 Y181	E26-R131 IonicContact OE1-CZ 3.62Å; E26-R131 IonicContact OE1-NE 2.81Å; E26-R131 IonicContact OE1-NH1 3.29Å; E26-R131 IonicContact OE1-NH2 3.33Å; E26-R131 PolarHBondContact OE1-NH2 2.88Å; E26-R131 IonicContact OE2-CZ 3.81Å; E26-R131 IonicContact OE2-NH1 2.8Å; E26-R131 PolarHBondContact OE2-NH1 2.72Å; E26-R131 IonicContact OE2-NH2 3.06Å; E26-R131 PolarHBondContact OE2-NH2 3.45Å; V127-R131 WeakPolarHBondContact O-CB 3.4Å; V127-R131 PolarHBondContact O-N 2.96Å; A129-R131 PolarHBondContact O-N 3.3Å; R131-Y134 PolarHBondContact O-N 2.9Å; R131-E135 HydrophobicContact CG-CG 4.4Å; R131-E135 IonicContact CZ-OE1 3.5Å; R131-E135 IonicContact NE-OE1 2.75Å; R131-E135 PolarHBondContact NE-OE1 3.03Å; R131-E135 IonicContact NE-OE2 3.58Å; R131-E135 IonicContact NH2-OE1 3.22Å; R131-E135 PolarHBondContact NH2-OE1 3.16Å; R131-E135 WeakPolarHBondContact O-CB 3.41Å; R131-E135 VanDerWaalsContact O-CG 3.26Å; R131-E135 WeakPolarHBondContact O-CG 3.42Å; R131-E135 PolarHBondContact O-N 3.45Å; R131-Y181 HydrophobicContact CB-CE2 3.84Å; R131-Y181 WeakPolarHBondContact CB-OH 3.21Å
132	K	96.4	Very high	95.8	Very high	148 Å²	148	64.2 Å²	64.2	64%	0.643	30%	0.297	S	S	*	.	H	α-helix	trans	-70.4	-31.4	-179.9	-74.2	178.5	177.3	-172.1	0	113.4	R128 A129 E130 K136	R128-K132 WeakPolarHBondContact O-CG 3.45Å; R128-K132 PolarHBondContact O-N 3.3Å; A129-K132 PolarHBondContact O-N 3.13Å; E130-K132 PolarHBondContact O-N 3.45Å; K132-K136 VanDerWaalsContact O-CB 3.24Å; K132-K136 WeakPolarHBondContact O-CB 3.47Å; K132-K136 PolarHBondContact O-N 2.95Å
133	R	95.7	Very high	95.9	Very high	106 Å²	106	61.9 Å²	61.9	40%	0.4	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-54.5	170.4	-84.4	-175.7	-84.4	-89.7	-0.7	109.9	A129 E130 E135 K136 E137	A129-R133 PolarHBondContact O-N 3.48Å; A129-R133 VanDerWaalsContact O-N 3.11Å; E130-R133 WeakPolarHBondContact O-CA 3.49Å; E130-R133 WeakPolarHBondContact O-CB 3.37Å; E130-R133 PolarHBondContact O-N 3.48Å; E130-R133 IonicContact OE1-CZ 2.73Å; E130-R133 IonicContact OE1-NH2 3.29Å; E130-R133 PolarHBondContact OE1-NH2 2.86Å; E130-R133 IonicContact OE2-CZ 2.95Å; E130-R133 IonicContact OE2-NE 2.71Å; E130-R133 PolarHBondContact OE2-NE 3.11Å; E130-R133 IonicContact OE2-NH2 3.58Å; E130-R133 PolarHBondContact OE2-NH2 3.25Å; R133-E135 PolarHBondContact O-N 2.74Å; R133-K136 WeakPolarHBondContact O-CA 3.34Å; R133-K136 WeakPolarHBondContact O-CB 2.85Å; R133-K136 PolarHBondContact O-N 3Å; R133-E137 WeakPolarHBondContact O-CG 3.33Å; R133-E137 PolarHBondContact O-N 2.86Å
134	Y	97.1	Very high	95.9	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-55.4	-45	178.3	174.2	-115.5	0	0	0	113.5	R19 I22 E130 R131 K136 T138 F174 S178 Y181	R19-Y134 PolarHBondContact NE-OH 2.88Å; R19-Y134 PolarHBondContact NH1-OH 2.76Å; R19-Y134 VanDerWaalsContact NH1-OH 3.11Å; I22-Y134 HydrophobicContact CD1-CE1 4.4Å; E130-Y134 PolarHBondContact O-N 3.24Å; R131-Y134 PolarHBondContact O-N 2.9Å; Y134-K136 VanDerWaalsContact C-N 3.35Å; Y134-K136 PolarHBondContact O-N 2.89Å; Y134-T138 VanDerWaalsContact O-CB 3.27Å; Y134-T138 WeakPolarHBondContact O-CB 3.27Å; Y134-T138 PolarHBondContact O-N 3.18Å; Y134-T138 PolarHBondContact O-OG1 3.06Å; Y134-F174 HydrophobicContact CD2-CE2 4.39Å; Y134-F174 AromaticContact CE2-CE2 3.78Å; Y134-F174 HydrophobicContact CE2-CE2 3.78Å; Y134-F174 HydrophobicContact CE2-CZ 4.48Å; Y134-S178 WeakPolarHBondContact CE2-OG 3.46Å; Y134-Y181 AromaticContact CD1-CD1 3.24Å; Y134-Y181 HydrophobicContact CD1-CD1 3.24Å; Y134-Y181 AromaticContact CD1-CE1 3.48Å; Y134-Y181 HydrophobicContact CD1-CE1 3.48Å; Y134-Y181 VanDerWaalsContact CD1-CE1 3.48Å; Y134-Y181 HydrophobicContact CD1-CG 4.18Å; Y134-Y181 HydrophobicContact CD2-CD1 4.15Å; Y134-Y181 AromaticContact CE1-CD1 3.69Å; Y134-Y181 HydrophobicContact CE1-CD1 3.69Å; Y134-Y181 AromaticContact CE1-CE1 3.89Å; Y134-Y181 HydrophobicContact CE1-CE1 3.89Å; Y134-Y181 AromaticContact CG-CD1 3.46Å; Y134-Y181 HydrophobicContact CG-CD1 3.46Å; Y134-Y181 VanDerWaalsContact CG-CD1 3.46Å; Y134-Y181 HydrophobicContact CG-CE1 4.14Å; Y134-Y181 AromaticContact CG-CG 4Å; Y134-Y181 HydrophobicContact CG-CG 4Å
135	E	96.7	Very high	96	Very high	81 Å²	81	62.8 Å²	62.8	38%	0.379	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-40.9	175	-75.7	169.9	167.6	0	0	111.9	R131 R133 T138 E139	R131-E135 HydrophobicContact CG-CG 4.4Å; R131-E135 IonicContact CZ-OE1 3.5Å; R131-E135 IonicContact NE-OE1 2.75Å; R131-E135 PolarHBondContact NE-OE1 3.03Å; R131-E135 IonicContact NE-OE2 3.58Å; R131-E135 IonicContact NH2-OE1 3.22Å; R131-E135 PolarHBondContact NH2-OE1 3.16Å; R131-E135 WeakPolarHBondContact O-CB 3.41Å; R131-E135 VanDerWaalsContact O-CG 3.26Å; R131-E135 WeakPolarHBondContact O-CG 3.42Å; R131-E135 PolarHBondContact O-N 3.45Å; R133-E135 PolarHBondContact O-N 2.74Å; E135-T138 WeakPolarHBondContact O-CB 3.32Å; E135-E139 PolarHBondContact O-N 2.73Å
136	K	97.1	Very high	96.1	Very high	117 Å²	117	67.3 Å²	67.3	51%	0.509	31%	0.311	S	S	.	.	H	α-helix	trans	-70.4	-42.7	179.3	179.6	-168.5	175.7	-164.8	0	113	K132 R133 Y134 E139 K140	K132-K136 VanDerWaalsContact O-CB 3.24Å; K132-K136 WeakPolarHBondContact O-CB 3.47Å; K132-K136 PolarHBondContact O-N 2.95Å; R133-K136 WeakPolarHBondContact O-CA 3.34Å; R133-K136 WeakPolarHBondContact O-CB 2.85Å; R133-K136 PolarHBondContact O-N 3Å; Y134-K136 VanDerWaalsContact C-N 3.35Å; Y134-K136 PolarHBondContact O-N 2.89Å; K136-E139 PolarHBondContact O-N 2.84Å; K136-K140 WeakPolarHBondContact O-CG 3.3Å; K136-K140 PolarHBondContact O-N 3.41Å
137	E	96.5	Very high	96.1	Very high	17 Å²	17	69.6 Å²	69.6	8%	0.079	32%	0.317	C	S	.	.	H	α-helix	trans	-73	-32	177.7	-56	-47.8	125.2	0	0	111.2	R133 K140 Y141 H173 E177	R133-E137 WeakPolarHBondContact O-CG 3.33Å; R133-E137 PolarHBondContact O-N 2.86Å; E137-K140 VanDerWaalsContact CD-CD 3.5Å; E137-K140 PolarHBondContact O-N 3.06Å; E137-K140 WeakPolarHBondContact OE1-CD 3.4Å; E137-K140 WeakPolarHBondContact OE1-CE 3.35Å; E137-K140 IonicContact OE1-NZ 2.68Å; E137-K140 PolarHBondContact OE1-NZ 2.91Å; E137-K140 WeakPolarHBondContact OE2-CD 3.44Å; E137-K140 WeakPolarHBondContact OE2-CE 3.4Å; E137-K140 IonicContact OE2-NZ 2.62Å; E137-K140 PolarHBondContact OE2-NZ 2.92Å; E137-Y141 WeakPolarHBondContact O-CB 3.49Å; E137-Y141 PolarHBondContact O-N 3.48Å; E137-H173 IonicContact OE2-CD2 2.72Å; E137-H173 PolarHBondContact OE2-CD2 2.93Å; E137-H173 IonicContact OE2-NE2 3.54Å; E137-E177 HydrophobicContact CG-CG 4.15Å
138	T	96.6	Very high	96.1	Very high	20 Å²	20	70.6 Å²	70.6	12%	0.123	32%	0.322	C	S	.	.	H	α-helix	trans	-54.7	-53.3	165.6	-62.3	0	0	0	0	110.7	R19 Y134 E135 K140 Y141 Y142 F174	R19-T138 PolarHBondContact NH1-OG1 3.07Å; R19-T138 VanDerWaalsContact NH2-CG2 3.27Å; R19-T138 PolarHBondContact NH2-OG1 3.01Å; Y134-T138 VanDerWaalsContact O-CB 3.27Å; Y134-T138 WeakPolarHBondContact O-CB 3.27Å; Y134-T138 PolarHBondContact O-N 3.18Å; Y134-T138 PolarHBondContact O-OG1 3.06Å; E135-T138 WeakPolarHBondContact O-CB 3.32Å; T138-K140 PolarHBondContact O-N 3.46Å; T138-Y141 PolarHBondContact O-N 3.01Å; T138-Y142 HydrophobicContact CG2-CD2 3.81Å; T138-Y142 HydrophobicContact CG2-CE2 4.03Å; T138-Y142 WeakPolarHBondContact O-CD2 3.46Å; T138-Y142 PolarHBondContact O-N 3.14Å; T138-Y142 VanDerWaalsContact O-N 3.12Å; T138-F174 WeakPolarHBondContact OG1-CE2 3.47Å
139	E	97.1	Very high	96.1	Very high	144 Å²	144	72.1 Å²	72.1	67%	0.673	34%	0.337	S	S	*	.	H	α-helix	trans	-61.3	-44.7	-178.2	-174.4	-178.7	-171.6	0	0	112.2	E135 K136 S143	E135-E139 PolarHBondContact O-N 2.73Å; K136-E139 PolarHBondContact O-N 2.84Å; E139-S143 WeakPolarHBondContact O-CB 3.12Å; E139-S143 PolarHBondContact O-N 3.36Å
140	K	96.1	Very high	96.1	Very high	89 Å²	89	76.1 Å²	76.1	39%	0.387	35%	0.353	S	S	.	.	H	α-helix	trans	-58.5	-50.3	176	-79.4	163	151.1	-173	0	112.5	K136 E137 T138 S143 S144	K136-K140 WeakPolarHBondContact O-CG 3.3Å; K136-K140 PolarHBondContact O-N 3.41Å; E137-K140 VanDerWaalsContact CD-CD 3.5Å; E137-K140 PolarHBondContact O-N 3.06Å; E137-K140 WeakPolarHBondContact OE1-CD 3.4Å; E137-K140 WeakPolarHBondContact OE1-CE 3.35Å; E137-K140 IonicContact OE1-NZ 2.68Å; E137-K140 PolarHBondContact OE1-NZ 2.91Å; E137-K140 WeakPolarHBondContact OE2-CD 3.44Å; E137-K140 WeakPolarHBondContact OE2-CE 3.4Å; E137-K140 IonicContact OE2-NZ 2.62Å; E137-K140 PolarHBondContact OE2-NZ 2.92Å; T138-K140 PolarHBondContact O-N 3.46Å; K140-S143 PolarHBondContact O-N 2.94Å; K140-S144 WeakPolarHBondContact O-CB 3.34Å; K140-S144 PolarHBondContact O-N 3.18Å
141	Y	97.4	Very high	95.9	Very high	29 Å²	29	76.5 Å²	76.5	11%	0.114	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-53.3	-177.7	166.4	-121.5	0	0	0	110.9	E137 T138 S143 S144 L145 V167 M170 R171 F174	E137-Y141 WeakPolarHBondContact O-CB 3.49Å; E137-Y141 PolarHBondContact O-N 3.48Å; T138-Y141 PolarHBondContact O-N 3.01Å; Y141-S143 PolarHBondContact O-N 3.46Å; Y141-S144 PolarHBondContact O-N 3.06Å; Y141-S144 VanDerWaalsContact O-N 3.11Å; Y141-L145 HydrophobicContact CE2-CB 4.43Å; Y141-L145 WeakPolarHBondContact O-CB 3.43Å; Y141-L145 PolarHBondContact O-N 2.66Å; Y141-V167 HydrophobicContact CE2-CG1 4.11Å; Y141-M170 HydrophobicContact CD2-CB 4.32Å; Y141-R171 HydrophobicContact CD2-CB 4.03Å; Y141-R171 HydrophobicContact CE2-CB 3.51Å; Y141-R171 HydrophobicContact CE2-CG 3.76Å; Y141-F174 HydrophobicContact CD1-CB 4.35Å; Y141-F174 AromaticContact CD1-CD1 3.57Å; Y141-F174 HydrophobicContact CD1-CD1 3.57Å; Y141-F174 HydrophobicContact CD1-CE1 4.12Å; Y141-F174 AromaticContact CD1-CG 3.96Å; Y141-F174 HydrophobicContact CD1-CG 3.96Å; Y141-F174 AromaticContact CE1-CD1 3.98Å; Y141-F174 HydrophobicContact CE1-CD1 3.98Å; Y141-F174 HydrophobicContact CE1-CE1 4.31Å; Y141-F174 HydrophobicContact CG-CB 4.15Å; Y141-F174 HydrophobicContact CG-CD1 4.21Å; Y141-F174 HydrophobicContact CG-CG 4.26Å
142	Y	97.1	Very high	95.7	Very high	101 Å²	101	76.5 Å²	76.5	40%	0.396	37%	0.366	S	S	.	.	H	α-helix	trans	-64.8	-36.7	-179.6	-78.4	-69.3	0	0	0	112.9	D14 T138 S144 L145 E146	D14-Y142 PolarHBondContact OD2-OH 3.3Å; T138-Y142 HydrophobicContact CG2-CD2 3.81Å; T138-Y142 HydrophobicContact CG2-CE2 4.03Å; T138-Y142 WeakPolarHBondContact O-CD2 3.46Å; T138-Y142 PolarHBondContact O-N 3.14Å; T138-Y142 VanDerWaalsContact O-N 3.12Å; Y142-S144 VanDerWaalsContact C-N 3.31Å; Y142-S144 PolarHBondContact O-N 3.32Å; Y142-L145 HydrophobicContact CD1-CD2 4.26Å; Y142-L145 HydrophobicContact CE1-CD2 4.44Å; Y142-L145 PolarHBondContact O-N 2.89Å; Y142-E146 WeakPolarHBondContact O-CB 3.28Å; Y142-E146 PolarHBondContact O-N 3Å
143	S	96.3	Very high	95.3	Very high	45 Å²	45	74 Å²	74	32%	0.315	37%	0.373	S	S	.	.	H	α-helix	trans	-66.1	-31.1	173.6	-174.8	0	0	0	0	113.2	E139 K140 Y141 K147	E139-S143 WeakPolarHBondContact O-CB 3.12Å; E139-S143 PolarHBondContact O-N 3.36Å; K140-S143 PolarHBondContact O-N 2.94Å; Y141-S143 PolarHBondContact O-N 3.46Å; S143-K147 VanDerWaalsContact O-CD 3.26Å; S143-K147 WeakPolarHBondContact O-CD 3.3Å; S143-K147 WeakPolarHBondContact O-CE 3.34Å; S143-K147 VanDerWaalsContact O-CG 3.27Å; S143-K147 WeakPolarHBondContact O-CG 3.33Å; S143-K147 PolarHBondContact O-N 3.09Å; S143-K147 PolarHBondContact O-NZ 2.96Å; S143-K147 PolarHBondContact OG-NZ 2.96Å
144	S	95.4	Very high	95	Very high	13 Å²	13	78.4 Å²	78.4	9%	0.091	40%	0.396	C	S	.	.	H	α-helix	trans	-76.2	-43.8	175.9	-157.7	0	0	0	0	111.3	K140 Y141 Y142 E146 K147 L148 M170	K140-S144 WeakPolarHBondContact O-CB 3.34Å; K140-S144 PolarHBondContact O-N 3.18Å; Y141-S144 PolarHBondContact O-N 3.06Å; Y141-S144 VanDerWaalsContact O-N 3.11Å; Y142-S144 VanDerWaalsContact C-N 3.31Å; Y142-S144 PolarHBondContact O-N 3.32Å; S144-E146 PolarHBondContact O-N 2.65Å; S144-K147 WeakPolarHBondContact O-CB 3.35Å; S144-K147 PolarHBondContact O-N 3.08Å; S144-K147 VanDerWaalsContact O-N 3.15Å; S144-L148 PolarHBondContact O-N 2.82Å; S144-M170 WeakPolarHBondContact CB-SD 3.21Å; S144-M170 PolarHBondContact OG-SD 2.95Å; S144-M170 VanDerWaalsContact OG-SD 3.41Å
145	L	96.6	Very high	94.7	Very high	41 Å²	41	83 Å²	83	22%	0.215	42%	0.416	C	S	.	.	H	α-helix	trans	-59	-44.2	174.3	179.2	62.8	0	0	0	111.7	Y141 Y142 K147 L148 L149 V167	Y141-L145 HydrophobicContact CE2-CB 4.43Å; Y141-L145 WeakPolarHBondContact O-CB 3.43Å; Y141-L145 PolarHBondContact O-N 2.66Å; Y142-L145 HydrophobicContact CD1-CD2 4.26Å; Y142-L145 HydrophobicContact CE1-CD2 4.44Å; Y142-L145 PolarHBondContact O-N 2.89Å; L145-K147 VanDerWaalsContact C-N 3.31Å; L145-K147 PolarHBondContact O-N 3.1Å; L145-L148 WeakPolarHBondContact O-CB 3.42Å; L145-L148 PolarHBondContact O-N 3.31Å; L145-L149 HydrophobicContact CD1-CD1 4.13Å; L145-L149 HydrophobicContact CD1-CG 4.16Å; L145-L149 HydrophobicContact CG-CD1 3.97Å; L145-L149 HydrophobicContact CG-CG 4.4Å; L145-L149 WeakPolarHBondContact O-CG 3.33Å; L145-L149 PolarHBondContact O-N 3.03Å; L145-V167 HydrophobicContact CB-CG1 4.21Å; L145-V167 HydrophobicContact CD1-CG1 3.95Å
146	E	96.8	Very high	94.4	Very high	123 Å²	123	86.6 Å²	86.6	58%	0.575	43%	0.43	S	S	*	.	H	α-helix	trans	-60.9	-38.5	175.7	-177.5	176.9	-154.3	0	0	112.2	Y142 S144 L149 N150	Y142-E146 WeakPolarHBondContact O-CB 3.28Å; Y142-E146 PolarHBondContact O-N 3Å; S144-E146 PolarHBondContact O-N 2.65Å; E146-L149 PolarHBondContact O-N 2.82Å; E146-N150 WeakPolarHBondContact CG-ND2 3.42Å; E146-N150 WeakPolarHBondContact O-CB 3.24Å; E146-N150 PolarHBondContact O-N 3.07Å; E146-N150 VanDerWaalsContact O-N 3.09Å; E146-N150 PolarHBondContact O-ND2 3.41Å
147	K	94.3	Very high	94	Very high	130 Å²	130	86.6 Å²	86.6	57%	0.565	43%	0.432	S	S	*	.	H	α-helix	trans	-65.7	-39.7	175.2	-70.8	161	-171	141.1	0	111.9	S143 S144 L145 N150 L151	S143-K147 VanDerWaalsContact O-CD 3.26Å; S143-K147 WeakPolarHBondContact O-CD 3.3Å; S143-K147 WeakPolarHBondContact O-CE 3.34Å; S143-K147 VanDerWaalsContact O-CG 3.27Å; S143-K147 WeakPolarHBondContact O-CG 3.33Å; S143-K147 PolarHBondContact O-N 3.09Å; S143-K147 PolarHBondContact O-NZ 2.96Å; S143-K147 PolarHBondContact OG-NZ 2.96Å; S144-K147 WeakPolarHBondContact O-CB 3.35Å; S144-K147 PolarHBondContact O-N 3.08Å; S144-K147 VanDerWaalsContact O-N 3.15Å; L145-K147 VanDerWaalsContact C-N 3.31Å; L145-K147 PolarHBondContact O-N 3.1Å; K147-N150 PolarHBondContact O-N 3.27Å; K147-L151 PolarHBondContact O-N 3.26Å
148	L	94.5	Very high	93.8	Very high	29 Å²	29	89.8 Å²	89.8	15%	0.152	45%	0.454	C	S	.	.	H	α-helix	trans	-63.6	-48.4	174.3	177.4	63.2	0	0	0	111.9	S144 L145 N150 L151 A163 V167	S144-L148 PolarHBondContact O-N 2.82Å; L145-L148 WeakPolarHBondContact O-CB 3.42Å; L145-L148 PolarHBondContact O-N 3.31Å; L148-N150 PolarHBondContact O-N 2.98Å; L148-L151 HydrophobicContact CD1-CD1 4.26Å; L148-L151 WeakPolarHBondContact O-CB 3.47Å; L148-L151 PolarHBondContact O-N 2.96Å; L148-A163 HydrophobicContact CD1-CB 3.7Å; L148-V167 HydrophobicContact CB-CG2 3.75Å; L148-V167 HydrophobicContact CD2-CB 3.79Å; L148-V167 HydrophobicContact CD2-CG1 4.08Å; L148-V167 HydrophobicContact CD2-CG2 3.71Å; L148-V167 HydrophobicContact CG-CG2 4.33Å
149	L	94.1	Very high	93.3	Very high	131 Å²	131	93.2 Å²	93.2	69%	0.686	47%	0.469	S	S	*	.	H	α-helix	trans	-65.7	-23.7	-179.8	-65.9	173.8	0	0	0	113.1	L145 E146	L145-L149 HydrophobicContact CD1-CD1 4.13Å; L145-L149 HydrophobicContact CD1-CG 4.16Å; L145-L149 HydrophobicContact CG-CD1 3.97Å; L145-L149 HydrophobicContact CG-CG 4.4Å; L145-L149 WeakPolarHBondContact O-CG 3.33Å; L145-L149 PolarHBondContact O-N 3.03Å; E146-L149 PolarHBondContact O-N 2.82Å
150	N	94.1	Very high	92.9	Very high	122 Å²	122	88 Å²	88	65%	0.652	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	0.3	174	-74.6	-61.9	0	0	0	114.3	E146 K147 L148 S152	E146-N150 WeakPolarHBondContact CG-ND2 3.42Å; E146-N150 WeakPolarHBondContact O-CB 3.24Å; E146-N150 PolarHBondContact O-N 3.07Å; E146-N150 VanDerWaalsContact O-N 3.09Å; E146-N150 PolarHBondContact O-ND2 3.41Å; K147-N150 PolarHBondContact O-N 3.27Å; L148-N150 PolarHBondContact O-N 2.98Å; N150-S152 PolarHBondContact O-N 3.12Å
151	L	92.9	Very high	92.7	Very high	49 Å²	49	88.6 Å²	88.6	26%	0.257	45%	0.45	S	S	.	.	S	Bend	trans	-70.6	129.4	174.2	-96.4	138.9	0	0	0	110.9	K147 L148 A153 K155 A163	K147-L151 PolarHBondContact O-N 3.26Å; L148-L151 HydrophobicContact CD1-CD1 4.26Å; L148-L151 WeakPolarHBondContact O-CB 3.47Å; L148-L151 PolarHBondContact O-N 2.96Å; L151-A153 PolarHBondContact O-N 3.32Å; L151-K155 HydrophobicContact CD2-CD 3.48Å; L151-K155 VanDerWaalsContact CD2-CD 3.48Å; L151-K155 HydrophobicContact CD2-CG 4.06Å; L151-A163 HydrophobicContact CD1-CB 3.85Å
152	S	91.6	Very high	92.4	Very high	67 Å²	67	93.9 Å²	93.9	47%	0.469	48%	0.475	S	S	.	.			trans	-61.9	123.6	176.6	172.3	0	0	0	0	111.5	N150 K154 K155	N150-S152 PolarHBondContact O-N 3.12Å; S152-K154 PolarHBondContact O-N 3.44Å; S152-K154 PolarHBondContact OG-N 3Å; S152-K155 WeakPolarHBondContact O-CB 3.47Å; S152-K155 WeakPolarHBondContact O-CG 3.34Å; S152-K155 PolarHBondContact O-N 2.94Å
153	A	88.2	Confident	92.2	Very high	96 Å²	96	89.8 Å²	89.8	79%	0.793	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-5.2	173.5	0	0	0	0	0	114.8	L151	L151-A153 PolarHBondContact O-N 3.32Å
154	K	89.8	Confident	92.1	Very high	199 Å²	199	91.6 Å²	91.6	87%	0.865	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	2.1	171.8	-58.9	-178.6	-179.7	178.1	0	113.6	S152	S152-K154 PolarHBondContact O-N 3.44Å; S152-K154 PolarHBondContact OG-N 3Å
155	K	90.1	Very high	92.1	Very high	101 Å²	101	94.4 Å²	94.4	44%	0.439	49%	0.488	S	S	.	.	S	Bend	trans	-67	161.6	173.7	-77.8	-130	-178.1	169	0	111.3	L151 S152 Q159 L160	L151-K155 HydrophobicContact CD2-CD 3.48Å; L151-K155 VanDerWaalsContact CD2-CD 3.48Å; L151-K155 HydrophobicContact CD2-CG 4.06Å; S152-K155 WeakPolarHBondContact O-CB 3.47Å; S152-K155 WeakPolarHBondContact O-CG 3.34Å; S152-K155 PolarHBondContact O-N 2.94Å; K155-Q159 HydrophobicContact CD-CB 4.45Å; K155-L160 HydrophobicContact CB-CD2 3.99Å; K155-L160 HydrophobicContact CB-CG 4.14Å
156	K	89.7	Confident	92	Very high	155 Å²	155	97.8 Å²	97.8	67%	0.674	50%	0.503	S	S	*	.			trans	-69.9	134.4	176	-67	-176	177.1	-177.3	0	109.6	P158 Q159 L160	K156-P158 HydrophobicContact CB-CG 4.35Å; K156-P158 VanDerWaalsContact O-N 3.16Å; K156-Q159 HydrophobicContact CB-CG 4.49Å; K156-Q159 WeakPolarHBondContact O-CA 3.3Å; K156-Q159 WeakPolarHBondContact O-CB 3.27Å; K156-Q159 PolarHBondContact O-N 2.94Å; K156-L160 PolarHBondContact O-N 3.25Å
157	E	89.2	Confident	92	Very high	117 Å²	117	92.4 Å²	92.4	55%	0.547	48%	0.478	S	S	.	.	H	α-helix	trans	-36.4	-53.6	176.6	-171.2	62.1	-157.4	0	0	115.4	Q159 L160 Q161	E157-Q159 PolarHBondContact O-N 2.85Å; E157-L160 WeakPolarHBondContact O-CB 3.3Å; E157-L160 PolarHBondContact O-N 2.98Å; E157-Q161 PolarHBondContact O-N 3.04Å; E157-Q161 PolarHBondContact OE1-NE2 3.05Å
158	P	91.2	Very high	92	Very high	85 Å²	85	89.2 Å²	89.2	55%	0.552	47%	0.465	S	S	*	.	H	α-helix	trans	-61.8	-27.4	179.1	23.4	-36	0	0	0	114.5	K156 E162	K156-P158 HydrophobicContact CB-CG 4.35Å; K156-P158 VanDerWaalsContact O-N 3.16Å; P158-E162 VanDerWaalsContact O-CB 3.31Å; P158-E162 WeakPolarHBondContact O-CB 3.49Å; P158-E162 PolarHBondContact O-N 3.04Å
159	Q	87.6	Confident	92.1	Very high	92 Å²	92	93.4 Å²	93.4	43%	0.43	49%	0.487	S	S	.	.	H	α-helix	trans	-79.8	-19	176.6	-62.4	-177.2	-23	0	0	112.9	K155 K156 E157	K155-Q159 HydrophobicContact CD-CB 4.45Å; K156-Q159 HydrophobicContact CB-CG 4.49Å; K156-Q159 WeakPolarHBondContact O-CA 3.3Å; K156-Q159 WeakPolarHBondContact O-CB 3.27Å; K156-Q159 PolarHBondContact O-N 2.94Å; E157-Q159 PolarHBondContact O-N 2.85Å
160	L	89.3	Confident	92.2	Very high	35 Å²	35	90.2 Å²	90.2	18%	0.183	47%	0.47	C	S	.	.	H	α-helix	trans	-79.6	-51.2	170.8	-65	171.5	0	0	0	108.7	K155 K156 E157 E162 A163 D164	K155-L160 HydrophobicContact CB-CD2 3.99Å; K155-L160 HydrophobicContact CB-CG 4.14Å; K156-L160 PolarHBondContact O-N 3.25Å; E157-L160 WeakPolarHBondContact O-CB 3.3Å; E157-L160 PolarHBondContact O-N 2.98Å; L160-E162 VanDerWaalsContact C-N 3.3Å; L160-E162 PolarHBondContact O-N 2.8Å; L160-A163 WeakPolarHBondContact O-CA 3.45Å; L160-A163 PolarHBondContact O-N 2.89Å; L160-D164 PolarHBondContact O-N 2.66Å
161	Q	90.9	Very high	92.3	Very high	101 Å²	101	88.8 Å²	88.8	47%	0.472	46%	0.455	S	S	.	.	H	α-helix	trans	-58	-36.8	177.8	-65.8	178.5	0.6	0	0	113.6	E157 S165	E157-Q161 PolarHBondContact O-N 3.04Å; E157-Q161 PolarHBondContact OE1-NE2 3.05Å; Q161-S165 WeakPolarHBondContact O-CB 3.44Å; Q161-S165 PolarHBondContact O-N 3.39Å; Q161-S165 PolarHBondContact O-OG 3.4Å
162	E	92.1	Very high	92.4	Very high	139 Å²	139	90.5 Å²	90.5	65%	0.65	46%	0.462	S	S	*	.	H	α-helix	trans	-63.5	-42.9	172.9	-176.3	178.2	-168.7	0	0	112	P158 L160 Q166	P158-E162 VanDerWaalsContact O-CB 3.31Å; P158-E162 WeakPolarHBondContact O-CB 3.49Å; P158-E162 PolarHBondContact O-N 3.04Å; L160-E162 VanDerWaalsContact C-N 3.3Å; L160-E162 PolarHBondContact O-N 2.8Å; E162-Q166 WeakPolarHBondContact O-CB 3.4Å; E162-Q166 PolarHBondContact O-N 3.39Å
163	A	92.5	Very high	92.6	Very high	15 Å²	15	90.8 Å²	90.8	12%	0.124	46%	0.455	C	S	.	.	H	α-helix	trans	-72.2	-39.5	179.1	0	0	0	0	0	112.2	L148 L151 L160 Q166 V167	L148-A163 HydrophobicContact CD1-CB 3.7Å; L151-A163 HydrophobicContact CD1-CB 3.85Å; L160-A163 WeakPolarHBondContact O-CA 3.45Å; L160-A163 PolarHBondContact O-N 2.89Å; A163-Q166 PolarHBondContact O-N 3.19Å; A163-V167 PolarHBondContact O-N 2.88Å
164	D	93.9	Very high	93.1	Very high	83 Å²	83	86.4 Å²	86.4	44%	0.444	42%	0.419	S	S	.	.	H	α-helix	trans	-58.2	-49.1	171.8	-69.3	-42	0	0	0	110.6	L160 Q166 V167 E168	L160-D164 PolarHBondContact O-N 2.66Å; D164-Q166 VanDerWaalsContact C-N 3.31Å; D164-Q166 PolarHBondContact O-N 2.94Å; D164-V167 PolarHBondContact O-N 3.22Å; D164-E168 WeakPolarHBondContact O-CB 3.4Å; D164-E168 PolarHBondContact O-N 3.48Å
165	S	95.1	Very high	93.4	Very high	72 Å²	72	78.2 Å²	78.2	50%	0.503	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-38.6	178.1	-57.5	0	0	0	0	112.2	Q161 E168 L169	Q161-S165 WeakPolarHBondContact O-CB 3.44Å; Q161-S165 PolarHBondContact O-N 3.39Å; Q161-S165 PolarHBondContact O-OG 3.4Å; S165-E168 PolarHBondContact O-N 2.92Å; S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 2.67Å; S165-L169 VanDerWaalsContact O-N 3.08Å
166	Q	94.3	Very high	93.7	Very high	113 Å²	113	78.9 Å²	78.9	53%	0.528	39%	0.388	S	S	.	.	H	α-helix	trans	-67.2	-40.6	177.9	-172.6	177.6	28.7	0	0	112.4	E162 A163 D164 M170	E162-Q166 WeakPolarHBondContact O-CB 3.4Å; E162-Q166 PolarHBondContact O-N 3.39Å; A163-Q166 PolarHBondContact O-N 3.19Å; D164-Q166 VanDerWaalsContact C-N 3.31Å; D164-Q166 PolarHBondContact O-N 2.94Å; Q166-M170 PolarHBondContact O-N 3.11Å
167	V	96.1	Very high	94	Very high	10 Å²	10	73.1 Å²	73.1	6%	0.061	36%	0.364	C	S	.	.	H	α-helix	trans	-71.6	-37	176.2	172.4	0	0	0	0	111.4	Y141 L145 L148 A163 D164 M170 R171	Y141-V167 HydrophobicContact CE2-CG1 4.11Å; L145-V167 HydrophobicContact CB-CG1 4.21Å; L145-V167 HydrophobicContact CD1-CG1 3.95Å; L148-V167 HydrophobicContact CB-CG2 3.75Å; L148-V167 HydrophobicContact CD2-CB 3.79Å; L148-V167 HydrophobicContact CD2-CG1 4.08Å; L148-V167 HydrophobicContact CD2-CG2 3.71Å; L148-V167 HydrophobicContact CG-CG2 4.33Å; A163-V167 PolarHBondContact O-N 2.88Å; D164-V167 PolarHBondContact O-N 3.22Å; V167-M170 PolarHBondContact O-N 3.07Å; V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 PolarHBondContact O-N 2.92Å
168	E	95.7	Very high	94.4	Very high	62 Å²	62	67.6 Å²	67.6	29%	0.29	34%	0.338	S	S	.	.	H	α-helix	trans	-60.1	-45.7	175.2	-176.4	58.7	-140.7	0	0	111.6	D164 S165 M170 R171 Q172	D164-E168 WeakPolarHBondContact O-CB 3.4Å; D164-E168 PolarHBondContact O-N 3.48Å; S165-E168 PolarHBondContact O-N 2.92Å; E168-M170 VanDerWaalsContact C-N 3.34Å; E168-M170 PolarHBondContact O-N 2.84Å; E168-R171 WeakPolarHBondContact O-CB 3.5Å; E168-R171 PolarHBondContact O-N 2.84Å; E168-R171 VanDerWaalsContact O-N 3.16Å; E168-R171 IonicContact OE1-CZ 2.64Å; E168-R171 IonicContact OE1-NE 2.76Å; E168-R171 IonicContact OE1-NH2 2.67Å; E168-R171 PolarHBondContact OE1-NH2 3.3Å; E168-R171 IonicContact OE2-CZ 3.79Å; E168-R171 IonicContact OE2-NE 2.87Å; E168-R171 IonicContact OE2-NH1 3.41Å; E168-R171 PolarHBondContact OE2-NH1 3.13Å; E168-R171 IonicContact OE2-NH2 2.82Å; E168-R171 PolarHBondContact OE2-NH2 2.93Å; E168-Q172 WeakPolarHBondContact O-CG 3.06Å; E168-Q172 PolarHBondContact O-N 2.73Å; E168-Q172 PolarHBondContact OE1-NE2 3.05Å
169	L	95.9	Very high	94.7	Very high	117 Å²	117	65.4 Å²	65.4	61%	0.613	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-41.1	174.3	-72.8	169.6	0	0	0	112.3	S165 R171 Q172 H173	S165-L169 WeakPolarHBondContact O-CG 3.44Å; S165-L169 PolarHBondContact O-N 2.67Å; S165-L169 VanDerWaalsContact O-N 3.08Å; L169-R171 VanDerWaalsContact C-N 3.34Å; L169-Q172 PolarHBondContact O-N 2.86Å; L169-H173 PolarHBondContact O-N 2.94Å; L169-H173 VanDerWaalsContact O-N 3.12Å
170	M	96.1	Very high	95.2	Very high	65 Å²	65	67 Å²	67	32%	0.32	33%	0.328	S	S	.	.	H	α-helix	trans	-68.3	-32.7	175.1	-73.4	-166.5	173.1	0	0	112.9	Y141 S144 Q166 V167 E168 F174	Y141-M170 HydrophobicContact CD2-CB 4.32Å; S144-M170 WeakPolarHBondContact CB-SD 3.21Å; S144-M170 PolarHBondContact OG-SD 2.95Å; S144-M170 VanDerWaalsContact OG-SD 3.41Å; Q166-M170 PolarHBondContact O-N 3.11Å; V167-M170 PolarHBondContact O-N 3.07Å; E168-M170 VanDerWaalsContact C-N 3.34Å; E168-M170 PolarHBondContact O-N 2.84Å; M170-F174 WeakPolarHBondContact O-CB 3.25Å; M170-F174 PolarHBondContact O-N 3.15Å
171	R	96.1	Very high	95.6	Very high	92 Å²	92	65.5 Å²	65.5	35%	0.347	32%	0.321	S	S	.	.	H	α-helix	trans	-65.5	-45.9	175.2	-169.2	177.9	74.3	-165	2.6	111.1	Y141 V167 E168 L169 F174 Q175	Y141-R171 HydrophobicContact CD2-CB 4.03Å; Y141-R171 HydrophobicContact CE2-CB 3.51Å; Y141-R171 HydrophobicContact CE2-CG 3.76Å; V167-R171 WeakPolarHBondContact O-CB 3.42Å; V167-R171 PolarHBondContact O-N 2.92Å; E168-R171 WeakPolarHBondContact O-CB 3.5Å; E168-R171 PolarHBondContact O-N 2.84Å; E168-R171 VanDerWaalsContact O-N 3.16Å; E168-R171 IonicContact OE1-CZ 2.64Å; E168-R171 IonicContact OE1-NE 2.76Å; E168-R171 IonicContact OE1-NH2 2.67Å; E168-R171 PolarHBondContact OE1-NH2 3.3Å; E168-R171 IonicContact OE2-CZ 3.79Å; E168-R171 IonicContact OE2-NE 2.87Å; E168-R171 IonicContact OE2-NH1 3.41Å; E168-R171 PolarHBondContact OE2-NH1 3.13Å; E168-R171 IonicContact OE2-NH2 2.82Å; E168-R171 PolarHBondContact OE2-NH2 2.93Å; L169-R171 VanDerWaalsContact C-N 3.34Å; R171-F174 PolarHBondContact O-N 3.47Å; R171-Q175 WeakPolarHBondContact O-CB 3.46Å; R171-Q175 VanDerWaalsContact O-CG 3.24Å; R171-Q175 WeakPolarHBondContact O-CG 3.31Å; R171-Q175 PolarHBondContact O-N 2.96Å
172	Q	95.6	Very high	95.9	Very high	84 Å²	84	60.7 Å²	60.7	39%	0.393	30%	0.298	S	S	.	.	H	α-helix	trans	-60.7	-49.4	178	-70.6	171.3	13.3	0	0	110.7	E168 L169 F174 Q175 E176	E168-Q172 WeakPolarHBondContact O-CG 3.06Å; E168-Q172 PolarHBondContact O-N 2.73Å; E168-Q172 PolarHBondContact OE1-NE2 3.05Å; L169-Q172 PolarHBondContact O-N 2.86Å; Q172-F174 PolarHBondContact O-N 3.42Å; Q172-Q175 PolarHBondContact O-N 3.3Å; Q172-Q175 VanDerWaalsContact O-N 3.12Å; Q172-E176 WeakPolarHBondContact O-CG 3.27Å; Q172-E176 PolarHBondContact O-N 3.44Å
173	H	96.3	Very high	96	Very high	73 Å²	73	57 Å²	57	34%	0.338	29%	0.287	S	S	.	.	H	α-helix	trans	-62.6	-40.4	178.1	-172.7	41.7	0	0	0	113	E137 L169 Q175 E176 E177	E137-H173 IonicContact OE2-CD2 2.72Å; E137-H173 PolarHBondContact OE2-CD2 2.93Å; E137-H173 IonicContact OE2-NE2 3.54Å; L169-H173 PolarHBondContact O-N 2.94Å; L169-H173 VanDerWaalsContact O-N 3.12Å; H173-Q175 VanDerWaalsContact C-N 3.35Å; H173-Q175 PolarHBondContact O-N 3.23Å; H173-E176 PolarHBondContact O-N 3.1Å; H173-E177 IonicContact CE1-OE1 2.66Å; H173-E177 PolarHBondContact CE1-OE1 3.39Å; H173-E177 WeakPolarHBondContact O-CG 3.37Å; H173-E177 PolarHBondContact O-N 3.29Å
174	F	97.1	Very high	96.2	Very high	4 Å²	4	58.5 Å²	58.5	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-41.1	172.8	161.2	-109.4	0	0	0	112.3	D14 Y134 T138 Y141 M170 R171 Q172 S178	D14-F174 HydrophobicContact CB-CE1 4.34Å; D14-F174 HydrophobicContact CB-CZ 4.31Å; D14-F174 WeakPolarHBondContact OD2-CZ 3.4Å; Y134-F174 HydrophobicContact CD2-CE2 4.39Å; Y134-F174 AromaticContact CE2-CE2 3.78Å; Y134-F174 HydrophobicContact CE2-CE2 3.78Å; Y134-F174 HydrophobicContact CE2-CZ 4.48Å; T138-F174 WeakPolarHBondContact OG1-CE2 3.47Å; Y141-F174 HydrophobicContact CD1-CB 4.35Å; Y141-F174 AromaticContact CD1-CD1 3.57Å; Y141-F174 HydrophobicContact CD1-CD1 3.57Å; Y141-F174 HydrophobicContact CD1-CE1 4.12Å; Y141-F174 AromaticContact CD1-CG 3.96Å; Y141-F174 HydrophobicContact CD1-CG 3.96Å; Y141-F174 AromaticContact CE1-CD1 3.98Å; Y141-F174 HydrophobicContact CE1-CD1 3.98Å; Y141-F174 HydrophobicContact CE1-CE1 4.31Å; Y141-F174 HydrophobicContact CG-CB 4.15Å; Y141-F174 HydrophobicContact CG-CD1 4.21Å; Y141-F174 HydrophobicContact CG-CG 4.26Å; M170-F174 WeakPolarHBondContact O-CB 3.25Å; M170-F174 PolarHBondContact O-N 3.15Å; R171-F174 PolarHBondContact O-N 3.47Å; Q172-F174 PolarHBondContact O-N 3.42Å; F174-S178 VanDerWaalsContact O-CB 3.28Å; F174-S178 WeakPolarHBondContact O-CB 3.34Å; F174-S178 PolarHBondContact O-N 2.96Å
175	Q	96.3	Very high	96.3	Very high	27 Å²	27	54.6 Å²	54.6	13%	0.126	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-41.4	178.7	-74.3	168.9	-16.1	0	0	111.8	Y12 R171 Q172 H173 S178 L179	Y12-Q175 HydrophobicContact CD1-CB 4.26Å; Y12-Q175 VanDerWaalsContact CD1-CD 3.47Å; Y12-Q175 HydrophobicContact CD1-CG 4.01Å; Y12-Q175 HydrophobicContact CE1-CB 4.16Å; Y12-Q175 HydrophobicContact CE1-CG 4.41Å; R171-Q175 WeakPolarHBondContact O-CB 3.46Å; R171-Q175 VanDerWaalsContact O-CG 3.24Å; R171-Q175 WeakPolarHBondContact O-CG 3.31Å; R171-Q175 PolarHBondContact O-N 2.96Å; Q172-Q175 PolarHBondContact O-N 3.3Å; Q172-Q175 VanDerWaalsContact O-N 3.12Å; H173-Q175 VanDerWaalsContact C-N 3.35Å; H173-Q175 PolarHBondContact O-N 3.23Å; Q175-S178 WeakPolarHBondContact O-CB 3.47Å; Q175-S178 PolarHBondContact O-N 3.38Å; Q175-L179 VanDerWaalsContact O-CG 3.28Å; Q175-L179 WeakPolarHBondContact O-CG 3.46Å; Q175-L179 PolarHBondContact O-N 2.91Å
176	E	96.4	Very high	96.2	Very high	115 Å²	115	54 Å²	54	54%	0.537	26%	0.259	S	S	.	.	H	α-helix	trans	-58.7	-53.9	173.2	-71.2	171.1	166.4	0	0	111.5	Q172 H173 S178 L179 E180	Q172-E176 WeakPolarHBondContact O-CG 3.27Å; Q172-E176 PolarHBondContact O-N 3.44Å; H173-E176 PolarHBondContact O-N 3.1Å; E176-S178 VanDerWaalsContact C-N 3.26Å; E176-S178 PolarHBondContact O-N 3.49Å; E176-L179 WeakPolarHBondContact O-CB 3.38Å; E176-L179 PolarHBondContact O-N 3.01Å; E176-L179 VanDerWaalsContact O-N 3.08Å; E176-E180 PolarHBondContact O-N 2.9Å
177	E	97.1	Very high	96.2	Very high	35 Å²	35	51.7 Å²	51.7	16%	0.164	25%	0.248	C	C	.	.	H	α-helix	trans	-62.7	-31.9	178.1	-69.3	-92.5	164	0	0	112.2	E137 H173 Y181	E137-E177 HydrophobicContact CG-CG 4.15Å; H173-E177 IonicContact CE1-OE1 2.66Å; H173-E177 PolarHBondContact CE1-OE1 3.39Å; H173-E177 WeakPolarHBondContact O-CG 3.37Å; H173-E177 PolarHBondContact O-N 3.29Å; E177-Y181 VanDerWaalsContact O-CB 3.3Å; E177-Y181 WeakPolarHBondContact O-CB 3.36Å; E177-Y181 PolarHBondContact O-N 3.32Å
178	S	97.4	Very high	96.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-42.4	172.6	-170.1	0	0	0	0	112.2	Y134 F174 Q175 E176 V182	Y134-S178 WeakPolarHBondContact CE2-OG 3.46Å; F174-S178 VanDerWaalsContact O-CB 3.28Å; F174-S178 WeakPolarHBondContact O-CB 3.34Å; F174-S178 PolarHBondContact O-N 2.96Å; Q175-S178 WeakPolarHBondContact O-CB 3.47Å; Q175-S178 PolarHBondContact O-N 3.38Å; E176-S178 VanDerWaalsContact C-N 3.26Å; E176-S178 PolarHBondContact O-N 3.49Å; S178-V182 VanDerWaalsContact O-CB 3.26Å; S178-V182 WeakPolarHBondContact O-CB 3.36Å; S178-V182 WeakPolarHBondContact O-CG2 3.46Å; S178-V182 PolarHBondContact O-N 3.18Å
179	L	97.6	Very high	96	Very high	40 Å²	40	49 Å²	49	21%	0.209	24%	0.235	C	C	.	.	H	α-helix	trans	-65.5	-45.4	177.4	-69.7	165.2	0	0	0	111	F8 C11 Y12 Q175 E176 V182 C183	F8-L179 HydrophobicContact CB-CD2 3.66Å; F8-L179 HydrophobicContact CD1-CD2 3.72Å; F8-L179 HydrophobicContact CG-CD2 4.03Å; C11-L179 HydrophobicContact CB-CD2 3.91Å; C11-L179 HydrophobicContact CB-CG 4.2Å; Y12-L179 HydrophobicContact CE2-CD1 4.26Å; Y12-L179 HydrophobicContact CE2-CD2 4.34Å; Q175-L179 VanDerWaalsContact O-CG 3.28Å; Q175-L179 WeakPolarHBondContact O-CG 3.46Å; Q175-L179 PolarHBondContact O-N 2.91Å; E176-L179 WeakPolarHBondContact O-CB 3.38Å; E176-L179 PolarHBondContact O-N 3.01Å; E176-L179 VanDerWaalsContact O-N 3.08Å; L179-V182 PolarHBondContact O-N 3.49Å; L179-C183 VanDerWaalsContact O-CB 3.29Å; L179-C183 WeakPolarHBondContact O-CB 3.39Å; L179-C183 PolarHBondContact O-N 3.36Å
180	E	96.6	Very high	95.8	Very high	124 Å²	124	48.4 Å²	48.4	58%	0.579	23%	0.229	S	C	*	.	H	α-helix	trans	-61.5	-46.6	176.8	-69.9	-166.3	-178.3	0	0	111.9	E176 V182 C183 K184	E176-E180 PolarHBondContact O-N 2.9Å; E180-V182 PolarHBondContact O-N 2.72Å; E180-C183 WeakPolarHBondContact O-CB 3.42Å; E180-C183 PolarHBondContact O-N 3.12Å; E180-K184 WeakPolarHBondContact O-CB 2.96Å; E180-K184 PolarHBondContact O-N 3.24Å
181	Y	97.7	Very high	95.8	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-42	178.9	-179.5	-128.2	0	0	0	112.6	I22 E26 E130 R131 Y134 E177 K184 L185	I22-Y181 HydrophobicContact CG2-CE1 4.09Å; E26-Y181 PolarHBondContact OE1-OH 2.89Å; E26-Y181 VanDerWaalsContact OE1-OH 3.05Å; E130-Y181 HydrophobicContact CB-CD2 3.62Å; E130-Y181 HydrophobicContact CB-CE2 4.14Å; R131-Y181 HydrophobicContact CB-CE2 3.84Å; R131-Y181 WeakPolarHBondContact CB-OH 3.21Å; Y134-Y181 AromaticContact CD1-CD1 3.24Å; Y134-Y181 HydrophobicContact CD1-CD1 3.24Å; Y134-Y181 AromaticContact CD1-CE1 3.48Å; Y134-Y181 HydrophobicContact CD1-CE1 3.48Å; Y134-Y181 VanDerWaalsContact CD1-CE1 3.48Å; Y134-Y181 HydrophobicContact CD1-CG 4.18Å; Y134-Y181 HydrophobicContact CD2-CD1 4.15Å; Y134-Y181 AromaticContact CE1-CD1 3.69Å; Y134-Y181 HydrophobicContact CE1-CD1 3.69Å; Y134-Y181 AromaticContact CE1-CE1 3.89Å; Y134-Y181 HydrophobicContact CE1-CE1 3.89Å; Y134-Y181 AromaticContact CG-CD1 3.46Å; Y134-Y181 HydrophobicContact CG-CD1 3.46Å; Y134-Y181 VanDerWaalsContact CG-CD1 3.46Å; Y134-Y181 HydrophobicContact CG-CE1 4.14Å; Y134-Y181 AromaticContact CG-CG 4Å; Y134-Y181 HydrophobicContact CG-CG 4Å; E177-Y181 VanDerWaalsContact O-CB 3.3Å; E177-Y181 WeakPolarHBondContact O-CB 3.36Å; E177-Y181 PolarHBondContact O-N 3.32Å; Y181-K184 PolarHBondContact O-N 2.79Å; Y181-L185 HydrophobicContact CD1-CD1 4.1Å; Y181-L185 HydrophobicContact CD2-CG 4.35Å; Y181-L185 HydrophobicContact CE1-CD1 3.59Å; Y181-L185 HydrophobicContact CE1-CG 4.25Å; Y181-L185 HydrophobicContact CE2-CD1 4.16Å; Y181-L185 HydrophobicContact CE2-CD2 4.22Å; Y181-L185 HydrophobicContact CE2-CG 3.88Å; Y181-L185 PolarHBondContact O-N 2.87Å
182	V	97.2	Very high	95.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-68.8	-36.8	178.8	166.8	0	0	0	0	111.8	L6 F8 F18 I22 S178 L179 E180 Q186	L6-V182 HydrophobicContact CB-CG1 3.57Å; L6-V182 HydrophobicContact CD1-CG1 4.1Å; L6-V182 HydrophobicContact CD1-CG2 4.46Å; L6-V182 HydrophobicContact CG-CG1 4.48Å; F8-V182 HydrophobicContact CD1-CG1 4.1Å; F8-V182 HydrophobicContact CE1-CG1 4.05Å; F18-V182 HydrophobicContact CZ-CG2 3.75Å; I22-V182 HydrophobicContact CD1-CG2 4.13Å; S178-V182 VanDerWaalsContact O-CB 3.26Å; S178-V182 WeakPolarHBondContact O-CB 3.36Å; S178-V182 WeakPolarHBondContact O-CG2 3.46Å; S178-V182 PolarHBondContact O-N 3.18Å; L179-V182 PolarHBondContact O-N 3.49Å; E180-V182 PolarHBondContact O-N 2.72Å; V182-Q186 WeakPolarHBondContact O-CG 3.46Å; V182-Q186 PolarHBondContact O-N 3.3Å; V182-Q186 PolarHBondContact O-NE2 3.15Å
183	C	95.9	Very high	95.5	Very high	63 Å²	63	47.6 Å²	47.6	43%	0.426	22%	0.223	S	C	.	.	H	α-helix	trans	-60.7	-48.3	170	-173.6	0	0	0	0	110.5	F8 L179 E180 L185 Q186 E187	F8-C183 HydrophobicContact CE1-CB 3.97Å; F8-C183 HydrophobicContact CZ-CB 4.11Å; L179-C183 VanDerWaalsContact O-CB 3.29Å; L179-C183 WeakPolarHBondContact O-CB 3.39Å; L179-C183 PolarHBondContact O-N 3.36Å; E180-C183 WeakPolarHBondContact O-CB 3.42Å; E180-C183 PolarHBondContact O-N 3.12Å; C183-L185 PolarHBondContact O-N 3.08Å; C183-Q186 PolarHBondContact O-N 2.81Å; C183-E187 WeakPolarHBondContact O-CB 3.39Å; C183-E187 PolarHBondContact O-N 3Å
184	K	95.8	Very high	95.4	Very high	46 Å²	46	48.6 Å²	48.6	20%	0.2	23%	0.227	C	C	.	.	H	α-helix	trans	-62.9	-39.2	179.5	-162.4	77.3	-158.4	164.9	0	113	V127 E130 E180 Y181 E187 I188	V127-K184 HydrophobicContact CG2-CG 4.03Å; E130-K184 HydrophobicContact CG-CB 4.38Å; E130-K184 HydrophobicContact CG-CG 3.99Å; E180-K184 WeakPolarHBondContact O-CB 2.96Å; E180-K184 PolarHBondContact O-N 3.24Å; Y181-K184 PolarHBondContact O-N 2.79Å; K184-E187 WeakPolarHBondContact CD-OE2 3.4Å; K184-E187 VanDerWaalsContact CE-OE2 3.32Å; K184-E187 WeakPolarHBondContact CE-OE2 3.36Å; K184-E187 IonicContact NZ-OE1 3.22Å; K184-E187 IonicContact NZ-OE2 3.36Å; K184-E187 PolarHBondContact NZ-OE2 2.83Å; K184-E187 PolarHBondContact O-N 2.99Å; K184-I188 WeakPolarHBondContact O-CG2 3.49Å; K184-I188 PolarHBondContact O-N 2.97Å
185	L	96.1	Very high	95.3	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-44.1	175.1	-83.7	175.6	0	0	0	111.8	L6 I22 L29 V127 Y181 C183 I188 Q189	L6-L185 HydrophobicContact CD1-CB 4.38Å; L6-L185 HydrophobicContact CD1-CD1 4.12Å; I22-L185 HydrophobicContact CG2-CD1 4.02Å; L29-L185 HydrophobicContact CD1-CD2 3.71Å; V127-L185 HydrophobicContact CG1-CD2 4.12Å; Y181-L185 HydrophobicContact CD1-CD1 4.1Å; Y181-L185 HydrophobicContact CD2-CG 4.35Å; Y181-L185 HydrophobicContact CE1-CD1 3.59Å; Y181-L185 HydrophobicContact CE1-CG 4.25Å; Y181-L185 HydrophobicContact CE2-CD1 4.16Å; Y181-L185 HydrophobicContact CE2-CD2 4.22Å; Y181-L185 HydrophobicContact CE2-CG 3.88Å; Y181-L185 PolarHBondContact O-N 2.87Å; C183-L185 PolarHBondContact O-N 3.08Å; L185-I188 WeakPolarHBondContact O-CG2 3.27Å; L185-Q189 WeakPolarHBondContact O-CG 3.45Å; L185-Q189 PolarHBondContact O-N 3.29Å
186	Q	94	Very high	95.1	Very high	60 Å²	60	50 Å²	50	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-69.2	-42	177.4	-68.6	-178.3	79	0	0	111.7	L6 V182 C183 I188 Q189 E190	L6-Q186 PolarHBondContact O-NE2 2.82Å; V182-Q186 WeakPolarHBondContact O-CG 3.46Å; V182-Q186 PolarHBondContact O-N 3.3Å; V182-Q186 PolarHBondContact O-NE2 3.15Å; C183-Q186 PolarHBondContact O-N 2.81Å; Q186-I188 VanDerWaalsContact C-N 3.35Å; Q186-I188 PolarHBondContact O-N 3.16Å; Q186-Q189 WeakPolarHBondContact O-CB 3.43Å; Q186-Q189 PolarHBondContact O-N 3.22Å; Q186-E190 PolarHBondContact O-N 3.01Å; Q186-E190 VanDerWaalsContact O-N 3.17Å
187	E	94.1	Very high	95	Very high	64 Å²	64	48.7 Å²	48.7	30%	0.299	24%	0.235	S	C	.	.	H	α-helix	trans	-57	-45.3	177	-168.2	-161.6	167	0	0	112.1	C183 K184 E190 R191	C183-E187 WeakPolarHBondContact O-CB 3.39Å; C183-E187 PolarHBondContact O-N 3Å; K184-E187 WeakPolarHBondContact CD-OE2 3.4Å; K184-E187 VanDerWaalsContact CE-OE2 3.32Å; K184-E187 WeakPolarHBondContact CE-OE2 3.36Å; K184-E187 IonicContact NZ-OE1 3.22Å; K184-E187 IonicContact NZ-OE2 3.36Å; K184-E187 PolarHBondContact NZ-OE2 2.83Å; K184-E187 PolarHBondContact O-N 2.99Å; E187-E190 PolarHBondContact O-N 3.21Å; E187-R191 HydrophobicContact CG-CG 4.49Å; E187-R191 WeakPolarHBondContact O-CB 3.46Å; E187-R191 WeakPolarHBondContact O-CG 3.41Å; E187-R191 PolarHBondContact O-N 3.35Å; E187-R191 IonicContact OE1-CZ 3.14Å; E187-R191 IonicContact OE1-NE 3.22Å; E187-R191 PolarHBondContact OE1-NE 2.85Å; E187-R191 IonicContact OE1-NH2 3.81Å; E187-R191 PolarHBondContact OE1-NH2 3.15Å
188	I	95.4	Very high	94.9	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-71.4	-30.6	-179.9	-168.7	59	0	0	0	113	L29 F119 Q123 L124 V127 K184 L185 Q186 E190 R191 K192	L29-I188 HydrophobicContact CD1-CG2 3.51Å; L29-I188 HydrophobicContact CD2-CG1 4.19Å; L29-I188 HydrophobicContact CD2-CG2 3.89Å; L29-I188 HydrophobicContact CG-CG2 4.36Å; F119-I188 HydrophobicContact CE2-CD1 3.58Å; F119-I188 HydrophobicContact CZ-CD1 3.48Å; F119-I188 VanDerWaalsContact CZ-CD1 3.48Å; F119-I188 HydrophobicContact CZ-CG1 4.33Å; Q123-I188 HydrophobicContact CB-CD1 3.61Å; L124-I188 HydrophobicContact CD2-CD1 4.2Å; L124-I188 HydrophobicContact CD2-CG1 3.85Å; V127-I188 HydrophobicContact CG1-CG2 4.47Å; V127-I188 HydrophobicContact CG2-CB 3.96Å; V127-I188 HydrophobicContact CG2-CG1 4.11Å; V127-I188 HydrophobicContact CG2-CG2 3.88Å; K184-I188 WeakPolarHBondContact O-CG2 3.49Å; K184-I188 PolarHBondContact O-N 2.97Å; L185-I188 WeakPolarHBondContact O-CG2 3.27Å; Q186-I188 VanDerWaalsContact C-N 3.35Å; Q186-I188 PolarHBondContact O-N 3.16Å; I188-E190 VanDerWaalsContact C-N 3.27Å; I188-E190 PolarHBondContact O-N 2.83Å; I188-R191 HydrophobicContact CD1-CB 4.29Å; I188-K192 PolarHBondContact O-N 2.6Å; I188-K192 VanDerWaalsContact O-N 3.12Å
189	Q	92.1	Very high	94.8	Very high	16 Å²	16	53.2 Å²	53.2	8%	0.075	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-30.2	175	-74.8	-69.9	-10.7	0	0	112.3	Q25 E28 L185 Q186 K192	Q25-Q189 PolarHBondContact O-NE2 3.02Å; E28-Q189 PolarHBondContact OE2-NE2 3.47Å; E28-Q189 PolarHBondContact OE2-OE1 3.37Å; L185-Q189 WeakPolarHBondContact O-CG 3.45Å; L185-Q189 PolarHBondContact O-N 3.29Å; Q186-Q189 WeakPolarHBondContact O-CB 3.43Å; Q186-Q189 PolarHBondContact O-N 3.22Å; Q189-K192 WeakPolarHBondContact O-CE 3.23Å; Q189-K192 WeakPolarHBondContact O-CG 3.29Å; Q189-K192 VanDerWaalsContact OE1-CE 3.29Å
190	E	92	Very high	94.7	Very high	103 Å²	103	53.5 Å²	53.5	48%	0.481	26%	0.258	S	S	.	.	H	α-helix	trans	-82.6	-48.8	171	-65.5	-54.4	126.3	0	0	112.2	Q186 E187 I188 K192 K193	Q186-E190 PolarHBondContact O-N 3.01Å; Q186-E190 VanDerWaalsContact O-N 3.17Å; E187-E190 PolarHBondContact O-N 3.21Å; I188-E190 VanDerWaalsContact C-N 3.27Å; I188-E190 PolarHBondContact O-N 2.83Å; E190-K192 VanDerWaalsContact C-N 3.28Å; E190-K192 PolarHBondContact O-N 3.03Å; E190-K193 VanDerWaalsContact O-CB 3.28Å; E190-K193 WeakPolarHBondContact O-CB 3.49Å; E190-K193 WeakPolarHBondContact O-CG 3.42Å; E190-K193 PolarHBondContact O-N 2.74Å; E190-K193 WeakPolarHBondContact OE1-CE 3.36Å; E190-K193 IonicContact OE1-NZ 2.72Å; E190-K193 PolarHBondContact OE1-NZ 3.13Å; E190-K193 WeakPolarHBondContact OE2-CE 3.28Å; E190-K193 IonicContact OE2-NZ 2.65Å; E190-K193 PolarHBondContact OE2-NZ 3.02Å
191	R	94.7	Very high	94.7	Very high	73 Å²	73	53.7 Å²	53.7	28%	0.275	26%	0.262	S	S	.	.	H	α-helix	trans	-51.7	-42.5	180	-79.5	177.4	176.9	-89.2	0.4	113.7	F119 E187 I188 K193 F194 E195	F119-R191 HydrophobicContact CE2-CB 4.31Å; E187-R191 HydrophobicContact CG-CG 4.49Å; E187-R191 WeakPolarHBondContact O-CB 3.46Å; E187-R191 WeakPolarHBondContact O-CG 3.41Å; E187-R191 PolarHBondContact O-N 3.35Å; E187-R191 IonicContact OE1-CZ 3.14Å; E187-R191 IonicContact OE1-NE 3.22Å; E187-R191 PolarHBondContact OE1-NE 2.85Å; E187-R191 IonicContact OE1-NH2 3.81Å; E187-R191 PolarHBondContact OE1-NH2 3.15Å; I188-R191 HydrophobicContact CD1-CB 4.29Å; R191-K193 PolarHBondContact O-N 2.86Å; R191-F194 HydrophobicContact CB-CZ 4.3Å; R191-F194 HydrophobicContact CG-CZ 4Å; R191-F194 PolarHBondContact O-N 3.15Å; R191-E195 VanDerWaalsContact CD-OE1 3.3Å; R191-E195 WeakPolarHBondContact CD-OE1 3.39Å; R191-E195 WeakPolarHBondContact CG-OE1 3.07Å; R191-E195 IonicContact CZ-OE1 2.95Å; R191-E195 IonicContact NE-OE1 2.8Å; R191-E195 IonicContact NH1-OE1 3.48Å; R191-E195 PolarHBondContact NH1-OE1 3.12Å; R191-E195 WeakPolarHBondContact O-CB 3.28Å; R191-E195 PolarHBondContact O-N 3.4Å
192	K	93.1	Very high	94.6	Very high	37 Å²	37	55 Å²	55	16%	0.161	27%	0.274	C	S	.	.	H	α-helix	trans	-57.5	-26	-179.3	78.9	-173.7	-175.3	179.1	0	113	E28 F119 I188 Q189 E190 F194 C196	E28-K192 IonicContact OE1-NZ 2.92Å; E28-K192 PolarHBondContact OE1-NZ 3.36Å; E28-K192 IonicContact OE2-NZ 2.7Å; E28-K192 PolarHBondContact OE2-NZ 3.38Å; F119-K192 HydrophobicContact CE1-CB 4.31Å; F119-K192 HydrophobicContact CE2-CB 4.38Å; F119-K192 HydrophobicContact CZ-CB 3.63Å; I188-K192 PolarHBondContact O-N 2.6Å; I188-K192 VanDerWaalsContact O-N 3.12Å; Q189-K192 WeakPolarHBondContact O-CE 3.23Å; Q189-K192 WeakPolarHBondContact O-CG 3.29Å; Q189-K192 VanDerWaalsContact OE1-CE 3.29Å; E190-K192 VanDerWaalsContact C-N 3.28Å; E190-K192 PolarHBondContact O-N 3.03Å; K192-F194 VanDerWaalsContact C-N 3.3Å; K192-F194 PolarHBondContact O-N 2.88Å; K192-C196 VanDerWaalsContact O-CB 3.25Å; K192-C196 WeakPolarHBondContact O-CB 3.24Å; K192-C196 PolarHBondContact O-N 3.33Å
193	K	91.8	Very high	94.5	Very high	114 Å²	114	56.8 Å²	56.8	50%	0.496	28%	0.281	S	S	.	.	H	α-helix	trans	-68.1	-29.5	-177	-60.1	178.3	-172.6	170.9	0	112.5	E190 R191 V197	E190-K193 VanDerWaalsContact O-CB 3.28Å; E190-K193 WeakPolarHBondContact O-CB 3.49Å; E190-K193 WeakPolarHBondContact O-CG 3.42Å; E190-K193 PolarHBondContact O-N 2.74Å; E190-K193 WeakPolarHBondContact OE1-CE 3.36Å; E190-K193 IonicContact OE1-NZ 2.72Å; E190-K193 PolarHBondContact OE1-NZ 3.13Å; E190-K193 WeakPolarHBondContact OE2-CE 3.28Å; E190-K193 IonicContact OE2-NZ 2.65Å; E190-K193 PolarHBondContact OE2-NZ 3.02Å; R191-K193 PolarHBondContact O-N 2.86Å; K193-V197 WeakPolarHBondContact O-CB 3.39Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å
194	F	94.5	Very high	94.5	Very high	95 Å²	95	58.9 Å²	58.9	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-110.1	-48.3	177.3	56.4	-90.6	0	0	0	112	R191 K192 C196 V197 E198	R191-F194 HydrophobicContact CB-CZ 4.3Å; R191-F194 HydrophobicContact CG-CZ 4Å; R191-F194 PolarHBondContact O-N 3.15Å; K192-F194 VanDerWaalsContact C-N 3.3Å; K192-F194 PolarHBondContact O-N 2.88Å; F194-C196 PolarHBondContact O-N 3.19Å; F194-V197 PolarHBondContact O-N 3.36Å; F194-E198 HydrophobicContact CB-CG 4.46Å; F194-E198 WeakPolarHBondContact O-CG 3.41Å; F194-E198 PolarHBondContact O-N 3.27Å
195	E	94.7	Very high	94.6	Very high	42 Å²	42	61 Å²	61	20%	0.196	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-18.3	-178.6	-66.1	-167.8	-133.9	0	0	113.8	F119 R191 P199	F119-E195 HydrophobicContact CD2-CB 3.55Å; F119-E195 HydrophobicContact CD2-CG 4.32Å; F119-E195 WeakPolarHBondContact CD2-OE2 3.36Å; F119-E195 HydrophobicContact CE2-CB 3.91Å; F119-E195 HydrophobicContact CG-CB 4.44Å; R191-E195 VanDerWaalsContact CD-OE1 3.3Å; R191-E195 WeakPolarHBondContact CD-OE1 3.39Å; R191-E195 WeakPolarHBondContact CG-OE1 3.07Å; R191-E195 IonicContact CZ-OE1 2.95Å; R191-E195 IonicContact NE-OE1 2.8Å; R191-E195 IonicContact NH1-OE1 3.48Å; R191-E195 PolarHBondContact NH1-OE1 3.12Å; R191-E195 WeakPolarHBondContact O-CB 3.28Å; R191-E195 PolarHBondContact O-N 3.4Å; E195-P199 WeakPolarHBondContact O-CG 3.5Å
196	C	92.6	Very high	94.6	Very high	19 Å²	19	61.8 Å²	61.8	13%	0.128	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-19.3	171.7	-60.9	0	0	0	0	114.7	I36 F119 K192 F194 M200	I36-C196 VanDerWaalsContact CD1-SG 3.58Å; F119-C196 VanDerWaalsContact CD1-SG 3.54Å; F119-C196 WeakPolarHBondContact CE1-SG 3.5Å; K192-C196 VanDerWaalsContact O-CB 3.25Å; K192-C196 WeakPolarHBondContact O-CB 3.24Å; K192-C196 PolarHBondContact O-N 3.33Å; F194-C196 PolarHBondContact O-N 3.19Å; C196-M200 WeakPolarHBondContact O-CG 3.22Å
197	V	93.7	Very high	94.8	Very high	87 Å²	87	60.1 Å²	60.1	53%	0.527	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-37.8	-174.1	178.6	0	0	0	0	111.9	K193 F194 M200 L201	K193-V197 WeakPolarHBondContact O-CB 3.39Å; K193-V197 WeakPolarHBondContact O-CG2 3.4Å; F194-V197 PolarHBondContact O-N 3.36Å; V197-M200 WeakPolarHBondContact O-CA 3.23Å; V197-M200 WeakPolarHBondContact O-CB 3.44Å; V197-M200 PolarHBondContact O-N 2.56Å; V197-L201 PolarHBondContact O-N 3.41Å
198	E	95.8	Very high	94.9	Very high	121 Å²	121	63 Å²	63	57%	0.565	31%	0.305	S	S	*	.	H	α-helix	trans	-56.3	-41.9	173.8	-65.5	170.5	172.1	0	0	112.6	F194 M200 L201 A202	F194-E198 HydrophobicContact CB-CG 4.46Å; F194-E198 WeakPolarHBondContact O-CG 3.41Å; F194-E198 PolarHBondContact O-N 3.27Å; E198-M200 VanDerWaalsContact C-N 3.28Å; E198-M200 PolarHBondContact O-N 3.2Å; E198-L201 PolarHBondContact O-N 2.95Å; E198-A202 WeakPolarHBondContact O-CB 3.3Å; E198-A202 PolarHBondContact O-N 3.5Å
199	P	96.4	Very high	95	Very high	8 Å²	8	66.6 Å²	66.6	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-59.4	-34.2	172.4	-26.8	37.8	0	0	0	113.9	T111 L112 P115 E195 F203	T111-P199 WeakPolarHBondContact O-CA 3.47Å; T111-P199 WeakPolarHBondContact O-CB 3.49Å; L112-P199 HydrophobicContact CD1-CB 3.97Å; L112-P199 WeakPolarHBondContact CD1-O 3.45Å; P115-P199 HydrophobicContact CB-CB 4.29Å; P115-P199 HydrophobicContact CB-CG 3.69Å; P115-P199 HydrophobicContact CG-CG 4.48Å; E195-P199 WeakPolarHBondContact O-CG 3.5Å; P199-F203 WeakPolarHBondContact O-CB 3.27Å; P199-F203 PolarHBondContact O-N 3.33Å
200	M	94.4	Very high	95.3	Very high	47 Å²	47	66.7 Å²	66.7	23%	0.232	33%	0.327	C	S	.	.	H	α-helix	trans	-69.9	-43.5	176.9	-57.6	-63.1	144.5	0	0	111.1	L39 L112 L116 C196 V197 E198 A202 F203 F204	L39-M200 HydrophobicContact CD2-CE 3.39Å; L39-M200 HydrophobicContact CD2-SD 4.12Å; L39-M200 HydrophobicContact CG-CE 4.29Å; L112-M200 HydrophobicContact CD1-CE 3.57Å; L112-M200 HydrophobicContact CD1-SD 3.78Å; L116-M200 HydrophobicContact CD1-CE 3.7Å; L116-M200 HydrophobicContact CD2-CE 3.76Å; L116-M200 HydrophobicContact CG-CE 4.21Å; C196-M200 WeakPolarHBondContact O-CG 3.22Å; V197-M200 WeakPolarHBondContact O-CA 3.23Å; V197-M200 WeakPolarHBondContact O-CB 3.44Å; V197-M200 PolarHBondContact O-N 2.56Å; E198-M200 VanDerWaalsContact C-N 3.28Å; E198-M200 PolarHBondContact O-N 3.2Å; M200-A202 VanDerWaalsContact C-N 3.34Å; M200-F203 WeakPolarHBondContact O-CB 3.42Å; M200-F203 PolarHBondContact O-N 3.02Å; M200-F204 WeakPolarHBondContact O-CD2 3.48Å; M200-F204 PolarHBondContact O-N 3.07Å
201	L	95.8	Very high	95.6	Very high	127 Å²	127	69.3 Å²	69.3	67%	0.665	33%	0.334	S	S	*	.	H	α-helix	trans	-61.5	-44.8	176.3	-177.5	61.7	0	0	0	110.9	V197 E198 F203 F204 Q205	V197-L201 PolarHBondContact O-N 3.41Å; E198-L201 PolarHBondContact O-N 2.95Å; L201-F203 VanDerWaalsContact C-N 3.33Å; L201-F203 PolarHBondContact O-N 3.06Å; L201-F204 PolarHBondContact O-N 3.42Å; L201-Q205 WeakPolarHBondContact O-CB 3.36Å; L201-Q205 PolarHBondContact O-N 3Å
202	A	95.9	Very high	95.7	Very high	33 Å²	33	71.2 Å²	71.2	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-64.2	-35	176.3	0	0	0	0	0	112.8	T111 E198 M200 T206	T111-A202 HydrophobicContact CG2-CB 4.47Å; E198-A202 WeakPolarHBondContact O-CB 3.3Å; E198-A202 PolarHBondContact O-N 3.5Å; M200-A202 VanDerWaalsContact C-N 3.34Å; A202-T206 WeakPolarHBondContact O-CB 3.16Å; A202-T206 PolarHBondContact O-N 3.06Å; A202-T206 PolarHBondContact O-OG1 3.36Å
203	F	95.8	Very high	95.9	Very high	36 Å²	36	72.7 Å²	72.7	16%	0.158	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-53.2	171.2	166.1	-97.8	0	0	0	111.7	L46 I108 L112 P199 M200 L201 Q205 T206 V207	L46-F203 HydrophobicContact CD2-CE2 4.1Å; L46-F203 HydrophobicContact CD2-CZ 4.08Å; I108-F203 HydrophobicContact CD1-CD2 4.12Å; I108-F203 HydrophobicContact CD1-CE2 3.91Å; I108-F203 HydrophobicContact CG1-CD2 3.88Å; I108-F203 HydrophobicContact CG1-CE2 4.2Å; I108-F203 HydrophobicContact CG2-CD2 3.93Å; I108-F203 HydrophobicContact CG2-CE2 4.25Å; L112-F203 HydrophobicContact CB-CB 4.29Å; L112-F203 HydrophobicContact CD1-CB 4.21Å; L112-F203 HydrophobicContact CD2-CB 4.12Å; L112-F203 HydrophobicContact CD2-CD2 3.71Å; L112-F203 HydrophobicContact CD2-CE2 4.37Å; L112-F203 HydrophobicContact CD2-CG 4Å; L112-F203 HydrophobicContact CG-CB 4.44Å; P199-F203 WeakPolarHBondContact O-CB 3.27Å; P199-F203 PolarHBondContact O-N 3.33Å; M200-F203 WeakPolarHBondContact O-CB 3.42Å; M200-F203 PolarHBondContact O-N 3.02Å; L201-F203 VanDerWaalsContact C-N 3.33Å; L201-F203 PolarHBondContact O-N 3.06Å; F203-Q205 VanDerWaalsContact C-N 3.34Å; F203-Q205 PolarHBondContact O-N 3.42Å; F203-T206 WeakPolarHBondContact O-CB 3.33Å; F203-T206 PolarHBondContact O-N 3.46Å; F203-T206 VanDerWaalsContact O-N 3.12Å; F203-V207 HydrophobicContact CD2-CG2 4.32Å; F203-V207 HydrophobicContact CE1-CG2 4.25Å; F203-V207 HydrophobicContact CE2-CG2 3.9Å; F203-V207 HydrophobicContact CZ-CG2 3.86Å; F203-V207 WeakPolarHBondContact O-CG2 3.28Å; F203-V207 PolarHBondContact O-N 3.48Å
204	F	96.2	Very high	96.2	Very high	107 Å²	107	68 Å²	68	47%	0.469	34%	0.337	S	S	.	.	H	α-helix	trans	-60.8	-42.9	179.5	-78.1	-68.3	0	0	0	111.9	M200 L201 T206 V207 F208	M200-F204 WeakPolarHBondContact O-CD2 3.48Å; M200-F204 PolarHBondContact O-N 3.07Å; L201-F204 PolarHBondContact O-N 3.42Å; F204-T206 VanDerWaalsContact C-N 3.29Å; F204-T206 PolarHBondContact O-N 3.26Å; F204-V207 PolarHBondContact O-N 3Å; F204-F208 HydrophobicContact CB-CE2 4.05Å; F204-F208 HydrophobicContact CB-CZ 4.3Å; F204-F208 HydrophobicContact CD1-CZ 4.28Å; F204-F208 VanDerWaalsContact O-CD2 3.29Å; F204-F208 WeakPolarHBondContact O-CD2 3.45Å; F204-F208 VanDerWaalsContact O-CG 3.23Å; F204-F208 WeakPolarHBondContact O-CG 3.38Å; F204-F208 PolarHBondContact O-N 3.22Å
205	Q	96.8	Very high	96.3	Very high	90 Å²	90	70.4 Å²	70.4	42%	0.421	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-38.8	175	-174.8	59.8	26.2	0	0	112.7	L201 F203 T209	L201-Q205 WeakPolarHBondContact O-CB 3.36Å; L201-Q205 PolarHBondContact O-N 3Å; F203-Q205 VanDerWaalsContact C-N 3.34Å; F203-Q205 PolarHBondContact O-N 3.42Å; Q205-T209 WeakPolarHBondContact O-CB 3.45Å; Q205-T209 PolarHBondContact O-N 3.41Å; Q205-T209 PolarHBondContact O-OG1 3.11Å
206	T	97.5	Very high	96.5	Very high	18 Å²	18	70.8 Å²	70.8	11%	0.11	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-42.5	176.3	-60.5	0	0	0	0	111.4	M104 N107 I108 A202 F203 F204 T209 F210	M104-T206 HydrophobicContact CG-CG2 3.94Å; N107-T206 HydrophobicContact CB-CG2 3.52Å; I108-T206 HydrophobicContact CG1-CG2 3.89Å; A202-T206 WeakPolarHBondContact O-CB 3.16Å; A202-T206 PolarHBondContact O-N 3.06Å; A202-T206 PolarHBondContact O-OG1 3.36Å; F203-T206 WeakPolarHBondContact O-CB 3.33Å; F203-T206 PolarHBondContact O-N 3.46Å; F203-T206 VanDerWaalsContact O-N 3.12Å; F204-T206 VanDerWaalsContact C-N 3.29Å; F204-T206 PolarHBondContact O-N 3.26Å; T206-T209 PolarHBondContact O-N 3.42Å; T206-F210 PolarHBondContact O-N 3.04Å; T206-F210 VanDerWaalsContact O-N 3.15Å
207	V	96.4	Very high	96.7	Very high	25 Å²	25	70.9 Å²	70.9	15%	0.152	35%	0.345	C	S	.	.	H	α-helix	trans	-66.4	-43.7	177.3	171.7	0	0	0	0	111.5	I108 F203 F204 F210 Y211	I108-V207 HydrophobicContact CD1-CG2 4.38Å; F203-V207 HydrophobicContact CD2-CG2 4.32Å; F203-V207 HydrophobicContact CE1-CG2 4.25Å; F203-V207 HydrophobicContact CE2-CG2 3.9Å; F203-V207 HydrophobicContact CZ-CG2 3.86Å; F203-V207 WeakPolarHBondContact O-CG2 3.28Å; F203-V207 PolarHBondContact O-N 3.48Å; F204-V207 PolarHBondContact O-N 3Å; V207-F210 PolarHBondContact O-N 3.36Å; V207-Y211 HydrophobicContact CG1-CD2 3.8Å; V207-Y211 HydrophobicContact CG1-CE2 3.52Å; V207-Y211 VanDerWaalsContact O-CD2 3.27Å; V207-Y211 WeakPolarHBondContact O-CD2 3.22Å; V207-Y211 PolarHBondContact O-N 2.98Å; V207-Y211 VanDerWaalsContact O-N 3.12Å
208	F	97.9	Very high	96.8	Very high	123 Å²	123	69 Å²	69	54%	0.539	34%	0.339	S	S	.	.	H	α-helix	trans	-64.6	-39.9	176.8	-60.6	-30.6	0	0	0	112.3	F204 F210 Y211 H212	F204-F208 HydrophobicContact CB-CE2 4.05Å; F204-F208 HydrophobicContact CB-CZ 4.3Å; F204-F208 HydrophobicContact CD1-CZ 4.28Å; F204-F208 VanDerWaalsContact O-CD2 3.29Å; F204-F208 WeakPolarHBondContact O-CD2 3.45Å; F204-F208 VanDerWaalsContact O-CG 3.23Å; F204-F208 WeakPolarHBondContact O-CG 3.38Å; F204-F208 PolarHBondContact O-N 3.22Å; F208-F210 VanDerWaalsContact C-N 3.32Å; F208-F210 PolarHBondContact O-N 3.32Å; F208-Y211 PolarHBondContact O-N 3.47Å; F208-H212 WeakPolarHBondContact O-CB 3.27Å; F208-H212 PolarHBondContact O-N 2.92Å
209	T	97.6	Very high	96.8	Very high	77 Å²	77	68.2 Å²	68.2	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-58.1	-42.9	173.1	-57.8	0	0	0	0	111.6	Q205 T206 H212 Q213	Q205-T209 WeakPolarHBondContact O-CB 3.45Å; Q205-T209 PolarHBondContact O-N 3.41Å; Q205-T209 PolarHBondContact O-OG1 3.11Å; T206-T209 PolarHBondContact O-N 3.42Å; T209-H212 PolarHBondContact O-N 3.28Å; T209-Q213 WeakPolarHBondContact O-CB 3.24Å; T209-Q213 PolarHBondContact O-N 3.47Å
210	F	97.6	Very high	96.7	Very high	18 Å²	18	71.6 Å²	71.6	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-62.2	-48.1	176.7	168.8	-103.7	0	0	0	112.5	L97 Q100 R101 M104 T206 V207 F208 H212 Q213 G214	L97-F210 HydrophobicContact CD1-CE2 4.33Å; L97-F210 HydrophobicContact CD1-CZ 4.36Å; Q100-F210 HydrophobicContact CB-CD2 4.17Å; Q100-F210 HydrophobicContact CB-CE2 4.27Å; R101-F210 HydrophobicContact CB-CE2 3.78Å; R101-F210 HydrophobicContact CB-CZ 4.21Å; R101-F210 HydrophobicContact CG-CE2 4.34Å; R101-F210 HydrophobicContact CG-CZ 4.39Å; M104-F210 HydrophobicContact CB-CB 4.01Å; M104-F210 HydrophobicContact CB-CD2 4.25Å; M104-F210 HydrophobicContact CB-CG 4.23Å; M104-F210 HydrophobicContact CG-CB 3.81Å; M104-F210 HydrophobicContact CG-CG 4.22Å; M104-F210 HydrophobicContact SD-CB 3.54Å; M104-F210 VanDerWaalsContact SD-CB 3.54Å; M104-F210 HydrophobicContact SD-CD1 3.61Å; M104-F210 HydrophobicContact SD-CD2 4.27Å; M104-F210 HydrophobicContact SD-CE1 4.43Å; M104-F210 HydrophobicContact SD-CG 3.51Å; M104-F210 VanDerWaalsContact SD-CG 3.51Å; T206-F210 PolarHBondContact O-N 3.04Å; T206-F210 VanDerWaalsContact O-N 3.15Å; V207-F210 PolarHBondContact O-N 3.36Å; F208-F210 VanDerWaalsContact C-N 3.32Å; F208-F210 PolarHBondContact O-N 3.32Å; F210-H212 PolarHBondContact O-N 2.97Å; F210-Q213 PolarHBondContact O-N 3.49Å; F210-G214 PolarHBondContact O-N 2.95Å
211	Y	97.8	Very high	96.8	Very high	159 Å²	159	71 Å²	71	62%	0.624	35%	0.347	S	S	*	.	H	α-helix	trans	-63.3	-41.1	178.5	-76.7	-63.8	0	0	0	112.5	V207 F208 G214 Y215	V207-Y211 HydrophobicContact CG1-CD2 3.8Å; V207-Y211 HydrophobicContact CG1-CE2 3.52Å; V207-Y211 VanDerWaalsContact O-CD2 3.27Å; V207-Y211 WeakPolarHBondContact O-CD2 3.22Å; V207-Y211 PolarHBondContact O-N 2.98Å; V207-Y211 VanDerWaalsContact O-N 3.12Å; F208-Y211 PolarHBondContact O-N 3.47Å; Y211-G214 PolarHBondContact O-N 3.33Å; Y211-Y215 PolarHBondContact O-N 3.23Å
212	H	97.8	Very high	96.6	Very high	113 Å²	113	68.4 Å²	68.4	52%	0.523	33%	0.334	S	S	.	.	H	α-helix	trans	-61.7	-43.8	174.9	178	54.7	0	0	0	112	F208 T209 F210 G214 Y215 E216	F208-H212 WeakPolarHBondContact O-CB 3.27Å; F208-H212 PolarHBondContact O-N 2.92Å; T209-H212 PolarHBondContact O-N 3.28Å; F210-H212 PolarHBondContact O-N 2.97Å; H212-G214 VanDerWaalsContact C-N 3.34Å; H212-G214 PolarHBondContact O-N 3.42Å; H212-Y215 WeakPolarHBondContact O-CB 3.27Å; H212-Y215 PolarHBondContact O-N 3.3Å; H212-E216 PolarHBondContact O-N 3.42Å
213	Q	97.4	Very high	96.5	Very high	68 Å²	68	73.7 Å²	73.7	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-66.5	-35.2	177.8	-174.7	57.7	67.3	0	0	112.5	Q100 T209 F210 L217	Q100-Q213 HydrophobicContact CB-CG 4.32Å; Q100-Q213 HydrophobicContact CG-CG 3.68Å; T209-Q213 WeakPolarHBondContact O-CB 3.24Å; T209-Q213 PolarHBondContact O-N 3.47Å; F210-Q213 PolarHBondContact O-N 3.49Å; Q213-L217 WeakPolarHBondContact O-CG 3.25Å; Q213-L217 PolarHBondContact O-N 2.88Å
214	G	97.3	Very high	96.4	Very high	16 Å²	16	74 Å²	74	17%	0.165	35%	0.353	C	S	.	.	H	α-helix	trans	-64	-39.8	171.6	0	0	0	0	0	112.8	F210 Y211 H212 A218	F210-G214 PolarHBondContact O-N 2.95Å; Y211-G214 PolarHBondContact O-N 3.33Å; H212-G214 VanDerWaalsContact C-N 3.34Å; H212-G214 PolarHBondContact O-N 3.42Å; G214-A218 WeakPolarHBondContact O-CB 3.26Å; G214-A218 PolarHBondContact O-N 3.27Å
215	Y	97.6	Very high	96.3	Very high	144 Å²	144	73.2 Å²	73.2	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-64.1	-48.1	174.3	170.9	-96	0	0	0	112.4	Y211 H212 L217 A218 K219	Y211-Y215 PolarHBondContact O-N 3.23Å; H212-Y215 WeakPolarHBondContact O-CB 3.27Å; H212-Y215 PolarHBondContact O-N 3.3Å; Y215-L217 VanDerWaalsContact C-N 3.32Å; Y215-L217 PolarHBondContact O-N 2.81Å; Y215-A218 PolarHBondContact O-N 2.88Å; Y215-K219 HydrophobicContact CE1-CD 3.93Å; Y215-K219 VanDerWaalsContact O-CB 3.32Å; Y215-K219 WeakPolarHBondContact O-CB 3.48Å; Y215-K219 PolarHBondContact O-N 2.78Å
216	E	97.7	Very high	96.1	Very high	51 Å²	51	71.8 Å²	71.8	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-64.3	-36.9	178.6	-70.7	-64.7	123.5	0	0	111.8	H212 K219 D220	H212-E216 PolarHBondContact O-N 3.42Å; E216-K219 VanDerWaalsContact CD-NZ 3.29Å; E216-K219 PolarHBondContact O-N 2.85Å; E216-K219 IonicContact OE1-NZ 3.22Å; E216-K219 PolarHBondContact OE1-NZ 3.32Å; E216-K219 IonicContact OE2-NZ 2.66Å; E216-K219 PolarHBondContact OE2-NZ 3.48Å; E216-D220 WeakPolarHBondContact O-CB 3.42Å; E216-D220 PolarHBondContact O-N 2.95Å
217	L	96.8	Very high	95.9	Very high	20 Å²	20	75.2 Å²	75.2	11%	0.105	36%	0.362	C	S	.	.	H	α-helix	trans	-59.5	-47.8	170.7	-75.6	172.3	0	0	0	112.1	F93 N96 Q100 Q213 Y215 K219 D220 F221	F93-L217 HydrophobicContact CE2-CB 4.12Å; N96-L217 HydrophobicContact CB-CD2 4.42Å; Q100-L217 HydrophobicContact CG-CD1 4.15Å; Q213-L217 WeakPolarHBondContact O-CG 3.25Å; Q213-L217 PolarHBondContact O-N 2.88Å; Y215-L217 VanDerWaalsContact C-N 3.32Å; Y215-L217 PolarHBondContact O-N 2.81Å; L217-K219 VanDerWaalsContact C-N 3.33Å; L217-K219 PolarHBondContact O-N 3.05Å; L217-D220 PolarHBondContact O-N 3.38Å; L217-F221 WeakPolarHBondContact O-CB 3.31Å; L217-F221 PolarHBondContact O-N 2.96Å; L217-F221 VanDerWaalsContact O-N 3.14Å
218	A	95.8	Very high	95.8	Very high	47 Å²	47	74.3 Å²	74.3	39%	0.388	36%	0.357	S	S	.	.	H	α-helix	trans	-63.6	-39.2	-179.8	0	0	0	0	0	112.4	F93 G214 Y215 F221 D222	F93-A218 HydrophobicContact CZ-CB 4.33Å; G214-A218 WeakPolarHBondContact O-CB 3.26Å; G214-A218 PolarHBondContact O-N 3.27Å; Y215-A218 PolarHBondContact O-N 2.88Å; A218-F221 WeakPolarHBondContact O-CB 3.45Å; A218-F221 PolarHBondContact O-N 3.18Å; A218-D222 PolarHBondContact O-N 3.43Å
219	K	96.2	Very high	95.6	Very high	106 Å²	106	73.8 Å²	73.8	46%	0.461	36%	0.356	S	S	.	.	H	α-helix	trans	-66.6	-42	176.2	175	-173.6	167.3	-155.1	0	112.6	Y215 E216 L217 F221 D222	Y215-K219 HydrophobicContact CE1-CD 3.93Å; Y215-K219 VanDerWaalsContact O-CB 3.32Å; Y215-K219 WeakPolarHBondContact O-CB 3.48Å; Y215-K219 PolarHBondContact O-N 2.78Å; E216-K219 VanDerWaalsContact CD-NZ 3.29Å; E216-K219 PolarHBondContact O-N 2.85Å; E216-K219 IonicContact OE1-NZ 3.22Å; E216-K219 PolarHBondContact OE1-NZ 3.32Å; E216-K219 IonicContact OE2-NZ 2.66Å; E216-K219 PolarHBondContact OE2-NZ 3.48Å; L217-K219 VanDerWaalsContact C-N 3.33Å; L217-K219 PolarHBondContact O-N 3.05Å; K219-F221 PolarHBondContact O-N 3.49Å; K219-D222 PolarHBondContact O-N 2.95Å
220	D	94.6	Very high	95.3	Very high	78 Å²	78	74.4 Å²	74.4	42%	0.417	36%	0.355	S	S	.	.	H	α-helix	trans	-62	-30.6	172.7	-77.5	-49.1	0	0	0	112.2	E216 L217 R601	E216-D220 WeakPolarHBondContact O-CB 3.42Å; E216-D220 PolarHBondContact O-N 2.95Å; L217-D220 PolarHBondContact O-N 3.38Å; D220-R601 IonicContact OD1-CZ 3.48Å; D220-R601 IonicContact OD1-NH2 3.39Å; D220-R601 PolarHBondContact OD1-NH2 3.08Å; D220-R601 IonicContact OD2-CZ 2.73Å; D220-R601 IonicContact OD2-NH1 2.65Å; D220-R601 PolarHBondContact OD2-NH1 3.03Å; D220-R601 IonicContact OD2-NH2 2.66Å; D220-R601 PolarHBondContact OD2-NH2 3.24Å
221	F	95.8	Very high	95.1	Very high	34 Å²	34	74.5 Å²	74.5	15%	0.149	36%	0.356	C	S	.	.	H	α-helix	trans	-80.7	-16.7	-179.4	-168.1	-104.2	0	0	0	114.1	F90 F93 L217 A218 K219 H223 Y224 K225	F90-F221 AromaticContact CD1-CE1 3.92Å; F90-F221 HydrophobicContact CD1-CE1 3.92Å; F90-F221 AromaticContact CD1-CZ 3.5Å; F90-F221 HydrophobicContact CD1-CZ 3.5Å; F90-F221 VanDerWaalsContact CD1-CZ 3.5Å; F90-F221 AromaticContact CE1-CE1 3.79Å; F90-F221 HydrophobicContact CE1-CE1 3.79Å; F90-F221 AromaticContact CE1-CZ 3.62Å; F90-F221 HydrophobicContact CE1-CZ 3.62Å; F93-F221 HydrophobicContact CB-CD2 4.24Å; F93-F221 HydrophobicContact CB-CE2 4.14Å; F93-F221 HydrophobicContact CD2-CB 3.84Å; F93-F221 HydrophobicContact CD2-CD1 4.33Å; F93-F221 AromaticContact CD2-CD2 3.83Å; F93-F221 HydrophobicContact CD2-CD2 3.83Å; F93-F221 AromaticContact CD2-CG 3.74Å; F93-F221 HydrophobicContact CD2-CG 3.74Å; F93-F221 HydrophobicContact CE2-CB 3.87Å; F93-F221 HydrophobicContact CE2-CG 4.15Å; F93-F221 HydrophobicContact CG-CD2 4.3Å; F93-F221 HydrophobicContact CG-CG 4.38Å; L217-F221 WeakPolarHBondContact O-CB 3.31Å; L217-F221 PolarHBondContact O-N 2.96Å; L217-F221 VanDerWaalsContact O-N 3.14Å; A218-F221 WeakPolarHBondContact O-CB 3.45Å; A218-F221 PolarHBondContact O-N 3.18Å; K219-F221 PolarHBondContact O-N 3.49Å; F221-H223 PolarHBondContact O-N 2.87Å; F221-Y224 HydrophobicContact CD2-CD1 4.29Å; F221-Y224 HydrophobicContact CE1-CD1 4.24Å; F221-Y224 AromaticContact CE2-CD1 3.52Å; F221-Y224 HydrophobicContact CE2-CD1 3.52Å; F221-Y224 HydrophobicContact CE2-CE1 4.14Å; F221-Y224 HydrophobicContact CE2-CG 4.35Å; F221-Y224 AromaticContact CZ-CD1 3.49Å; F221-Y224 HydrophobicContact CZ-CD1 3.49Å; F221-Y224 VanDerWaalsContact CZ-CD1 3.49Å; F221-Y224 AromaticContact CZ-CE1 3.9Å; F221-Y224 HydrophobicContact CZ-CE1 3.9Å; F221-Y224 PolarHBondContact O-N 2.85Å; F221-K225 HydrophobicContact CD1-CB 4.34Å; F221-K225 HydrophobicContact CE1-CB 4.31Å; F221-K225 PolarHBondContact O-N 2.87Å
222	D	92.9	Very high	94.9	Very high	74 Å²	74	70.1 Å²	70.1	40%	0.396	34%	0.343	S	S	.	.	H	α-helix	trans	-68	-30.5	-170.5	-164.9	63.4	0	0	0	113.9	A218 K219 K225 T226	A218-D222 PolarHBondContact O-N 3.43Å; K219-D222 PolarHBondContact O-N 2.95Å; D222-K225 PolarHBondContact O-N 3.25Å; D222-K225 IonicContact OD1-NZ 3.71Å; D222-K225 PolarHBondContact OD1-NZ 2.73Å; D222-T226 WeakPolarHBondContact O-CB 3.41Å; D222-T226 PolarHBondContact O-N 3.36Å; D222-T226 PolarHBondContact O-OG1 3.48Å
223	H	92.6	Very high	94.5	Very high	143 Å²	143	69.2 Å²	69.2	66%	0.662	34%	0.339	S	S	*	.	H	α-helix	trans	-61.2	-49.9	171.6	-176.8	-63.9	0	0	0	111.2	F221 K225 T226 E227	F221-H223 PolarHBondContact O-N 2.87Å; H223-K225 VanDerWaalsContact C-N 3.35Å; H223-K225 PolarHBondContact O-N 3.43Å; H223-T226 PolarHBondContact O-N 3.06Å; H223-E227 IonicContact CE1-OE2 3.83Å; H223-E227 PolarHBondContact CE1-OE2 2.94Å; H223-E227 IonicContact ND1-OE2 2.84Å; H223-E227 PolarHBondContact ND1-OE2 2.81Å; H223-E227 WeakPolarHBondContact O-CB 3.32Å; H223-E227 PolarHBondContact O-N 2.9Å
224	Y	95.3	Very high	94.1	Very high	42 Å²	42	67.3 Å²	67.3	17%	0.165	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-43.9	179.4	173.7	-95.6	0	0	0	111.2	S86 E89 F221 T226 E227 L228	S86-Y224 WeakPolarHBondContact CA-OH 3.41Å; S86-Y224 VanDerWaalsContact CB-OH 3.23Å; S86-Y224 WeakPolarHBondContact CB-OH 3.32Å; E89-Y224 HydrophobicContact CB-CD1 4.44Å; E89-Y224 HydrophobicContact CB-CE1 3.75Å; E89-Y224 HydrophobicContact CB-CE2 4.44Å; E89-Y224 HydrophobicContact CG-CE1 4.26Å; E89-Y224 HydrophobicContact CG-CE2 4.03Å; F221-Y224 HydrophobicContact CD2-CD1 4.29Å; F221-Y224 HydrophobicContact CE1-CD1 4.24Å; F221-Y224 AromaticContact CE2-CD1 3.52Å; F221-Y224 HydrophobicContact CE2-CD1 3.52Å; F221-Y224 HydrophobicContact CE2-CE1 4.14Å; F221-Y224 HydrophobicContact CE2-CG 4.35Å; F221-Y224 AromaticContact CZ-CD1 3.49Å; F221-Y224 HydrophobicContact CZ-CD1 3.49Å; F221-Y224 VanDerWaalsContact CZ-CD1 3.49Å; F221-Y224 AromaticContact CZ-CE1 3.9Å; F221-Y224 HydrophobicContact CZ-CE1 3.9Å; F221-Y224 PolarHBondContact O-N 2.85Å; Y224-T226 VanDerWaalsContact C-N 3.33Å; Y224-T226 PolarHBondContact O-N 3.42Å; Y224-E227 PolarHBondContact O-N 2.95Å; Y224-L228 HydrophobicContact CE1-CB 4.38Å; Y224-L228 HydrophobicContact CE1-CD2 3.92Å; Y224-L228 VanDerWaalsContact O-CB 3.3Å; Y224-L228 WeakPolarHBondContact O-CB 3.28Å; Y224-L228 PolarHBondContact O-N 3.28Å
225	K	92.8	Very high	93.9	Very high	91 Å²	91	68.3 Å²	68.3	40%	0.396	33%	0.334	S	S	.	.	H	α-helix	trans	-57.1	-44.4	174.5	174.9	-171.2	159	-150.4	0	112.1	F221 D222 H223 Q229	F221-K225 HydrophobicContact CD1-CB 4.34Å; F221-K225 HydrophobicContact CE1-CB 4.31Å; F221-K225 PolarHBondContact O-N 2.87Å; D222-K225 PolarHBondContact O-N 3.25Å; D222-K225 IonicContact OD1-NZ 3.71Å; D222-K225 PolarHBondContact OD1-NZ 2.73Å; H223-K225 VanDerWaalsContact C-N 3.35Å; H223-K225 PolarHBondContact O-N 3.43Å; K225-Q229 VanDerWaalsContact O-CG 3.31Å; K225-Q229 WeakPolarHBondContact O-CG 3.38Å; K225-Q229 PolarHBondContact O-N 2.93Å
226	T	93.3	Very high	93.6	Very high	61 Å²	61	67.5 Å²	67.5	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-66.1	-43.7	179.5	-58.3	0	0	0	0	111.5	D222 H223 Y224 Q229 I230	D222-T226 WeakPolarHBondContact O-CB 3.41Å; D222-T226 PolarHBondContact O-N 3.36Å; D222-T226 PolarHBondContact O-OG1 3.48Å; H223-T226 PolarHBondContact O-N 3.06Å; Y224-T226 VanDerWaalsContact C-N 3.33Å; Y224-T226 PolarHBondContact O-N 3.42Å; T226-Q229 PolarHBondContact O-N 3.26Å; T226-I230 HydrophobicContact CG2-CD1 4.47Å; T226-I230 WeakPolarHBondContact O-CG1 3.2Å; T226-I230 PolarHBondContact O-N 3.45Å; T226-I230 VanDerWaalsContact O-N 3.16Å
227	E	92.2	Very high	93.1	Very high	89 Å²	89	66.1 Å²	66.1	42%	0.416	33%	0.326	S	S	.	.	H	α-helix	trans	-62.3	-46.5	175.9	-173.4	173.6	175.2	0	0	111.7	H223 Y224 Q229 I230 N231	H223-E227 IonicContact CE1-OE2 3.83Å; H223-E227 PolarHBondContact CE1-OE2 2.94Å; H223-E227 IonicContact ND1-OE2 2.84Å; H223-E227 PolarHBondContact ND1-OE2 2.81Å; H223-E227 WeakPolarHBondContact O-CB 3.32Å; H223-E227 PolarHBondContact O-N 2.9Å; Y224-E227 PolarHBondContact O-N 2.95Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 3.43Å; E227-I230 WeakPolarHBondContact O-CB 3.41Å; E227-I230 PolarHBondContact O-N 2.94Å; E227-I230 VanDerWaalsContact O-N 3.14Å; E227-N231 VanDerWaalsContact O-CG 3.25Å; E227-N231 PolarHBondContact O-N 3.27Å; E227-N231 PolarHBondContact O-OD1 3.47Å
228	L	95.3	Very high	92.6	Very high	7 Å²	7	65.9 Å²	65.9	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-39.6	175.5	179.2	62.9	0	0	0	112.3	I83 F90 Y224 I230 N231 I232	I83-L228 HydrophobicContact CG1-CD1 4.06Å; F90-L228 HydrophobicContact CE1-CD2 4.34Å; F90-L228 HydrophobicContact CE2-CD2 4.13Å; F90-L228 HydrophobicContact CZ-CD2 3.54Å; Y224-L228 HydrophobicContact CE1-CB 4.38Å; Y224-L228 HydrophobicContact CE1-CD2 3.92Å; Y224-L228 VanDerWaalsContact O-CB 3.3Å; Y224-L228 WeakPolarHBondContact O-CB 3.28Å; Y224-L228 PolarHBondContact O-N 3.28Å; L228-I230 VanDerWaalsContact C-N 3.33Å; L228-I230 PolarHBondContact O-N 3.3Å; L228-N231 PolarHBondContact O-N 3.25Å; L228-I232 HydrophobicContact CD1-CD1 4.13Å; L228-I232 HydrophobicContact CD1-CG1 4.27Å; L228-I232 HydrophobicContact CG-CD1 3.92Å; L228-I232 HydrophobicContact CG-CG1 4.48Å; L228-I232 WeakPolarHBondContact O-CB 3.5Å; L228-I232 VanDerWaalsContact O-CG1 3.25Å; L228-I232 WeakPolarHBondContact O-CG1 3.35Å; L228-I232 PolarHBondContact O-N 3.44Å
229	Q	94.3	Very high	92.4	Very high	112 Å²	112	69.6 Å²	69.6	52%	0.523	33%	0.331	S	S	.	.	H	α-helix	trans	-61.1	-40.1	174.8	-78.6	177.3	-26.6	0	0	112.3	K225 T226 E227 Q233	K225-Q229 VanDerWaalsContact O-CG 3.31Å; K225-Q229 WeakPolarHBondContact O-CG 3.38Å; K225-Q229 PolarHBondContact O-N 2.93Å; T226-Q229 PolarHBondContact O-N 3.26Å; E227-Q229 VanDerWaalsContact C-N 3.34Å; E227-Q229 PolarHBondContact O-N 3.43Å; Q229-Q233 WeakPolarHBondContact O-CB 3.33Å; Q229-Q233 PolarHBondContact O-N 3.24Å; Q229-Q233 VanDerWaalsContact O-N 3.09Å
230	I	90.1	Very high	92	Very high	90 Å²	90	69.3 Å²	69.3	46%	0.462	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-47.6	174.6	-66.9	163.7	0	0	0	110.1	T226 E227 L228 I232 Q233 N234	T226-I230 HydrophobicContact CG2-CD1 4.47Å; T226-I230 WeakPolarHBondContact O-CG1 3.2Å; T226-I230 PolarHBondContact O-N 3.45Å; T226-I230 VanDerWaalsContact O-N 3.16Å; E227-I230 WeakPolarHBondContact O-CB 3.41Å; E227-I230 PolarHBondContact O-N 2.94Å; E227-I230 VanDerWaalsContact O-N 3.14Å; L228-I230 VanDerWaalsContact C-N 3.33Å; L228-I230 PolarHBondContact O-N 3.3Å; I230-I232 VanDerWaalsContact C-N 3.34Å; I230-I232 PolarHBondContact O-N 2.91Å; I230-Q233 PolarHBondContact O-N 3.18Å; I230-Q233 VanDerWaalsContact O-N 3.08Å; I230-N234 PolarHBondContact O-N 3.02Å
231	N	92.9	Very high	91.6	Very high	19 Å²	19	66.8 Å²	66.8	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-64.4	-37.5	-177.9	-63.4	-7.9	0	0	0	112.1	D79 C82 E227 L228 T235	D79-N231 HydrophobicContact CB-CB 4.09Å; D79-N231 PolarHBondContact OD1-OD1 2.97Å; C82-N231 PolarHBondContact SG-ND2 3.34Å; E227-N231 VanDerWaalsContact O-CG 3.25Å; E227-N231 PolarHBondContact O-N 3.27Å; E227-N231 PolarHBondContact O-OD1 3.47Å; L228-N231 PolarHBondContact O-N 3.25Å; N231-T235 WeakPolarHBondContact O-CB 3.32Å; N231-T235 PolarHBondContact O-N 3.14Å; N231-T235 PolarHBondContact O-OG1 3.06Å
232	I	93.8	Very high	91.2	Very high	67 Å²	67	66.7 Å²	66.7	34%	0.344	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-45	171.1	-71.3	167.2	0	0	0	111	I83 L228 I230 T235 R236	I83-I232 HydrophobicContact CD1-CG1 4.01Å; I83-I232 HydrophobicContact CG1-CG1 3.93Å; L228-I232 HydrophobicContact CD1-CD1 4.13Å; L228-I232 HydrophobicContact CD1-CG1 4.27Å; L228-I232 HydrophobicContact CG-CD1 3.92Å; L228-I232 HydrophobicContact CG-CG1 4.48Å; L228-I232 WeakPolarHBondContact O-CB 3.5Å; L228-I232 VanDerWaalsContact O-CG1 3.25Å; L228-I232 WeakPolarHBondContact O-CG1 3.35Å; L228-I232 PolarHBondContact O-N 3.44Å; I230-I232 VanDerWaalsContact C-N 3.34Å; I230-I232 PolarHBondContact O-N 2.91Å; I232-T235 PolarHBondContact O-N 3.26Å; I232-R236 WeakPolarHBondContact O-CB 3.09Å; I232-R236 PolarHBondContact O-N 2.99Å
233	Q	90.3	Very high	91	Very high	95 Å²	95	69.3 Å²	69.3	44%	0.444	33%	0.331	S	S	.	.	H	α-helix	trans	-70.1	-37.2	-179	-174.6	56.6	31.4	0	0	112.4	Q229 I230 R236 S237	Q229-Q233 WeakPolarHBondContact O-CB 3.33Å; Q229-Q233 PolarHBondContact O-N 3.24Å; Q229-Q233 VanDerWaalsContact O-N 3.09Å; I230-Q233 PolarHBondContact O-N 3.18Å; I230-Q233 VanDerWaalsContact O-N 3.08Å; Q233-R236 PolarHBondContact O-N 2.89Å; Q233-S237 WeakPolarHBondContact O-CB 3.47Å; Q233-S237 PolarHBondContact O-N 3.33Å
234	N	89.6	Confident	90.8	Very high	27 Å²	27	65.7 Å²	65.7	14%	0.144	32%	0.322	C	S	.	.	H	α-helix	trans	-60.7	-47.8	171	-70.9	-14	0	0	0	110.8	D79 I230 R236 S237 R238	D79-N234 WeakPolarHBondContact OD2-CB 3.41Å; I230-N234 PolarHBondContact O-N 3.02Å; N234-R236 VanDerWaalsContact C-N 3.34Å; N234-R236 PolarHBondContact O-N 2.89Å; N234-S237 WeakPolarHBondContact O-CB 3.46Å; N234-S237 PolarHBondContact O-N 2.87Å; N234-R238 WeakPolarHBondContact O-CG 3.46Å; N234-R238 PolarHBondContact O-N 2.81Å
235	T	91.2	Very high	90.3	Very high	37 Å²	37	66.6 Å²	66.6	23%	0.227	33%	0.327	C	S	.	.	H	α-helix	trans	-61.6	-40.7	178.3	-59	0	0	0	0	111.8	I83 N231 I232 R238 F239	I83-T235 HydrophobicContact CD1-CG2 4.14Å; I83-T235 WeakPolarHBondContact CD1-OG1 3.38Å; N231-T235 WeakPolarHBondContact O-CB 3.32Å; N231-T235 PolarHBondContact O-N 3.14Å; N231-T235 PolarHBondContact O-OG1 3.06Å; I232-T235 PolarHBondContact O-N 3.26Å; T235-R238 PolarHBondContact O-N 3.4Å; T235-F239 WeakPolarHBondContact O-CB 3.43Å; T235-F239 PolarHBondContact O-N 3.42Å
236	R	91.4	Very high	90.1	Very high	127 Å²	127	64.9 Å²	64.9	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-47.3	172.8	-178.4	-177.7	-69.3	145	-7.6	112.1	I232 Q233 N234 R238 F239 E240	I232-R236 WeakPolarHBondContact O-CB 3.09Å; I232-R236 PolarHBondContact O-N 2.99Å; Q233-R236 PolarHBondContact O-N 2.89Å; N234-R236 VanDerWaalsContact C-N 3.34Å; N234-R236 PolarHBondContact O-N 2.89Å; R236-R238 PolarHBondContact O-N 3.44Å; R236-F239 PolarHBondContact O-N 3.21Å; R236-E240 WeakPolarHBondContact O-CG 3.49Å; R236-E240 PolarHBondContact O-N 2.93Å
237	S	87.3	Confident	89.9	Confident	22 Å²	22	66.9 Å²	66.9	15%	0.154	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-45.7	177.6	-170.4	0	0	0	0	111.7	Q233 N234 E240 G241 N532	Q233-S237 WeakPolarHBondContact O-CB 3.47Å; Q233-S237 PolarHBondContact O-N 3.33Å; N234-S237 WeakPolarHBondContact O-CB 3.46Å; N234-S237 PolarHBondContact O-N 2.87Å; S237-E240 PolarHBondContact O-N 2.78Å; S237-G241 PolarHBondContact O-N 3.35Å; S237-G241 VanDerWaalsContact O-N 3.16Å; S237-N532 PolarHBondContact OG-OD1 3.46Å
238	R	87.8	Confident	89.6	Confident	15 Å²	15	66.6 Å²	66.6	6%	0.057	33%	0.328	C	S	.	.	H	α-helix	trans	-62.2	-43.4	174.3	-68.3	-179.2	-175.4	139.5	5.5	111.9	D79 N234 T235 R236 E240 G241 T242 V535 E563	D79-R238 IonicContact OD2-CZ 2.73Å; D79-R238 IonicContact OD2-NH1 2.7Å; D79-R238 PolarHBondContact OD2-NH1 2.96Å; D79-R238 IonicContact OD2-NH2 3.15Å; D79-R238 PolarHBondContact OD2-NH2 2.65Å; N234-R238 WeakPolarHBondContact O-CG 3.46Å; N234-R238 PolarHBondContact O-N 2.81Å; T235-R238 PolarHBondContact O-N 3.4Å; R236-R238 PolarHBondContact O-N 3.44Å; R238-E240 PolarHBondContact O-N 2.85Å; R238-G241 PolarHBondContact O-N 2.72Å; R238-T242 PolarHBondContact O-N 2.85Å; R238-T242 PolarHBondContact O-OG1 3.02Å; R238-V535 HydrophobicContact CB-CG2 4.44Å; R238-V535 HydrophobicContact CG-CG2 3.72Å; R238-E563 IonicContact CZ-OE1 2.67Å; R238-E563 IonicContact CZ-OE2 3.91Å; R238-E563 IonicContact NE-OE1 3.97Å; R238-E563 PolarHBondContact NE-OE1 3.49Å; R238-E563 IonicContact NH2-OE1 2.94Å; R238-E563 PolarHBondContact NH2-OE1 3.45Å; R238-E563 IonicContact NH2-OE2 3.07Å; R238-E563 PolarHBondContact NH2-OE2 3.24Å
239	F	90.2	Very high	89.2	Confident	126 Å²	126	66.6 Å²	66.6	55%	0.553	33%	0.328	S	S	*	.	H	α-helix	trans	-60.7	-43.4	175.8	167.9	-101.3	0	0	0	112.5	T235 R236 G241 T242 R243	T235-F239 WeakPolarHBondContact O-CB 3.43Å; T235-F239 PolarHBondContact O-N 3.42Å; R236-F239 PolarHBondContact O-N 3.21Å; F239-G241 PolarHBondContact O-N 3.42Å; F239-T242 PolarHBondContact O-N 2.94Å; F239-R243 HydrophobicContact CZ-CB 4.43Å; F239-R243 WeakPolarHBondContact O-CB 3.26Å; F239-R243 PolarHBondContact O-N 3.35Å
240	E	89.4	Confident	88.9	Confident	99 Å²	99	65.3 Å²	65.3	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-62.2	-41.9	178.6	-75.6	174	-159.8	0	0	112.2	R236 S237 R238 R243 S244	R236-E240 WeakPolarHBondContact O-CG 3.49Å; R236-E240 PolarHBondContact O-N 2.93Å; S237-E240 PolarHBondContact O-N 2.78Å; R238-E240 PolarHBondContact O-N 2.85Å; E240-R243 PolarHBondContact O-N 3.2Å; E240-S244 PolarHBondContact O-N 3.24Å
241	G	84.6	Confident	88.8	Confident	25 Å²	25	67.2 Å²	67.2	26%	0.258	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-55.7	172.1	0	0	0	0	0	112.3	S237 R238 F239 R243 S244 E245	S237-G241 PolarHBondContact O-N 3.35Å; S237-G241 VanDerWaalsContact O-N 3.16Å; R238-G241 PolarHBondContact O-N 2.72Å; F239-G241 PolarHBondContact O-N 3.42Å; G241-R243 VanDerWaalsContact C-N 3.27Å; G241-R243 PolarHBondContact O-N 3.07Å; G241-S244 WeakPolarHBondContact O-CB 3.47Å; G241-S244 PolarHBondContact O-N 2.81Å; G241-E245 PolarHBondContact O-N 2.91Å; G241-E245 VanDerWaalsContact O-N 3.15Å
242	T	87	Confident	88.4	Confident	33 Å²	33	70.1 Å²	70.1	20%	0.202	34%	0.337	C	S	.	.	H	α-helix	trans	-55.7	-41.8	177.6	-55.6	0	0	0	0	111.8	R238 F239 S244 E245 V246 I552	R238-T242 PolarHBondContact O-N 2.85Å; R238-T242 PolarHBondContact O-OG1 3.02Å; F239-T242 PolarHBondContact O-N 2.94Å; T242-S244 VanDerWaalsContact C-N 3.33Å; T242-S244 PolarHBondContact O-N 3.49Å; T242-E245 PolarHBondContact O-N 2.86Å; T242-V246 WeakPolarHBondContact O-CG2 3.44Å; T242-V246 PolarHBondContact O-N 3.01Å; T242-I552 HydrophobicContact CG2-CG2 3.66Å
243	R	89.9	Confident	88	Confident	128 Å²	128	70.2 Å²	70.2	48%	0.483	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-40.6	176.7	-176.9	-176.5	67.3	146.8	-2.5	111.6	F239 E240 G241 V246 H247	F239-R243 HydrophobicContact CZ-CB 4.43Å; F239-R243 WeakPolarHBondContact O-CB 3.26Å; F239-R243 PolarHBondContact O-N 3.35Å; E240-R243 PolarHBondContact O-N 3.2Å; G241-R243 VanDerWaalsContact C-N 3.27Å; G241-R243 PolarHBondContact O-N 3.07Å; R243-V246 PolarHBondContact O-N 2.97Å; R243-H247 PolarHBondContact O-N 3.47Å; R243-H247 VanDerWaalsContact O-N 3.09Å; R243-H247 PolarHBondContact O-ND1 2.86Å
244	S	88.2	Confident	87.6	Confident	68 Å²	68	72.4 Å²	72.4	48%	0.476	35%	0.346	S	S	.	.	H	α-helix	trans	-61	-48.2	176.8	-166.3	0	0	0	0	111.2	E240 G241 T242 V246 H247 E248	E240-S244 PolarHBondContact O-N 3.24Å; G241-S244 WeakPolarHBondContact O-CB 3.47Å; G241-S244 PolarHBondContact O-N 2.81Å; T242-S244 VanDerWaalsContact C-N 3.33Å; T242-S244 PolarHBondContact O-N 3.49Å; S244-V246 PolarHBondContact O-N 2.97Å; S244-H247 PolarHBondContact O-N 2.62Å; S244-H247 VanDerWaalsContact O-N 3.1Å; S244-E248 PolarHBondContact O-N 2.66Å
245	E	85.6	Confident	87.4	Confident	60 Å²	60	76.2 Å²	76.2	28%	0.28	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-40.9	178.7	-64.9	-65.9	155.4	0	0	112.3	G241 T242 H247 E248 L249 I552 L555	G241-E245 PolarHBondContact O-N 2.91Å; G241-E245 VanDerWaalsContact O-N 3.15Å; T242-E245 PolarHBondContact O-N 2.86Å; E245-H247 VanDerWaalsContact C-N 3.32Å; E245-H247 PolarHBondContact O-N 3.08Å; E245-E248 PolarHBondContact O-N 3.2Å; E245-L249 WeakPolarHBondContact O-CB 3.36Å; E245-L249 PolarHBondContact O-N 2.91Å; E245-I552 HydrophobicContact CB-CD1 4.33Å; E245-I552 HydrophobicContact CB-CG1 4.41Å; E245-I552 HydrophobicContact CB-CG2 4.32Å; E245-L555 HydrophobicContact CB-CD1 3.96Å; E245-L555 HydrophobicContact CG-CD1 3.75Å
246	V	87.8	Confident	86.9	Confident	56 Å²	56	76.9 Å²	76.9	34%	0.339	37%	0.371	S	S	.	.	H	α-helix	trans	-60.5	-40.9	172.8	174.1	0	0	0	0	111.7	T242 R243 S244 M250 I552	T242-V246 WeakPolarHBondContact O-CG2 3.44Å; T242-V246 PolarHBondContact O-N 3.01Å; R243-V246 PolarHBondContact O-N 2.97Å; S244-V246 PolarHBondContact O-N 2.97Å; V246-M250 VanDerWaalsContact O-CB 3.31Å; V246-M250 WeakPolarHBondContact O-CB 3.21Å; V246-M250 PolarHBondContact O-N 3.49Å; V246-I552 HydrophobicContact CG2-CD1 4.41Å; V246-I552 HydrophobicContact CG2-CG2 3.71Å
247	H	89.3	Confident	86.2	Confident	103 Å²	103	74.5 Å²	74.5	48%	0.477	37%	0.372	S	S	.	.	H	α-helix	trans	-70.3	-37.7	178.9	-76.8	74.6	0	0	0	112.2	R243 S244 E245 K251	R243-H247 PolarHBondContact O-N 3.47Å; R243-H247 VanDerWaalsContact O-N 3.09Å; R243-H247 PolarHBondContact O-ND1 2.86Å; S244-H247 PolarHBondContact O-N 2.62Å; S244-H247 VanDerWaalsContact O-N 3.1Å; E245-H247 VanDerWaalsContact C-N 3.32Å; E245-H247 PolarHBondContact O-N 3.08Å; H247-K251 WeakPolarHBondContact O-CB 3.49Å; H247-K251 PolarHBondContact O-N 2.86Å
248	E	86.8	Confident	85.5	Confident	82 Å²	82	79.8 Å²	79.8	38%	0.383	39%	0.394	S	S	.	.	H	α-helix	trans	-67.7	-43.3	175.8	-172.6	162.9	172.5	0	0	111.4	S244 E245 K251 R252	S244-E248 PolarHBondContact O-N 2.66Å; E245-E248 PolarHBondContact O-N 3.2Å; E248-K251 PolarHBondContact O-N 3.36Å; E248-R252 WeakPolarHBondContact O-CG 3.36Å; E248-R252 PolarHBondContact O-N 3.04Å
249	L	86.1	Confident	84.6	Confident	7 Å²	7	85.5 Å²	85.5	4%	0.037	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-47.7	172.4	-179.5	60.5	0	0	0	111.7	E245 K251 R252 I253 E547 V549 I552	E245-L249 WeakPolarHBondContact O-CB 3.36Å; E245-L249 PolarHBondContact O-N 2.91Å; L249-K251 VanDerWaalsContact C-N 3.25Å; L249-K251 PolarHBondContact O-N 2.94Å; L249-R252 PolarHBondContact O-N 3.33Å; L249-I253 HydrophobicContact CD1-CD1 3.82Å; L249-I253 HydrophobicContact CD1-CG1 4.13Å; L249-I253 HydrophobicContact CD2-CD1 4.49Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.5Å; L249-I253 PolarHBondContact O-N 3.16Å; L249-E547 HydrophobicContact CD1-CB 4.12Å; L249-E547 WeakPolarHBondContact CD1-O 3.47Å; L249-V549 HydrophobicContact CD2-CG2 4.28Å; L249-I552 HydrophobicContact CB-CD1 4.01Å; L249-I552 HydrophobicContact CD2-CD1 3.56Å; L249-I552 HydrophobicContact CG-CD1 4.42Å
250	M	87.7	Confident	83.6	Confident	85 Å²	85	83.6 Å²	83.6	42%	0.419	41%	0.411	S	S	.	.	H	α-helix	trans	-57.4	-39.9	175.8	177.2	-174	54.6	0	0	111.7	V246 K254	V246-M250 VanDerWaalsContact O-CB 3.31Å; V246-M250 WeakPolarHBondContact O-CB 3.21Å; V246-M250 PolarHBondContact O-N 3.49Å; M250-K254 HydrophobicContact CG-CD 4.26Å; M250-K254 WeakPolarHBondContact O-CG 3.44Å; M250-K254 PolarHBondContact O-N 3.38Å; M250-K254 VanDerWaalsContact O-N 3.16Å
251	K	88.9	Confident	82.6	Confident	131 Å²	131	83.1 Å²	83.1	57%	0.57	41%	0.405	S	S	*	.	H	α-helix	trans	-65.5	-49.8	177.8	-173.1	-171.2	171.4	-166.3	0	110.9	H247 E248 L249 I253 K254 D255	H247-K251 WeakPolarHBondContact O-CB 3.49Å; H247-K251 PolarHBondContact O-N 2.86Å; E248-K251 PolarHBondContact O-N 3.36Å; L249-K251 VanDerWaalsContact C-N 3.25Å; L249-K251 PolarHBondContact O-N 2.94Å; K251-I253 VanDerWaalsContact C-N 3.34Å; K251-I253 PolarHBondContact O-N 3.13Å; K251-K254 WeakPolarHBondContact O-CA 3.38Å; K251-K254 WeakPolarHBondContact O-CB 3.33Å; K251-K254 PolarHBondContact O-N 3.31Å; K251-D255 WeakPolarHBondContact CE-OD2 3.29Å; K251-D255 PolarHBondContact O-N 2.93Å
252	R	84	Confident	81.7	Confident	79 Å²	79	87.1 Å²	87.1	30%	0.298	42%	0.417	S	S	.	.	H	α-helix	trans	-58.5	-44	179.1	-69.9	-171.8	-70.4	158.6	-4.4	112.4	E248 L249 K254 D255 T256 E547	E248-R252 WeakPolarHBondContact O-CG 3.36Å; E248-R252 PolarHBondContact O-N 3.04Å; L249-R252 PolarHBondContact O-N 3.33Å; R252-K254 VanDerWaalsContact C-N 3.28Å; R252-K254 PolarHBondContact O-N 3.25Å; R252-D255 PolarHBondContact O-N 2.93Å; R252-D255 VanDerWaalsContact O-N 3.13Å; R252-T256 PolarHBondContact O-N 2.64Å; R252-T256 PolarHBondContact O-OG1 3.17Å; R252-E547 IonicContact CZ-OE1 3.23Å; R252-E547 IonicContact CZ-OE2 3.91Å; R252-E547 IonicContact NH1-OE1 2.66Å; R252-E547 PolarHBondContact NH1-OE1 3.33Å; R252-E547 IonicContact NH1-OE2 3.76Å; R252-E547 PolarHBondContact NH1-OE2 3.33Å; R252-E547 VanDerWaalsContact NH2-CD 3.29Å; R252-E547 IonicContact NH2-OE1 3.7Å; R252-E547 PolarHBondContact NH2-OE1 3.47Å; R252-E547 IonicContact NH2-OE2 3.88Å; R252-E547 PolarHBondContact NH2-OE2 3.3Å
253	I	84.1	Confident	80.4	Confident	69 Å²	69	89.3 Å²	89.3	35%	0.354	43%	0.43	S	S	.	.	H	α-helix	trans	-62.3	-33.8	175.7	-65.4	170.3	0	0	0	112.2	L249 K251 P257 Y260	L249-I253 HydrophobicContact CD1-CD1 3.82Å; L249-I253 HydrophobicContact CD1-CG1 4.13Å; L249-I253 HydrophobicContact CD2-CD1 4.49Å; L249-I253 HydrophobicContact CG-CD1 3.81Å; L249-I253 HydrophobicContact CG-CG1 4.49Å; L249-I253 WeakPolarHBondContact O-CG1 3.5Å; L249-I253 PolarHBondContact O-N 3.16Å; K251-I253 VanDerWaalsContact C-N 3.34Å; K251-I253 PolarHBondContact O-N 3.13Å; I253-P257 WeakPolarHBondContact O-CA 3.5Å; I253-Y260 HydrophobicContact CB-CD2 4.19Å; I253-Y260 HydrophobicContact CB-CE2 4.38Å; I253-Y260 HydrophobicContact CG1-CD1 3.91Å; I253-Y260 HydrophobicContact CG1-CD2 3.83Å; I253-Y260 HydrophobicContact CG1-CE1 3.94Å; I253-Y260 HydrophobicContact CG1-CE2 3.86Å; I253-Y260 HydrophobicContact CG1-CG 3.85Å; I253-Y260 HydrophobicContact CG2-CD2 4.42Å; I253-Y260 HydrophobicContact CG2-CG 4.49Å
254	K	83.1	Confident	79.4	Confident	141 Å²	141	84.5 Å²	84.5	61%	0.613	42%	0.417	S	S	*	.	H	α-helix	trans	-72.9	-34.4	174.3	-77	173.2	176.5	175.1	0	113.1	M250 K251 R252 P257	M250-K254 HydrophobicContact CG-CD 4.26Å; M250-K254 WeakPolarHBondContact O-CG 3.44Å; M250-K254 PolarHBondContact O-N 3.38Å; M250-K254 VanDerWaalsContact O-N 3.16Å; K251-K254 WeakPolarHBondContact O-CA 3.38Å; K251-K254 WeakPolarHBondContact O-CB 3.33Å; K251-K254 PolarHBondContact O-N 3.31Å; R252-K254 VanDerWaalsContact C-N 3.28Å; R252-K254 PolarHBondContact O-N 3.25Å; K254-P257 WeakPolarHBondContact O-CD 3.5Å
255	D	85.8	Confident	78.5	Confident	108 Å²	108	86.4 Å²	86.4	58%	0.578	43%	0.427	S	S	*	.	H	α-helix	trans	-77.7	-35.8	-177.7	-67.3	-17.7	0	0	0	111.6	K251 R252	K251-D255 WeakPolarHBondContact CE-OD2 3.29Å; K251-D255 PolarHBondContact O-N 2.93Å; R252-D255 PolarHBondContact O-N 2.93Å; R252-D255 VanDerWaalsContact O-N 3.13Å
256	T	81	Confident	78.2	Confident	51 Å²	51	88.4 Å²	88.4	31%	0.313	44%	0.439	S	S	.	.			trans	-126.4	58.9	177.3	62.2	0	0	0	0	115.1	R252 Q258 E259	R252-T256 PolarHBondContact O-N 2.64Å; R252-T256 PolarHBondContact O-OG1 3.17Å; T256-Q258 PolarHBondContact O-N 3.16Å; T256-E259 WeakPolarHBondContact CB-OE2 3.37Å; T256-E259 PolarHBondContact O-N 3.37Å; T256-E259 PolarHBondContact OG1-OE2 3.01Å
257	P	76.6	Confident	78.1	Confident	77 Å²	77	86.4 Å²	86.4	50%	0.5	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-9.4	-171.8	28.6	-37.6	0	0	0	115.4	I253 K254	I253-P257 WeakPolarHBondContact O-CA 3.5Å; K254-P257 WeakPolarHBondContact O-CD 3.5Å
258	Q	71.1	Confident	78	Confident	133 Å²	133	82 Å²	82	62%	0.621	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-30.1	174.6	-69.3	-177.8	-23	0	0	112.6	T256 R261	T256-Q258 PolarHBondContact O-N 3.16Å; Q258-R261 PolarHBondContact O-N 2.95Å
259	E	69.3	Low	78.2	Confident	135 Å²	135	80.6 Å²	80.6	63%	0.631	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-72.3	-43.4	-178.1	-65.1	174.2	163.7	0	0	110.4	T256 R261	T256-E259 WeakPolarHBondContact CB-OE2 3.37Å; T256-E259 PolarHBondContact O-N 3.37Å; T256-E259 PolarHBondContact OG1-OE2 3.01Å; E259-R261 PolarHBondContact O-N 3.18Å
260	Y	69.1	Low	78.3	Confident	85 Å²	85	81 Å²	81	33%	0.333	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-77.9	5.5	176.4	-58.3	-83.3	0	0	0	114.5	I253 Q262	I253-Y260 HydrophobicContact CB-CD2 4.19Å; I253-Y260 HydrophobicContact CB-CE2 4.38Å; I253-Y260 HydrophobicContact CG1-CD1 3.91Å; I253-Y260 HydrophobicContact CG1-CD2 3.83Å; I253-Y260 HydrophobicContact CG1-CE1 3.94Å; I253-Y260 HydrophobicContact CG1-CE2 3.86Å; I253-Y260 HydrophobicContact CG1-CG 3.85Å; I253-Y260 HydrophobicContact CG2-CD2 4.42Å; I253-Y260 HydrophobicContact CG2-CG 4.49Å; Y260-Q262 VanDerWaalsContact C-N 3.33Å
261	R	69.1	Low	78.4	Confident	89 Å²	89	79.9 Å²	79.9	34%	0.336	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-79.5	-14.3	175.4	-155.2	-172.3	-71.6	-177.1	7.6	112.7	Q258 E259 D359	Q258-R261 PolarHBondContact O-N 2.95Å; E259-R261 PolarHBondContact O-N 3.18Å; R261-D359 IonicContact CZ-OD1 3.65Å; R261-D359 IonicContact NH1-OD1 2.86Å; R261-D359 PolarHBondContact NH1-OD1 3.27Å
262	Q	65.7	Low	78.6	Confident	109 Å²	109	73.6 Å²	73.6	51%	0.509	37%	0.37	S	S	.	.			trans	-85	115	169.3	-63.9	-171.5	32.3	0	0	109.6	Y260 S264 F268	Y260-Q262 VanDerWaalsContact C-N 3.33Å; Q262-S264 VanDerWaalsContact C-N 3.33Å; Q262-S264 PolarHBondContact O-N 3.14Å; Q262-F268 HydrophobicContact CG-CE2 4.49Å
263	T	60.2	Low	78.9	Confident	79 Å²	79	73.7 Å²	73.7	49%	0.485	37%	0.371	S	S	.	.			trans	-73.2	-22.4	-178.9	52.4	0	0	0	0	113.8	E269	T263-E269 HydrophobicContact CG2-CB 4.19Å; T263-E269 WeakPolarHBondContact OG1-CG 3.41Å
264	S	67.7	Low	79.2	Confident	28 Å²	28	70.6 Å²	70.6	20%	0.196	36%	0.355	C	S	.	.			trans	-162.3	151.2	-176.3	-174.1	0	0	0	0	112.8	Q262 I266 S267 K295	Q262-S264 VanDerWaalsContact C-N 3.33Å; Q262-S264 PolarHBondContact O-N 3.14Å; S264-I266 VanDerWaalsContact C-N 3.3Å; S264-I266 WeakPolarHBondContact OG-CG1 3.15Å; S264-I266 PolarHBondContact OG-N 3.34Å; S264-S267 VanDerWaalsContact CB-OG 3.28Å; S264-S267 WeakPolarHBondContact CB-OG 3.34Å; S264-K295 PolarHBondContact O-NZ 2.66Å
265	P	69.2	Low	79.5	Confident	107 Å²	107	66 Å²	66	70%	0.695	34%	0.336	S	S	*	.	S	Bend	trans	-63.4	-34.6	164.6	25.6	-33.9	0	0	0	112.4	K295	P265-K295 WeakPolarHBondContact O-CD 3.31Å; P265-K295 PolarHBondContact O-NZ 3.29Å
266	I	79.9	Confident	79.5	Confident	102 Å²	102	63.7 Å²	63.7	52%	0.523	32%	0.322	S	S	.	.	S	Bend	trans	-92.4	-27.3	-173.2	56	165	0	0	0	114.6	S264 K295	S264-I266 VanDerWaalsContact C-N 3.3Å; S264-I266 WeakPolarHBondContact OG-CG1 3.15Å; S264-I266 PolarHBondContact OG-N 3.34Å; I266-K295 WeakPolarHBondContact O-CB 3.29Å; I266-K295 WeakPolarHBondContact O-CG 3.5Å; I266-K295 PolarHBondContact O-N 3.46Å
267	S	85.5	Confident	79.6	Confident	14 Å²	14	70.4 Å²	70.4	10%	0.098	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	167.5	176.7	67.6	0	0	0	0	112.5	S264 F293 K295	S264-S267 VanDerWaalsContact CB-OG 3.28Å; S264-S267 WeakPolarHBondContact CB-OG 3.34Å; S267-F293 CarbonylContact C-O 3.51Å; S267-F293 WeakPolarHBondContact CA-O 3.48Å; S267-F293 WeakPolarHBondContact CB-O 3.5Å; S267-K295 WeakPolarHBondContact O-CE 3.43Å; S267-K295 PolarHBondContact O-NZ 3.38Å; S267-K295 VanDerWaalsContact O-NZ 3.07Å
268	F	87.4	Confident	79.6	Confident	10 Å²	10	73.2 Å²	73.2	4%	0.044	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.1	164.4	-174.2	-102.6	0	0	0	108.8	Q262 F293 L362 W363 A366	Q262-F268 HydrophobicContact CG-CE2 4.49Å; F268-F293 PolarHBondContact N-O 2.91Å; F268-F293 PolarHBondContact O-N 3.4Å; F268-L362 HydrophobicContact CE1-CB 4.14Å; F268-L362 HydrophobicContact CE2-CB 4.12Å; F268-L362 HydrophobicContact CZ-CB 3.54Å; F268-L362 HydrophobicContact CZ-CD1 4.2Å; F268-L362 HydrophobicContact CZ-CG 4.42Å; F268-W363 AromaticContact CD1-CD2 3.73Å; F268-W363 HydrophobicContact CD1-CD2 3.73Å; F268-W363 AromaticContact CD1-CE2 3.97Å; F268-W363 AromaticContact CD1-CE3 3.58Å; F268-W363 HydrophobicContact CD1-CE3 3.58Å; F268-W363 HydrophobicContact CD1-CG 4.4Å; F268-W363 HydrophobicContact CD1-CH2 4.01Å; F268-W363 HydrophobicContact CD1-CZ2 4.12Å; F268-W363 AromaticContact CD1-CZ3 3.74Å; F268-W363 HydrophobicContact CD1-CZ3 3.74Å; F268-W363 AromaticContact CE1-CD2 3.59Å; F268-W363 HydrophobicContact CE1-CD2 3.59Å; F268-W363 AromaticContact CE1-CE2 3.66Å; F268-W363 AromaticContact CE1-CE3 3.98Å; F268-W363 HydrophobicContact CE1-CE3 3.98Å; F268-W363 AromaticContact CE1-CG 3.9Å; F268-W363 HydrophobicContact CE1-CG 3.9Å; F268-W363 HydrophobicContact CE1-CH2 4.47Å; F268-W363 HydrophobicContact CE1-CZ2 4.12Å; F268-W363 HydrophobicContact CE1-CZ3 4.4Å; F268-W363 AromaticContact CE1-NE1 3.91Å; F268-A366 HydrophobicContact CB-CB 3.76Å; F268-A366 HydrophobicContact CD1-CB 3.99Å; F268-A366 HydrophobicContact CG-CB 3.86Å
269	E	89.8	Confident	80	Confident	54 Å²	54	71.4 Å²	71.4	25%	0.252	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.7	-169.4	-53.9	-168.4	-175.5	0	0	112.9	T263 Y290 C291 T292	T263-E269 HydrophobicContact CG2-CB 4.19Å; T263-E269 WeakPolarHBondContact OG1-CG 3.41Å; E269-Y290 HydrophobicContact CB-CE1 4.31Å; E269-Y290 WeakPolarHBondContact CB-OH 3.46Å; E269-Y290 WeakPolarHBondContact OE2-CE1 3.44Å; E269-Y290 PolarHBondContact OE2-OH 3.46Å; E269-C291 VanDerWaalsContact CA-O 3.26Å; E269-C291 WeakPolarHBondContact CA-O 3.3Å; E269-T292 HydrophobicContact CG-CG2 3.87Å; E269-T292 WeakPolarHBondContact OE1-CG2 3.49Å
270	G	89.1	Confident	80.2	Confident	16 Å²	16	70.9 Å²	70.9	17%	0.165	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.4	-179.9	175.6	0	0	0	0	0	112.5	C291	G270-C291 PolarHBondContact N-O 3.37Å; G270-C291 WeakPolarHBondContact O-CB 3.25Å; G270-C291 PolarHBondContact O-N 2.9Å
271	Y	90.6	Very high	80.3	Confident	60 Å²	60	72.4 Å²	72.4	24%	0.235	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	134.1	177.8	-68.5	-83.1	0	0	0	112	K288 R289 Y290 F305	Y271-K288 HydrophobicContact CD1-CD 4.12Å; Y271-K288 VanDerWaalsContact CD1-CE 3.44Å; Y271-K288 HydrophobicContact CD1-CG 4.05Å; Y271-K288 VanDerWaalsContact CG-CE 3.45Å; Y271-R289 WeakPolarHBondContact CA-O 3.32Å; Y271-Y290 HydrophobicContact CD1-CD2 4.09Å; Y271-Y290 HydrophobicContact CD2-CD2 4.12Å; Y271-Y290 AromaticContact CE1-CD2 3.88Å; Y271-Y290 HydrophobicContact CE1-CD2 3.88Å; Y271-Y290 HydrophobicContact CE1-CG 4.39Å; Y271-Y290 AromaticContact CE2-CD2 3.88Å; Y271-Y290 HydrophobicContact CE2-CD2 3.88Å; Y271-Y290 HydrophobicContact CE2-CE2 4.35Å; Y271-Y290 HydrophobicContact CG-CD2 4.23Å; Y271-Y290 AromaticContact CZ-CD2 3.76Å; Y271-F305 HydrophobicContact CE1-CB 4.46Å; Y271-F305 HydrophobicContact CE1-CD1 4.18Å; Y271-F305 VanDerWaalsContact OH-CD1 3.31Å; Y271-F305 WeakPolarHBondContact OH-CD1 3.21Å
272	L	91.9	Very high	80.4	Confident	0 Å²	0	75 Å²	75	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.3	167.2	-68	173.8	0	0	0	109.6	R289 C291 V352 A354 W363 M367	L272-R289 PolarHBondContact N-O 2.92Å; L272-R289 PolarHBondContact O-N 2.9Å; L272-R289 VanDerWaalsContact O-O 3.13Å; L272-C291 HydrophobicContact CD1-CB 4.13Å; L272-C291 HydrophobicContact CG-CB 4.4Å; L272-V352 HydrophobicContact CD1-CB 4.34Å; L272-V352 HydrophobicContact CD1-CG2 4.18Å; L272-A354 HydrophobicContact CD2-CB 4.09Å; L272-W363 HydrophobicContact CD1-CD2 4.12Å; L272-W363 HydrophobicContact CD1-CE3 4.37Å; L272-W363 HydrophobicContact CD1-CH2 4.29Å; L272-W363 HydrophobicContact CD1-CZ2 4.03Å; L272-W363 HydrophobicContact CD1-CZ3 4.45Å; L272-W363 HydrophobicContact CD2-CD2 4.26Å; L272-W363 HydrophobicContact CD2-CG 4.14Å; L272-W363 HydrophobicContact CG-CD2 4.4Å; L272-W363 HydrophobicContact CG-CZ2 3.98Å; L272-M367 HydrophobicContact CD1-CE 4.37Å
273	Y	90.7	Very high	81.2	Confident	81 Å²	81	72.1 Å²	72.1	32%	0.318	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.8	163.2	-77.3	-90.5	0	0	0	108.7	W286 V287 K288 V352 Q353 L355	Y273-W286 HydrophobicContact CD1-CB 4.25Å; Y273-W286 WeakPolarHBondContact O-CZ3 3.39Å; Y273-V287 CarbonylContact C-O 3.58Å; Y273-V287 WeakPolarHBondContact CA-O 3.2Å; Y273-K288 HydrophobicContact CD1-CB 3.95Å; Y273-K288 HydrophobicContact CE1-CB 3.63Å; Y273-K288 HydrophobicContact CE1-CG 4.15Å; Y273-K288 HydrophobicContact CE2-CG 4.23Å; Y273-V352 CarbonylContact O-C 3.53Å; Y273-V352 VanDerWaalsContact O-CA 3.26Å; Y273-V352 WeakPolarHBondContact O-CA 3.49Å; Y273-Q353 PolarHBondContact N-O 2.98Å; Y273-Q353 PolarHBondContact O-N 2.76Å; Y273-L355 HydrophobicContact CD2-CD2 3.93Å; Y273-L355 HydrophobicContact CE2-CD2 3.64Å
274	V	90.3	Very high	82.2	Confident	3 Å²	3	70.9 Å²	70.9	2%	0.018	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	133.1	178.7	-175.9	0	0	0	0	109.2	E276 W286 V287 R289 M302 L350 V352	V274-E276 PolarHBondContact O-N 3.09Å; V274-W286 WeakPolarHBondContact O-CA 3.39Å; V274-V287 PolarHBondContact N-O 3.43Å; V274-V287 PolarHBondContact O-N 3.42Å; V274-R289 HydrophobicContact CG2-CB 4.28Å; V274-R289 HydrophobicContact CG2-CG 4.19Å; V274-M302 HydrophobicContact CG2-SD 4.09Å; V274-L350 HydrophobicContact CG1-CD1 3.62Å; V274-L350 HydrophobicContact CG1-CD2 4.07Å; V274-L350 HydrophobicContact CG1-CG 3.97Å; V274-V352 HydrophobicContact CG1-CG1 4.47Å; V274-V352 HydrophobicContact CG2-CG1 4.15Å
275	Q	89.1	Confident	83.1	Confident	45 Å²	45	70.3 Å²	70.3	21%	0.21	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	112.7	176.1	-167.7	-179.2	17.4	0	0	110.8	S284 W286 T351	Q275-S284 PolarHBondContact NE2-OG 3.35Å; Q275-W286 HydrophobicContact CB-CD2 4.15Å; Q275-W286 HydrophobicContact CB-CE3 3.99Å; Q275-W286 HydrophobicContact CB-CH2 3.92Å; Q275-W286 HydrophobicContact CB-CZ2 4.01Å; Q275-W286 HydrophobicContact CB-CZ3 3.88Å; Q275-W286 HydrophobicContact CG-CD2 4.37Å; Q275-W286 HydrophobicContact CG-CH2 4.44Å; Q275-W286 HydrophobicContact CG-CZ2 4.03Å; Q275-T351 WeakPolarHBondContact CB-O 3.31Å; Q275-T351 PolarHBondContact N-O 3.1Å
276	E	87.1	Confident	83.9	Confident	60 Å²	60	67.4 Å²	67.4	28%	0.28	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	126.9	175.7	-67	177.5	-174.6	0	0	110.1	V274 S284 S285 V287 R289	V274-E276 PolarHBondContact O-N 3.09Å; E276-S284 CarbonylContact O-C 3.56Å; E276-S284 VanDerWaalsContact O-CA 3.25Å; E276-S284 WeakPolarHBondContact O-CA 3.23Å; E276-S284 WeakPolarHBondContact O-CB 3.18Å; E276-S285 PolarHBondContact N-O 3.47Å; E276-S285 PolarHBondContact O-N 2.93Å; E276-V287 VanDerWaalsContact CD-CG2 3.42Å; E276-V287 HydrophobicContact CG-CG2 4.27Å; E276-V287 WeakPolarHBondContact OE1-CB 3.4Å; E276-V287 VanDerWaalsContact OE2-CG2 3.26Å; E276-V287 WeakPolarHBondContact OE2-CG2 3.43Å; E276-R289 IonicContact OE1-CZ 2.81Å; E276-R289 IonicContact OE1-NE 3.83Å; E276-R289 PolarHBondContact OE1-NE 3.07Å; E276-R289 IonicContact OE1-NH2 2.72Å; E276-R289 PolarHBondContact OE1-NH2 3.44Å
277	K	81.6	Confident	84.3	Confident	192 Å²	192	64.3 Å²	64.3	84%	0.835	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	125.1	174.6	-66.5	178	-178.8	175.2	0	109.2
278	R	78.3	Confident	84.5	Confident	135 Å²	135	67.3 Å²	67.3	51%	0.509	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-95	157.2	173.3	-63.5	-174.4	176.4	-172.3	-3.1	110.2	F282 G283 S285	R278-F282 HydrophobicContact CB-CB 3.81Å; R278-G283 WeakPolarHBondContact CB-O 3.33Å; R278-G283 PolarHBondContact N-O 2.8Å; R278-S285 VanDerWaalsContact NE-CB 3.29Å; R278-S285 PolarHBondContact NE-OG 3.01Å; R278-S285 VanDerWaalsContact NH2-CB 3.31Å; R278-S285 PolarHBondContact NH2-OG 3.4Å
279	P	78.9	Confident	84.6	Confident	96 Å²	96	68 Å²	68	62%	0.623	35%	0.354	S	S	*	.	S	Bend	trans	-56.7	144.2	169.2	-23.6	34.3	0	0	0	111.2	F282	P279-F282 PolarHBondContact O-N 3.27Å
280	P	72.6	Confident	84.6	Confident	124 Å²	124	68.9 Å²	68.9	81%	0.805	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	139.5	169	-24.2	34.3	0	0	0	110.8
281	P	71.2	Confident	84.7	Confident	116 Å²	116	68.1 Å²	68.1	75%	0.753	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	cis	-89	5.3	8.6	36.3	-38.1	0	0	0	115.4	G283	P281-G283 VanDerWaalsContact C-N 3.29Å; P281-G283 PolarHBondContact O-N 3.5Å; P281-G283 VanDerWaalsContact O-N 3.15Å
282	F	72.6	Confident	84.8	Confident	145 Å²	145	66.7 Å²	66.7	64%	0.636	35%	0.345	S	S	*	.	S	Bend	trans	-80.5	6.7	-162.6	-58	-76.4	0	0	0	116.4	R278 P279 S284	R278-F282 HydrophobicContact CB-CB 3.81Å; P279-F282 PolarHBondContact O-N 3.27Å; F282-S284 PolarHBondContact O-N 3.5Å
283	G	80.7	Confident	84.7	Confident	47 Å²	47	66.8 Å²	66.8	49%	0.485	35%	0.346	S	S	.	.			trans	62	-129.6	172.5	0	0	0	0	0	114.4	R278 P281	R278-G283 WeakPolarHBondContact CB-O 3.33Å; R278-G283 PolarHBondContact N-O 2.8Å; P281-G283 VanDerWaalsContact C-N 3.29Å; P281-G283 PolarHBondContact O-N 3.5Å; P281-G283 VanDerWaalsContact O-N 3.15Å
284	S	82.6	Confident	84.7	Confident	53 Å²	53	64.3 Å²	64.3	37%	0.371	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	140.9	175.3	66.2	0	0	0	0	111.4	Q275 E276 F282	Q275-S284 PolarHBondContact NE2-OG 3.35Å; E276-S284 CarbonylContact O-C 3.56Å; E276-S284 VanDerWaalsContact O-CA 3.25Å; E276-S284 WeakPolarHBondContact O-CA 3.23Å; E276-S284 WeakPolarHBondContact O-CB 3.18Å; F282-S284 PolarHBondContact O-N 3.5Å
285	S	86.2	Confident	84.5	Confident	16 Å²	16	67 Å²	67	11%	0.112	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	157.5	169.9	48.2	0	0	0	0	112	E276 R278	E276-S285 PolarHBondContact N-O 3.47Å; E276-S285 PolarHBondContact O-N 2.93Å; R278-S285 VanDerWaalsContact NE-CB 3.29Å; R278-S285 PolarHBondContact NE-OG 3.01Å; R278-S285 VanDerWaalsContact NH2-CB 3.31Å; R278-S285 PolarHBondContact NH2-OG 3.4Å
286	W	86.8	Confident	84.3	Confident	46 Å²	46	72.7 Å²	72.7	17%	0.174	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.2	172.5	-68.7	84.4	0	0	0	109	Y273 V274 Q275 R334 T351 Q353	Y273-W286 HydrophobicContact CD1-CB 4.25Å; Y273-W286 WeakPolarHBondContact O-CZ3 3.39Å; V274-W286 WeakPolarHBondContact O-CA 3.39Å; Q275-W286 HydrophobicContact CB-CD2 4.15Å; Q275-W286 HydrophobicContact CB-CE3 3.99Å; Q275-W286 HydrophobicContact CB-CH2 3.92Å; Q275-W286 HydrophobicContact CB-CZ2 4.01Å; Q275-W286 HydrophobicContact CB-CZ3 3.88Å; Q275-W286 HydrophobicContact CG-CD2 4.37Å; Q275-W286 HydrophobicContact CG-CH2 4.44Å; Q275-W286 HydrophobicContact CG-CZ2 4.03Å; W286-R334 VanDerWaalsContact CE2-CD 3.5Å; W286-T351 HydrophobicContact CH2-CG2 3.82Å; W286-Q353 HydrophobicContact CE3-CB 4.12Å; W286-Q353 HydrophobicContact CH2-CB 4.19Å; W286-Q353 HydrophobicContact CZ3-CB 3.58Å
287	V	87.4	Confident	84.3	Confident	38 Å²	38	75.3 Å²	75.3	23%	0.23	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.2	-178.6	177.3	0	0	0	0	109.2	Y273 V274 E276 R289 T304	Y273-V287 CarbonylContact C-O 3.58Å; Y273-V287 WeakPolarHBondContact CA-O 3.2Å; V274-V287 PolarHBondContact N-O 3.43Å; V274-V287 PolarHBondContact O-N 3.42Å; E276-V287 VanDerWaalsContact CD-CG2 3.42Å; E276-V287 HydrophobicContact CG-CG2 4.27Å; E276-V287 WeakPolarHBondContact OE1-CB 3.4Å; E276-V287 VanDerWaalsContact OE2-CG2 3.26Å; E276-V287 WeakPolarHBondContact OE2-CG2 3.43Å; V287-R289 HydrophobicContact CG1-CG 4.23Å; V287-R289 PolarHBondContact O-N 3.43Å; V287-T304 HydrophobicContact CG1-CG2 4.3Å
288	K	89.3	Confident	84.7	Confident	76 Å²	76	71.5 Å²	71.5	33%	0.33	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	118.6	175.4	-163.6	-173.9	-177.9	-166.4	0	108.8	Y271 Y273	Y271-K288 HydrophobicContact CD1-CD 4.12Å; Y271-K288 VanDerWaalsContact CD1-CE 3.44Å; Y271-K288 HydrophobicContact CD1-CG 4.05Å; Y271-K288 VanDerWaalsContact CG-CE 3.45Å; Y273-K288 HydrophobicContact CD1-CB 3.95Å; Y273-K288 HydrophobicContact CE1-CB 3.63Å; Y273-K288 HydrophobicContact CE1-CG 4.15Å; Y273-K288 HydrophobicContact CE2-CG 4.23Å
289	R	89.3	Confident	85.4	Confident	26 Å²	26	66.9 Å²	66.9	10%	0.098	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.5	173.5	-61.4	-166.2	-175.6	-175	6.6	109.6	Y271 L272 V274 E276 V287 M302 V303 T304 E317	Y271-R289 WeakPolarHBondContact CA-O 3.32Å; L272-R289 PolarHBondContact N-O 2.92Å; L272-R289 PolarHBondContact O-N 2.9Å; L272-R289 VanDerWaalsContact O-O 3.13Å; V274-R289 HydrophobicContact CG2-CB 4.28Å; V274-R289 HydrophobicContact CG2-CG 4.19Å; E276-R289 IonicContact OE1-CZ 2.81Å; E276-R289 IonicContact OE1-NE 3.83Å; E276-R289 PolarHBondContact OE1-NE 3.07Å; E276-R289 IonicContact OE1-NH2 2.72Å; E276-R289 PolarHBondContact OE1-NH2 3.44Å; V287-R289 HydrophobicContact CG1-CG 4.23Å; V287-R289 PolarHBondContact O-N 3.43Å; R289-M302 HydrophobicContact CB-CB 4.43Å; R289-V303 CarbonylContact C-O 3.53Å; R289-V303 WeakPolarHBondContact CA-O 3.34Å; R289-V303 WeakPolarHBondContact CB-O 3.49Å; R289-T304 HydrophobicContact CG-CG2 4.16Å; R289-E317 IonicContact CZ-OE2 3.55Å; R289-E317 IonicContact NH1-OE2 3.43Å; R289-E317 PolarHBondContact NH1-OE2 2.94Å; R289-E317 IonicContact NH2-OE2 3.98Å
290	Y	90.3	Very high	86	Confident	72 Å²	72	62.3 Å²	62.3	28%	0.282	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130	164.3	-171.3	-95.8	0	0	0	107.5	E269 Y271 M302 V303	E269-Y290 HydrophobicContact CB-CE1 4.31Å; E269-Y290 WeakPolarHBondContact CB-OH 3.46Å; E269-Y290 WeakPolarHBondContact OE2-CE1 3.44Å; E269-Y290 PolarHBondContact OE2-OH 3.46Å; Y271-Y290 HydrophobicContact CD1-CD2 4.09Å; Y271-Y290 HydrophobicContact CD2-CD2 4.12Å; Y271-Y290 AromaticContact CE1-CD2 3.88Å; Y271-Y290 HydrophobicContact CE1-CD2 3.88Å; Y271-Y290 HydrophobicContact CE1-CG 4.39Å; Y271-Y290 AromaticContact CE2-CD2 3.88Å; Y271-Y290 HydrophobicContact CE2-CD2 3.88Å; Y271-Y290 HydrophobicContact CE2-CE2 4.35Å; Y271-Y290 HydrophobicContact CG-CD2 4.23Å; Y271-Y290 AromaticContact CZ-CD2 3.76Å; Y290-M302 WeakPolarHBondContact O-CA 3.35Å; Y290-V303 PolarHBondContact N-O 2.98Å; Y290-V303 PolarHBondContact O-N 3.35Å
291	C	91.4	Very high	86.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.8	-169.6	-66.1	0	0	0	0	110.4	E269 G270 L272 L300 H301 W363	E269-C291 VanDerWaalsContact CA-O 3.26Å; E269-C291 WeakPolarHBondContact CA-O 3.3Å; G270-C291 PolarHBondContact N-O 3.37Å; G270-C291 WeakPolarHBondContact O-CB 3.25Å; G270-C291 PolarHBondContact O-N 2.9Å; L272-C291 HydrophobicContact CD1-CB 4.13Å; L272-C291 HydrophobicContact CG-CB 4.4Å; C291-L300 HydrophobicContact CB-CD1 4.05Å; C291-H301 CarbonylContact C-O 3.44Å; C291-H301 VanDerWaalsContact CA-O 3.24Å; C291-H301 WeakPolarHBondContact CA-O 3.36Å; C291-W363 HydrophobicContact CB-CH2 3.76Å; C291-W363 HydrophobicContact CB-CZ2 4.06Å
292	T	92.1	Very high	87.9	Confident	29 Å²	29	53.6 Å²	53.6	18%	0.178	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	114.5	176	-64.4	0	0	0	0	108.3	E269 H301	E269-T292 HydrophobicContact CG-CG2 3.87Å; E269-T292 WeakPolarHBondContact OE1-CG2 3.49Å; T292-H301 PolarHBondContact N-O 3.39Å; T292-H301 PolarHBondContact O-N 3.16Å
293	F	90.9	Very high	88.7	Confident	3 Å²	3	48 Å²	48	1%	0.013	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	121.2	177.1	178.2	-104.9	0	0	0	110.9	S267 F268 K295 K298 I299 L300 L321 W363 A366 M367	S267-F293 CarbonylContact C-O 3.51Å; S267-F293 WeakPolarHBondContact CA-O 3.48Å; S267-F293 WeakPolarHBondContact CB-O 3.5Å; F268-F293 PolarHBondContact N-O 2.91Å; F268-F293 PolarHBondContact O-N 3.4Å; F293-K295 HydrophobicContact CD1-CG 4.12Å; F293-K295 HydrophobicContact CE1-CB 4.35Å; F293-K295 HydrophobicContact CE1-CG 4.11Å; F293-K298 VanDerWaalsContact CE2-C 3.5Å; F293-K298 HydrophobicContact CE2-CB 4.25Å; F293-K298 HydrophobicContact CZ-CB 4.22Å; F293-K298 HydrophobicContact CZ-CG 4.4Å; F293-I299 CarbonylContact C-O 3.52Å; F293-I299 WeakPolarHBondContact CA-O 3.47Å; F293-I299 WeakPolarHBondContact CD2-O 3.45Å; F293-L300 HydrophobicContact CB-CD1 3.91Å; F293-L300 HydrophobicContact CD2-CB 4.25Å; F293-L300 HydrophobicContact CD2-CD1 4.42Å; F293-L321 HydrophobicContact CD2-CD1 3.94Å; F293-L321 HydrophobicContact CE2-CB 4.42Å; F293-L321 HydrophobicContact CE2-CD1 3.63Å; F293-L321 HydrophobicContact CE2-CG 4.1Å; F293-W363 HydrophobicContact CB-CZ3 3.81Å; F293-A366 WeakPolarHBondContact CE1-O 3.45Å; F293-M367 HydrophobicContact CD1-CG 4.31Å; F293-M367 HydrophobicContact CD2-CG 4.27Å; F293-M367 HydrophobicContact CE1-CG 4.35Å; F293-M367 HydrophobicContact CE2-CG 4.29Å; F293-M367 HydrophobicContact CG-CG 4.27Å; F293-M367 HydrophobicContact CZ-CB 4.48Å; F293-M367 HydrophobicContact CZ-CG 4.32Å
294	V	90.6	Very high	88.8	Confident	29 Å²	29	48.1 Å²	48.1	18%	0.176	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	111	177.3	-176.5	0	0	0	0	108.7	E296 Q297 K298 I299	V294-E296 PolarHBondContact O-N 3.29Å; V294-Q297 HydrophobicContact CB-CB 4.39Å; V294-Q297 HydrophobicContact CG1-CB 4.06Å; V294-Q297 HydrophobicContact CG1-CG 3.98Å; V294-Q297 PolarHBondContact O-N 2.77Å; V294-K298 WeakPolarHBondContact O-CA 3.42Å; V294-K298 PolarHBondContact O-N 2.97Å; V294-I299 PolarHBondContact N-O 3.09Å; V294-I299 PolarHBondContact O-N 3.21Å
295	K	85.4	Confident	88.3	Confident	59 Å²	59	48.6 Å²	48.6	26%	0.257	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-44.2	-164.6	-63.7	170.9	-166.9	155.8	0	113.4	S264 P265 I266 S267 F293	S264-K295 PolarHBondContact O-NZ 2.66Å; P265-K295 WeakPolarHBondContact O-CD 3.31Å; P265-K295 PolarHBondContact O-NZ 3.29Å; I266-K295 WeakPolarHBondContact O-CB 3.29Å; I266-K295 WeakPolarHBondContact O-CG 3.5Å; I266-K295 PolarHBondContact O-N 3.46Å; S267-K295 WeakPolarHBondContact O-CE 3.43Å; S267-K295 PolarHBondContact O-NZ 3.38Å; S267-K295 VanDerWaalsContact O-NZ 3.07Å; F293-K295 HydrophobicContact CD1-CG 4.12Å; F293-K295 HydrophobicContact CE1-CB 4.35Å; F293-K295 HydrophobicContact CE1-CG 4.11Å
296	E	85.1	Confident	87.5	Confident	165 Å²	165	51.2 Å²	51.2	77%	0.771	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-41.4	-179	-63.9	-177.4	162.6	0	0	112.5	V294	V294-E296 PolarHBondContact O-N 3.29Å
297	Q	87.2	Confident	86.5	Confident	114 Å²	114	56 Å²	56	53%	0.533	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-16.1	-175.4	-60.2	172.6	8	0	0	112.5	V294 I299	V294-Q297 HydrophobicContact CB-CB 4.39Å; V294-Q297 HydrophobicContact CG1-CB 4.06Å; V294-Q297 HydrophobicContact CG1-CG 3.98Å; V294-Q297 PolarHBondContact O-N 2.77Å; Q297-I299 HydrophobicContact CB-CD1 4.02Å; Q297-I299 HydrophobicContact CB-CG1 3.97Å; Q297-I299 PolarHBondContact O-N 3.08Å
298	K	90.3	Very high	85.5	Confident	112 Å²	112	65.7 Å²	65.7	49%	0.487	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	26.6	-171.1	-56.9	-176.5	177.3	-177	0	114.4	F293 V294 L321	F293-K298 VanDerWaalsContact CE2-C 3.5Å; F293-K298 HydrophobicContact CE2-CB 4.25Å; F293-K298 HydrophobicContact CZ-CB 4.22Å; F293-K298 HydrophobicContact CZ-CG 4.4Å; V294-K298 WeakPolarHBondContact O-CA 3.42Å; V294-K298 PolarHBondContact O-N 2.97Å; K298-L321 PolarHBondContact O-N 2.64Å
299	I	91.9	Very high	84.3	Confident	38 Å²	38	65.4 Å²	65.4	20%	0.195	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	129.9	178.8	-59.5	174.9	0	0	0	109.4	F293 V294 Q297	F293-I299 CarbonylContact C-O 3.52Å; F293-I299 WeakPolarHBondContact CA-O 3.47Å; F293-I299 WeakPolarHBondContact CD2-O 3.45Å; V294-I299 PolarHBondContact N-O 3.09Å; V294-I299 PolarHBondContact O-N 3.21Å; Q297-I299 HydrophobicContact CB-CD1 4.02Å; Q297-I299 HydrophobicContact CB-CG1 3.97Å; Q297-I299 PolarHBondContact O-N 3.08Å
300	L	92.1	Very high	82.9	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	109.6	169.9	-176.6	70	0	0	0	109.2	C291 F293 M302 S318 V319 L321 L340 W363 M367	C291-L300 HydrophobicContact CB-CD1 4.05Å; F293-L300 HydrophobicContact CB-CD1 3.91Å; F293-L300 HydrophobicContact CD2-CB 4.25Å; F293-L300 HydrophobicContact CD2-CD1 4.42Å; L300-M302 HydrophobicContact CD2-CG 4Å; L300-M302 HydrophobicContact CD2-SD 3.85Å; L300-M302 HydrophobicContact CG-CG 3.86Å; L300-M302 HydrophobicContact CG-SD 4.35Å; L300-S318 WeakPolarHBondContact O-CA 3.26Å; L300-V319 HydrophobicContact CB-CG2 4.03Å; L300-V319 HydrophobicContact CD2-CG2 4.42Å; L300-V319 PolarHBondContact N-O 2.72Å; L300-V319 PolarHBondContact O-N 3.14Å; L300-L321 HydrophobicContact CB-CD1 4.31Å; L300-L321 HydrophobicContact CB-CD2 4.35Å; L300-L321 HydrophobicContact CB-CG 4.26Å; L300-L340 HydrophobicContact CD2-CD1 3.77Å; L300-W363 HydrophobicContact CD1-CH2 4.41Å; L300-W363 HydrophobicContact CD1-CZ3 4.11Å; L300-M367 HydrophobicContact CD1-CE 3.72Å; L300-M367 HydrophobicContact CD2-CE 4.06Å; L300-M367 HydrophobicContact CG-CE 4.47Å
301	H	92.2	Very high	81.4	Confident	58 Å²	58	65.7 Å²	65.7	27%	0.269	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	139.4	167.1	-54.7	-72.4	0	0	0	109.4	C291 T292 T316 E317 S318	C291-H301 CarbonylContact C-O 3.44Å; C291-H301 VanDerWaalsContact CA-O 3.24Å; C291-H301 WeakPolarHBondContact CA-O 3.36Å; T292-H301 PolarHBondContact N-O 3.39Å; T292-H301 PolarHBondContact O-N 3.16Å; H301-T316 HydrophobicContact CB-CG2 4.36Å; H301-E317 CarbonylContact C-O 3.45Å; H301-S318 PolarHBondContact ND1-OG 2.88Å
302	M	91.6	Very high	80.2	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	116.9	-175	-55.5	-179.1	-74.1	0	0	109.9	V274 R289 Y290 L300 E317 V319 L350	V274-M302 HydrophobicContact CG2-SD 4.09Å; R289-M302 HydrophobicContact CB-CB 4.43Å; Y290-M302 WeakPolarHBondContact O-CA 3.35Å; L300-M302 HydrophobicContact CD2-CG 4Å; L300-M302 HydrophobicContact CD2-SD 3.85Å; L300-M302 HydrophobicContact CG-CG 3.86Å; L300-M302 HydrophobicContact CG-SD 4.35Å; M302-E317 HydrophobicContact CE-CB 4.23Å; M302-E317 HydrophobicContact CE-CG 3.96Å; M302-E317 PolarHBondContact N-O 3.36Å; M302-E317 PolarHBondContact O-N 3.33Å; M302-V319 HydrophobicContact CE-CG1 4.17Å; M302-V319 HydrophobicContact CE-CG2 3.93Å; M302-L350 HydrophobicContact CE-CD2 3.95Å; M302-L350 HydrophobicContact SD-CD2 3.71Å
303	V	90.2	Very high	79.1	Confident	26 Å²	26	78.7 Å²	78.7	16%	0.158	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.2	-175.3	179.3	0	0	0	0	109.7	R289 Y290 I313 T316	R289-V303 CarbonylContact C-O 3.53Å; R289-V303 WeakPolarHBondContact CA-O 3.34Å; R289-V303 WeakPolarHBondContact CB-O 3.49Å; Y290-V303 PolarHBondContact N-O 2.98Å; Y290-V303 PolarHBondContact O-N 3.35Å; V303-I313 HydrophobicContact CG1-CG2 3.67Å; V303-T316 HydrophobicContact CG2-CG2 3.98Å
304	T	82.4	Confident	78.2	Confident	50 Å²	50	80 Å²	80	31%	0.307	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	128.7	169.3	51.7	0	0	0	0	110.3	V287 R289 G314	V287-T304 HydrophobicContact CG1-CG2 4.3Å; R289-T304 HydrophobicContact CG-CG2 4.16Å; T304-G314 PolarHBondContact O-N 3.19Å; T304-G314 WeakPolarHBondContact OG1-CA 3.39Å
305	F	71.5	Confident	77.5	Confident	64 Å²	64	86.9 Å²	86.9	28%	0.281	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	107.6	-178.2	-174.1	-108.4	0	0	0	110.9	Y271 H307 G311	Y271-F305 HydrophobicContact CE1-CB 4.46Å; Y271-F305 HydrophobicContact CE1-CD1 4.18Å; Y271-F305 VanDerWaalsContact OH-CD1 3.31Å; Y271-F305 WeakPolarHBondContact OH-CD1 3.21Å; F305-H307 AromaticContact CD1-ND1 3.86Å; F305-H307 AromaticContact CE1-CE1 3.56Å; F305-H307 AromaticContact CE1-ND1 3.41Å; F305-H307 WeakPolarHBondContact CE1-ND1 3.24Å; F305-G311 WeakPolarHBondContact CE2-O 3.47Å
306	D	69.4	Low	77.6	Confident	71 Å²	71	88 Å²	88	38%	0.38	46%	0.456	S	S	.	.			trans	-101.5	117.2	176.9	176.2	30.5	0	0	0	111.8	R308 S309	D306-R308 PolarHBondContact O-N 3.24Å; D306-R308 WeakPolarHBondContact OD1-CB 3.28Å; D306-R308 PolarHBondContact OD1-N 2.86Å; D306-S309 PolarHBondContact O-N 2.94Å; D306-S309 VanDerWaalsContact OD2-CB 3.3Å; D306-S309 WeakPolarHBondContact OD2-CB 3.48Å; D306-S309 PolarHBondContact OD2-N 3.41Å; D306-S309 PolarHBondContact OD2-OG 3.48Å
307	H	65.8	Low	77.7	Confident	147 Å²	147	82.6 Å²	82.6	68%	0.681	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-62.9	-27.4	173.6	-98.9	66.6	0	0	0	113.3	F305	F305-H307 AromaticContact CD1-ND1 3.86Å; F305-H307 AromaticContact CE1-CE1 3.56Å; F305-H307 AromaticContact CE1-ND1 3.41Å; F305-H307 WeakPolarHBondContact CE1-ND1 3.24Å
308	R	66.9	Low	77.9	Confident	241 Å²	241	79.8 Å²	79.8	91%	0.909	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-78.2	-22.9	-179.8	-61.4	-173.2	179.1	-157.1	-0.1	112.9	D306 G310	D306-R308 PolarHBondContact O-N 3.24Å; D306-R308 WeakPolarHBondContact OD1-CB 3.28Å; D306-R308 PolarHBondContact OD1-N 2.86Å; R308-G310 VanDerWaalsContact C-N 3.28Å; R308-G310 PolarHBondContact O-N 3.02Å
309	S	62.9	Low	77.9	Confident	69 Å²	69	74.5 Å²	74.5	48%	0.483	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-87.3	17.3	179.9	-65.8	0	0	0	0	114.2	D306 G311	D306-S309 PolarHBondContact O-N 2.94Å; D306-S309 VanDerWaalsContact OD2-CB 3.3Å; D306-S309 WeakPolarHBondContact OD2-CB 3.48Å; D306-S309 PolarHBondContact OD2-N 3.41Å; D306-S309 PolarHBondContact OD2-OG 3.48Å; S309-G311 VanDerWaalsContact C-N 3.31Å; S309-G311 PolarHBondContact O-N 3.48Å
310	G	59.8	Low	77.8	Confident	75 Å²	75	74.4 Å²	74.4	77%	0.773	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	24.7	-179.6	0	0	0	0	0	114.3	R308	R308-G310 VanDerWaalsContact C-N 3.28Å; R308-G310 PolarHBondContact O-N 3.02Å
311	G	60.3	Low	77.7	Confident	30 Å²	30	74.8 Å²	74.8	31%	0.309	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	18.4	175.4	0	0	0	0	0	115.4	F305 S309 I313	F305-G311 WeakPolarHBondContact CE2-O 3.47Å; S309-G311 VanDerWaalsContact C-N 3.31Å; S309-G311 PolarHBondContact O-N 3.48Å; G311-I313 PolarHBondContact O-N 3.33Å
312	K	64.9	Low	77.3	Confident	169 Å²	169	79.1 Å²	79.1	74%	0.735	42%	0.422	S	S	*	.			trans	-60.3	120.9	171	-72.6	-173.7	177.4	-177.4	0	110.5	G314	K312-G314 PolarHBondContact O-N 3.35Å
313	I	70.6	Confident	76.9	Confident	133 Å²	133	81.1 Å²	81.1	68%	0.682	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.1	117.9	169.5	-66.9	174.7	0	0	0	107.5	V303 G311	V303-I313 HydrophobicContact CG1-CG2 3.67Å; G311-I313 PolarHBondContact O-N 3.33Å
314	G	71.4	Confident	76.7	Confident	30 Å²	30	80.1 Å²	80.1	31%	0.309	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	-165.2	175.6	0	0	0	0	0	112.8	T304 K312 T316	T304-G314 PolarHBondContact O-N 3.19Å; T304-G314 WeakPolarHBondContact OG1-CA 3.39Å; K312-G314 PolarHBondContact O-N 3.35Å; G314-T316 PolarHBondContact O-N 2.82Å
315	E	75.9	Confident	76.7	Confident	173 Å²	173	81.2 Å²	81.2	81%	0.808	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.4	136.2	179.6	-65.7	-178.5	170.2	0	0	112.1
316	T	86.1	Confident	77	Confident	83 Å²	83	84.1 Å²	84.1	51%	0.509	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	110	177	-54.6	0	0	0	0	110.1	H301 V303 G314	H301-T316 HydrophobicContact CB-CG2 4.36Å; V303-T316 HydrophobicContact CG2-CG2 3.98Å; G314-T316 PolarHBondContact O-N 2.82Å
317	E	88.8	Confident	77.2	Confident	51 Å²	51	83 Å²	83	24%	0.238	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	136.5	168	-174.2	170.9	-166	0	0	109.8	R289 H301 M302 R345	R289-E317 IonicContact CZ-OE2 3.55Å; R289-E317 IonicContact NH1-OE2 3.43Å; R289-E317 PolarHBondContact NH1-OE2 2.94Å; R289-E317 IonicContact NH2-OE2 3.98Å; H301-E317 CarbonylContact C-O 3.45Å; M302-E317 HydrophobicContact CE-CB 4.23Å; M302-E317 HydrophobicContact CE-CG 3.96Å; M302-E317 PolarHBondContact N-O 3.36Å; M302-E317 PolarHBondContact O-N 3.33Å; E317-R345 IonicContact OE1-CZ 3.89Å; E317-R345 VanDerWaalsContact OE1-CZ 3.22Å; E317-R345 IonicContact OE1-NH1 3.56Å; E317-R345 PolarHBondContact OE1-NH1 2.93Å; E317-R345 IonicContact OE1-NH2 2.92Å; E317-R345 PolarHBondContact OE1-NH2 3.29Å
318	S	91.3	Very high	76.9	Confident	56 Å²	56	79.5 Å²	79.5	39%	0.392	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	136.6	179	-53.3	0	0	0	0	110.3	L300 H301	L300-S318 WeakPolarHBondContact O-CA 3.26Å; H301-S318 PolarHBondContact ND1-OG 2.88Å
319	V	89.9	Confident	76.5	Confident	1 Å²	1	72 Å²	72	1%	0.006	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	136.3	179.4	-62.8	0	0	0	0	111.6	L300 M302 L321 I342	L300-V319 HydrophobicContact CB-CG2 4.03Å; L300-V319 HydrophobicContact CD2-CG2 4.42Å; L300-V319 PolarHBondContact N-O 2.72Å; L300-V319 PolarHBondContact O-N 3.14Å; M302-V319 HydrophobicContact CE-CG1 4.17Å; M302-V319 HydrophobicContact CE-CG2 3.93Å; V319-L321 HydrophobicContact CG2-CD2 4.08Å; V319-I342 HydrophobicContact CB-CD1 4.16Å; V319-I342 HydrophobicContact CB-CG1 4.18Å; V319-I342 HydrophobicContact CB-CG2 4.01Å; V319-I342 HydrophobicContact CG1-CD1 3.97Å; V319-I342 HydrophobicContact CG1-CG2 4.35Å; V319-I342 HydrophobicContact CG2-CD1 4.35Å; V319-I342 HydrophobicContact CG2-CG1 4.33Å
320	T	90.6	Very high	76.2	Confident	36 Å²	36	75.5 Å²	75.5	22%	0.221	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	125.1	174.8	-47	0	0	0	0	110.3	T343 D344	T320-T343 PolarHBondContact O-N 2.83Å; T320-D344 VanDerWaalsContact CB-OD1 3.31Å; T320-D344 WeakPolarHBondContact CB-OD1 3.37Å; T320-D344 WeakPolarHBondContact CB-OD2 3.42Å; T320-D344 PolarHBondContact N-OD2 3.24Å; T320-D344 PolarHBondContact OG1-OD1 2.9Å; T320-D344 VanDerWaalsContact OG1-OD1 3.12Å; T320-D344 PolarHBondContact OG1-OD2 3.42Å
321	L	88.6	Confident	76.2	Confident	7 Å²	7	79 Å²	79	4%	0.037	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132.6	-176.2	-57.4	-169.5	0	0	0	112.2	F293 K298 L300 V319 L340 M367	F293-L321 HydrophobicContact CD2-CD1 3.94Å; F293-L321 HydrophobicContact CE2-CB 4.42Å; F293-L321 HydrophobicContact CE2-CD1 3.63Å; F293-L321 HydrophobicContact CE2-CG 4.1Å; K298-L321 PolarHBondContact O-N 2.64Å; L300-L321 HydrophobicContact CB-CD1 4.31Å; L300-L321 HydrophobicContact CB-CD2 4.35Å; L300-L321 HydrophobicContact CB-CG 4.26Å; V319-L321 HydrophobicContact CG2-CD2 4.08Å; L321-L340 HydrophobicContact CD1-CD1 4.31Å; L321-L340 HydrophobicContact CD2-CB 4.1Å; L321-L340 HydrophobicContact CD2-CD1 4.22Å; L321-M367 HydrophobicContact CD1-CB 4.37Å; L321-M367 HydrophobicContact CD1-CE 4.05Å; L321-M367 HydrophobicContact CD1-CG 3.94Å; L321-M367 HydrophobicContact CD1-SD 3.57Å; L321-M367 VanDerWaalsContact CD1-SD 3.57Å
322	K	84.5	Confident	76.3	Confident	150 Å²	150	79.6 Å²	79.6	65%	0.652	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	-49.8	171.9	-174.3	-176.8	178.2	-175.2	0	111.3	D341 T343	K322-D341 HydrophobicContact CB-CB 3.98Å; K322-D341 WeakPolarHBondContact CB-O 3.48Å; K322-D341 PolarHBondContact N-O 3.4Å; K322-T343 WeakPolarHBondContact CB-OG1 3.4Å; K322-T343 PolarHBondContact N-OG1 3.35Å
323	S	83.1	Confident	76.6	Confident	42 Å²	42	79.4 Å²	79.4	29%	0.294	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	151.6	-177.8	13.9	0	0	0	0	110.8	D341	S323-D341 WeakPolarHBondContact CB-OD2 3.44Å; S323-D341 PolarHBondContact O-N 2.92Å; S323-D341 WeakPolarHBondContact OG-CB 3.34Å; S323-D341 PolarHBondContact OG-OD2 2.76Å
324	C	85.3	Confident	77.1	Confident	5 Å²	5	78.3 Å²	78.3	3%	0.034	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.6	172.2	177	0	0	0	0	108.4	L340 M367 G369	C324-L340 HydrophobicContact CB-CD2 3.81Å; C324-L340 WeakPolarHBondContact SG-CD2 3.5Å; C324-M367 HydrophobicContact CB-CB 3.67Å; C324-M367 HydrophobicContact CB-SD 4.36Å; C324-G369 WeakPolarHBondContact O-CA 3.38Å
325	V	83	Confident	77.8	Confident	73 Å²	73	84.8 Å²	84.8	44%	0.442	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.4	-175	-173.3	0	0	0	0	109.7	E339	V325-E339 PolarHBondContact N-O 3.17Å; V325-E339 PolarHBondContact O-N 2.97Å
326	R	79.1	Confident	78.3	Confident	125 Å²	125	78.8 Å²	78.8	47%	0.472	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	129	173	177.7	178.2	-177	169.6	-0.9	109.9	M364	R326-M364 HydrophobicContact CB-CE 4.03Å; R326-M364 HydrophobicContact CB-SD 4.2Å
327	K	72.8	Confident	78.4	Confident	48 Å²	48	75 Å²	75	21%	0.209	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-90.6	131.3	171.7	-159.2	152	-175	162.5	0	109.7	L332 C337 E339 T351	K327-L332 HydrophobicContact CD-CD1 3.74Å; K327-L332 HydrophobicContact CD-CG 4.45Å; K327-C337 HydrophobicContact CB-CB 4.17Å; K327-C337 PolarHBondContact N-O 2.9Å; K327-C337 VanDerWaalsContact N-O 3.09Å; K327-E339 WeakPolarHBondContact CD-OE2 3.18Å; K327-E339 WeakPolarHBondContact CE-OE2 3.37Å; K327-E339 IonicContact NZ-OE2 3.64Å; K327-E339 PolarHBondContact NZ-OE2 2.84Å; K327-T351 HydrophobicContact CD-CG2 4.48Å
328	T	60	Low	78.4	Confident	73 Å²	73	72.6 Å²	72.6	45%	0.448	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-75.8	150	174.5	61.3	0	0	0	0	110.6	D330 M331	T328-D330 WeakPolarHBondContact CB-OD2 3.34Å; T328-D330 PolarHBondContact O-N 3.49Å; T328-D330 VanDerWaalsContact O-N 3.07Å; T328-D330 PolarHBondContact OG1-OD2 2.96Å; T328-M331 PolarHBondContact O-N 3.09Å
329	T	58.3	Low	78.2	Confident	84 Å²	84	72.6 Å²	72.6	52%	0.515	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-59.5	-19.9	-178.4	-40.3	0	0	0	0	112.6	M331 L332	T329-M331 PolarHBondContact O-N 2.8Å; T329-L332 CarbonylContact O-C 3.55Å; T329-L332 PolarHBondContact O-N 2.81Å
330	D	55.9	Low	78.2	Confident	142 Å²	142	72.6 Å²	72.6	76%	0.759	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-72.1	-12.9	-172.1	-32.2	-56.7	0	0	0	113.4	T328	T328-D330 WeakPolarHBondContact CB-OD2 3.34Å; T328-D330 PolarHBondContact O-N 3.49Å; T328-D330 VanDerWaalsContact O-N 3.07Å; T328-D330 PolarHBondContact OG1-OD2 2.96Å
331	M	59.3	Low	78	Confident	147 Å²	147	73.2 Å²	73.2	72%	0.724	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-109.5	-12.6	178.8	-63.5	-165.4	-176.8	0	0	114.6	T328 T329	T328-M331 PolarHBondContact O-N 3.09Å; T329-M331 PolarHBondContact O-N 2.8Å
332	L	62.9	Low	78	Confident	43 Å²	43	73.3 Å²	73.3	23%	0.225	36%	0.357	C	S	.	.	S	Bend	trans	-148.5	128.4	178.7	-69.3	176.1	0	0	0	108.7	K327 T329 R334 T351	K327-L332 HydrophobicContact CD-CD1 3.74Å; K327-L332 HydrophobicContact CD-CG 4.45Å; T329-L332 CarbonylContact O-C 3.55Å; T329-L332 PolarHBondContact O-N 2.81Å; L332-R334 PolarHBondContact O-N 3Å; L332-T351 HydrophobicContact CD1-CG2 3.86Å
333	D	71.9	Confident	78	Confident	165 Å²	165	69.6 Å²	69.6	88%	0.882	35%	0.347	S	S	*	.	S	Bend	trans	-72.3	50.6	177.1	-172.3	29.1	0	0	0	112.8
334	R	81	Confident	77.8	Confident	110 Å²	110	71.9 Å²	71.9	42%	0.415	36%	0.356	S	S	.	.			trans	-150.4	125.1	-177	-73.2	-169.8	171	-103	-9.9	111	W286 L332 C337	W286-R334 VanDerWaalsContact CE2-CD 3.5Å; L332-R334 PolarHBondContact O-N 3Å; R334-C337 PolarHBondContact O-SG 2.73Å
335	R	85.2	Confident	77.6	Confident	167 Å²	167	76.4 Å²	76.4	63%	0.63	37%	0.373	S	S	*	.	S	Bend	trans	-72.4	155.6	175.8	-57.5	-171.5	-63.9	174.8	0.3	111.7	C337 Q353	R335-C337 PolarHBondContact O-N 2.67Å; R335-Q353 PolarHBondContact O-NE2 2.95Å
336	F	87.9	Confident	77	Confident	47 Å²	47	78.6 Å²	78.6	21%	0.206	39%	0.389	C	S	.	.	S	Bend	trans	65.6	33.7	169.4	-40.1	-46.2	0	0	0	114.9	A354 E357 H360	F336-A354 HydrophobicContact CB-CB 4.31Å; F336-A354 PolarHBondContact O-N 3.26Å; F336-E357 HydrophobicContact CD1-CB 4.1Å; F336-E357 HydrophobicContact CD1-CG 4.4Å; F336-E357 HydrophobicContact CE1-CB 3.57Å; F336-E357 HydrophobicContact CE1-CG 4.04Å; F336-E357 HydrophobicContact CZ-CB 4.14Å; F336-H360 HydrophobicContact CB-CB 4.1Å
337	C	87.9	Confident	76.5	Confident	4 Å²	4	76.6 Å²	76.6	3%	0.027	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	131.6	179.3	-60.8	0	0	0	0	112.5	K327 R334 R335 V352	K327-C337 HydrophobicContact CB-CB 4.17Å; K327-C337 PolarHBondContact N-O 2.9Å; K327-C337 VanDerWaalsContact N-O 3.09Å; R334-C337 PolarHBondContact O-SG 2.73Å; R335-C337 PolarHBondContact O-N 2.67Å; C337-V352 CarbonylContact C-O 3.58Å; C337-V352 VanDerWaalsContact CA-O 3.28Å; C337-V352 WeakPolarHBondContact CA-O 3.42Å
338	L	88.3	Confident	76.8	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.8	171.1	-49.8	86.7	0	0	0	109.1	L340 V352 A354 W363 M364	L338-L340 HydrophobicContact CB-CD2 4.35Å; L338-V352 HydrophobicContact CB-CG2 3.83Å; L338-V352 HydrophobicContact CD1-CG2 4.13Å; L338-V352 PolarHBondContact N-O 2.98Å; L338-V352 PolarHBondContact O-N 3.49Å; L338-A354 HydrophobicContact CD1-CB 4.11Å; L338-W363 HydrophobicContact CD2-CB 3.91Å; L338-M364 HydrophobicContact CD2-CG 3.71Å; L338-M364 HydrophobicContact CD2-SD 3.86Å; L338-M364 HydrophobicContact CG-CG 4.44Å; L338-M364 HydrophobicContact CG-SD 4.41Å
339	E	87.7	Confident	77.9	Confident	56 Å²	56	76.7 Å²	76.7	26%	0.262	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.2	175.9	-169.5	158.2	119.4	0	0	109.2	V325 K327 V349	V325-E339 PolarHBondContact N-O 3.17Å; V325-E339 PolarHBondContact O-N 2.97Å; K327-E339 WeakPolarHBondContact CD-OE2 3.18Å; K327-E339 WeakPolarHBondContact CE-OE2 3.37Å; K327-E339 IonicContact NZ-OE2 3.64Å; K327-E339 PolarHBondContact NZ-OE2 2.84Å; E339-V349 VanDerWaalsContact CD-CG1 3.47Å; E339-V349 HydrophobicContact CG-CG1 3.15Å
340	L	89.5	Confident	79.3	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	118.2	-173.3	-49.7	-176.4	0	0	0	110.3	L300 L321 C324 L338 L350 V352 M367	L300-L340 HydrophobicContact CD2-CD1 3.77Å; L321-L340 HydrophobicContact CD1-CD1 4.31Å; L321-L340 HydrophobicContact CD2-CB 4.1Å; L321-L340 HydrophobicContact CD2-CD1 4.22Å; C324-L340 HydrophobicContact CB-CD2 3.81Å; C324-L340 WeakPolarHBondContact SG-CD2 3.5Å; L338-L340 HydrophobicContact CB-CD2 4.35Å; L340-L350 HydrophobicContact CB-CB 4.3Å; L340-L350 PolarHBondContact N-O 3.4Å; L340-L350 PolarHBondContact O-N 2.71Å; L340-V352 HydrophobicContact CD1-CG1 4.03Å; L340-V352 HydrophobicContact CD1-CG2 3.94Å; L340-V352 HydrophobicContact CG-CG2 4.09Å; L340-M367 HydrophobicContact CD1-CE 4.1Å; L340-M367 HydrophobicContact CD1-SD 4.08Å; L340-M367 HydrophobicContact CD2-SD 3.51Å; L340-M367 VanDerWaalsContact CD2-SD 3.51Å; L340-M367 HydrophobicContact CG-SD 4.48Å
341	D	86.1	Confident	80.8	Confident	50 Å²	50	67.6 Å²	67.6	27%	0.267	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	123.7	171.4	-69.1	-51.5	0	0	0	109.7	K322 S323	K322-D341 HydrophobicContact CB-CB 3.98Å; K322-D341 WeakPolarHBondContact CB-O 3.48Å; K322-D341 PolarHBondContact N-O 3.4Å; S323-D341 WeakPolarHBondContact CB-OD2 3.44Å; S323-D341 PolarHBondContact O-N 2.92Å; S323-D341 WeakPolarHBondContact OG-CB 3.34Å; S323-D341 PolarHBondContact OG-OD2 2.76Å
342	I	88.4	Confident	82.4	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.041	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128	-179.9	-61.1	167.2	0	0	0	110.2	V319 D344 R345 T348 L350	V319-I342 HydrophobicContact CB-CD1 4.16Å; V319-I342 HydrophobicContact CB-CG1 4.18Å; V319-I342 HydrophobicContact CB-CG2 4.01Å; V319-I342 HydrophobicContact CG1-CD1 3.97Å; V319-I342 HydrophobicContact CG1-CG2 4.35Å; V319-I342 HydrophobicContact CG2-CD1 4.35Å; V319-I342 HydrophobicContact CG2-CG1 4.33Å; I342-D344 HydrophobicContact CG2-CB 4.18Å; I342-R345 HydrophobicContact CB-CB 4.43Å; I342-R345 HydrophobicContact CG2-CB 3.98Å; I342-R345 HydrophobicContact CG2-CG 4.19Å; I342-T348 HydrophobicContact CD1-CG2 4.24Å; I342-T348 PolarHBondContact N-O 2.82Å; I342-L350 HydrophobicContact CD1-CB 4Å
343	T	84.2	Confident	83.7	Confident	72 Å²	72	59.9 Å²	59.9	44%	0.442	32%	0.321	S	S	.	.	S	Bend	trans	-68.6	-45.3	175.4	-55.9	0	0	0	0	111.3	T320 K322 R345	T320-T343 PolarHBondContact O-N 2.83Å; K322-T343 WeakPolarHBondContact CB-OG1 3.4Å; K322-T343 PolarHBondContact N-OG1 3.35Å; T343-R345 PolarHBondContact O-N 3.03Å
344	D	79.5	Confident	84.7	Confident	90 Å²	90	52.1 Å²	52.1	48%	0.481	28%	0.279	S	S	.	.	S	Bend	trans	-71.3	-12.7	-172.7	-48.3	-31	0	0	0	113.8	T320 I342	T320-D344 VanDerWaalsContact CB-OD1 3.31Å; T320-D344 WeakPolarHBondContact CB-OD1 3.37Å; T320-D344 WeakPolarHBondContact CB-OD2 3.42Å; T320-D344 PolarHBondContact N-OD2 3.24Å; T320-D344 PolarHBondContact OG1-OD1 2.9Å; T320-D344 VanDerWaalsContact OG1-OD1 3.12Å; T320-D344 PolarHBondContact OG1-OD2 3.42Å; I342-D344 HydrophobicContact CG2-CB 4.18Å
345	R	81.3	Confident	85.1	Confident	101 Å²	101	51 Å²	51	38%	0.381	28%	0.281	S	S	.	.	S	Bend	trans	-135.9	75.9	-175.7	-59.9	-175.7	-171.4	164.6	5.6	109.7	E317 I342 T343 G347 T348	E317-R345 IonicContact OE1-CZ 3.89Å; E317-R345 VanDerWaalsContact OE1-CZ 3.22Å; E317-R345 IonicContact OE1-NH1 3.56Å; E317-R345 PolarHBondContact OE1-NH1 2.93Å; E317-R345 IonicContact OE1-NH2 2.92Å; E317-R345 PolarHBondContact OE1-NH2 3.29Å; I342-R345 HydrophobicContact CB-CB 4.43Å; I342-R345 HydrophobicContact CG2-CB 3.98Å; I342-R345 HydrophobicContact CG2-CG 4.19Å; T343-R345 PolarHBondContact O-N 3.03Å; R345-G347 PolarHBondContact O-N 3.05Å; R345-T348 HydrophobicContact CB-CG2 4.42Å; R345-T348 WeakPolarHBondContact O-CB 3.11Å; R345-T348 PolarHBondContact O-N 3.28Å; R345-T348 PolarHBondContact O-OG1 2.87Å
346	P	70.1	Confident	85.2	Confident	119 Å²	119	44.6 Å²	44.6	77%	0.773	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	128.9	-175.4	-26.9	35.2	0	0	0	112.7	T348	P346-T348 VanDerWaalsContact C-N 3.27Å; P346-T348 PolarHBondContact O-N 2.97Å
347	G	69.4	Low	85	Confident	83 Å²	83	46.9 Å²	46.9	86%	0.856	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-1	-175.8	0	0	0	0	0	115.2	R345	R345-G347 PolarHBondContact O-N 3.05Å
348	T	78.3	Confident	84.8	Confident	61 Å²	61	50 Å²	50	37%	0.374	29%	0.29	S	S	.	.			trans	-91.6	120.4	170.8	-55	0	0	0	0	110.2	I342 R345 P346	I342-T348 HydrophobicContact CD1-CG2 4.24Å; I342-T348 PolarHBondContact N-O 2.82Å; R345-T348 HydrophobicContact CB-CG2 4.42Å; R345-T348 WeakPolarHBondContact O-CB 3.11Å; R345-T348 PolarHBondContact O-N 3.28Å; R345-T348 PolarHBondContact O-OG1 2.87Å; P346-T348 VanDerWaalsContact C-N 3.27Å; P346-T348 PolarHBondContact O-N 2.97Å
349	V	82.4	Confident	84.6	Confident	61 Å²	61	51.4 Å²	51.4	37%	0.37	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	125.8	177.4	175.8	0	0	0	0	108.6	E339	E339-V349 VanDerWaalsContact CD-CG1 3.47Å; E339-V349 HydrophobicContact CG-CG1 3.15Å
350	L	87.5	Confident	84.6	Confident	23 Å²	23	49 Å²	49	12%	0.12	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	117.4	178.1	-165	72.6	0	0	0	109.5	V274 M302 L340 I342 V352	V274-L350 HydrophobicContact CG1-CD1 3.62Å; V274-L350 HydrophobicContact CG1-CD2 4.07Å; V274-L350 HydrophobicContact CG1-CG 3.97Å; M302-L350 HydrophobicContact CE-CD2 3.95Å; M302-L350 HydrophobicContact SD-CD2 3.71Å; L340-L350 HydrophobicContact CB-CB 4.3Å; L340-L350 PolarHBondContact N-O 3.4Å; L340-L350 PolarHBondContact O-N 2.71Å; I342-L350 HydrophobicContact CD1-CB 4Å; L350-V352 HydrophobicContact CD2-CG1 3.95Å; L350-V352 HydrophobicContact CG-CG1 4.04Å
351	T	88.9	Confident	84.4	Confident	13 Å²	13	53.3 Å²	53.3	8%	0.08	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.1	171.1	-54.5	0	0	0	0	109.1	Q275 W286 K327 L332	Q275-T351 WeakPolarHBondContact CB-O 3.31Å; Q275-T351 PolarHBondContact N-O 3.1Å; W286-T351 HydrophobicContact CH2-CG2 3.82Å; K327-T351 HydrophobicContact CD-CG2 4.48Å; L332-T351 HydrophobicContact CD1-CG2 3.86Å
352	V	91.5	Very high	84.3	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	152.9	178.5	-57.3	0	0	0	0	110.6	L272 Y273 V274 C337 L338 L340 L350	L272-V352 HydrophobicContact CD1-CB 4.34Å; L272-V352 HydrophobicContact CD1-CG2 4.18Å; Y273-V352 CarbonylContact O-C 3.53Å; Y273-V352 VanDerWaalsContact O-CA 3.26Å; Y273-V352 WeakPolarHBondContact O-CA 3.49Å; V274-V352 HydrophobicContact CG1-CG1 4.47Å; V274-V352 HydrophobicContact CG2-CG1 4.15Å; C337-V352 CarbonylContact C-O 3.58Å; C337-V352 VanDerWaalsContact CA-O 3.28Å; C337-V352 WeakPolarHBondContact CA-O 3.42Å; L338-V352 HydrophobicContact CB-CG2 3.83Å; L338-V352 HydrophobicContact CD1-CG2 4.13Å; L338-V352 PolarHBondContact N-O 2.98Å; L338-V352 PolarHBondContact O-N 3.49Å; L340-V352 HydrophobicContact CD1-CG1 4.03Å; L340-V352 HydrophobicContact CD1-CG2 3.94Å; L340-V352 HydrophobicContact CG-CG2 4.09Å; L350-V352 HydrophobicContact CD2-CG1 3.95Å; L350-V352 HydrophobicContact CG-CG1 4.04Å
353	Q	91.4	Very high	84.3	Confident	26 Å²	26	53.1 Å²	53.1	12%	0.121	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.1	179.2	168.2	173.1	43.9	0	0	109.7	Y273 W286 R335	Y273-Q353 PolarHBondContact N-O 2.98Å; Y273-Q353 PolarHBondContact O-N 2.76Å; W286-Q353 HydrophobicContact CE3-CB 4.12Å; W286-Q353 HydrophobicContact CH2-CB 4.19Å; W286-Q353 HydrophobicContact CZ3-CB 3.58Å; R335-Q353 PolarHBondContact O-NE2 2.95Å
354	A	91.5	Very high	84.4	Confident	2 Å²	2	50 Å²	50	2%	0.017	28%	0.284	C	S	.	.			trans	-80.1	160	172.3	0	0	0	0	0	111.6	L272 F336 L338 D359 H360	L272-A354 HydrophobicContact CD2-CB 4.09Å; F336-A354 HydrophobicContact CB-CB 4.31Å; F336-A354 PolarHBondContact O-N 3.26Å; L338-A354 HydrophobicContact CD1-CB 4.11Å; A354-D359 HydrophobicContact CB-CB 4.25Å; A354-H360 HydrophobicContact CB-CB 3.96Å
355	L	89.9	Confident	84.6	Confident	87 Å²	87	53.2 Å²	53.2	46%	0.455	30%	0.296	S	S	.	.	S	Bend	trans	-76.3	-28.9	-175.1	-57.3	-176.4	0	0	0	113.6	Y273	Y273-L355 HydrophobicContact CD2-CD2 3.93Å; Y273-L355 HydrophobicContact CE2-CD2 3.64Å
356	S	87.1	Confident	84.7	Confident	33 Å²	33	49.2 Å²	49.2	23%	0.231	28%	0.284	C	S	.	.	S	Bend	trans	-145.6	170.2	-177.1	70.6	0	0	0	0	111.5	D358 D359 H360	S356-D358 VanDerWaalsContact C-N 3.32Å; S356-D359 WeakPolarHBondContact CB-OD2 3.39Å; S356-D359 PolarHBondContact O-N 2.9Å; S356-D359 PolarHBondContact OG-N 3.01Å; S356-D359 VanDerWaalsContact OG-N 3.08Å; S356-D359 PolarHBondContact OG-OD2 2.91Å; S356-H360 WeakPolarHBondContact O-CB 3.48Å; S356-H360 PolarHBondContact O-N 3.44Å
357	E	85.1	Confident	85.6	Confident	95 Å²	95	44.4 Å²	44.4	44%	0.444	25%	0.252	S	S	.	.	H	α-helix	trans	-65.5	-36.9	174.3	-161.4	-174.4	140.6	0	0	112.1	F336 H360 K361	F336-E357 HydrophobicContact CD1-CB 4.1Å; F336-E357 HydrophobicContact CD1-CG 4.4Å; F336-E357 HydrophobicContact CE1-CB 3.57Å; F336-E357 HydrophobicContact CE1-CG 4.04Å; F336-E357 HydrophobicContact CZ-CB 4.14Å; E357-H360 WeakPolarHBondContact O-CB 3.26Å; E357-H360 PolarHBondContact O-N 3.47Å; E357-K361 WeakPolarHBondContact O-CG 3.38Å; E357-K361 PolarHBondContact O-N 2.87Å; E357-K361 WeakPolarHBondContact OE1-CE 3.41Å; E357-K361 IonicContact OE1-NZ 2.79Å; E357-K361 PolarHBondContact OE1-NZ 2.74Å
358	D	82.2	Confident	86	Confident	68 Å²	68	43.3 Å²	43.3	36%	0.364	24%	0.241	S	C	.	.	H	α-helix	trans	-65	-46.8	176.1	-66.3	-16.9	0	0	0	110.7	S356 H360 K361 L362	S356-D358 VanDerWaalsContact C-N 3.32Å; D358-H360 VanDerWaalsContact C-N 3.29Å; D358-H360 PolarHBondContact O-N 3.4Å; D358-K361 PolarHBondContact O-N 3.04Å; D358-K361 VanDerWaalsContact O-N 3.17Å; D358-L362 WeakPolarHBondContact O-CG 3.21Å; D358-L362 PolarHBondContact O-N 2.8Å
359	D	85.3	Confident	85.8	Confident	30 Å²	30	41.5 Å²	41.5	16%	0.16	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-37	178	-56.5	-38.2	0	0	0	110.9	R261 A354 S356 L362 W363	R261-D359 IonicContact CZ-OD1 3.65Å; R261-D359 IonicContact NH1-OD1 2.86Å; R261-D359 PolarHBondContact NH1-OD1 3.27Å; A354-D359 HydrophobicContact CB-CB 4.25Å; S356-D359 WeakPolarHBondContact CB-OD2 3.39Å; S356-D359 PolarHBondContact O-N 2.9Å; S356-D359 PolarHBondContact OG-N 3.01Å; S356-D359 VanDerWaalsContact OG-N 3.08Å; S356-D359 PolarHBondContact OG-OD2 2.91Å; D359-L362 PolarHBondContact O-N 3.31Å; D359-W363 WeakPolarHBondContact O-CB 3.41Å; D359-W363 PolarHBondContact O-N 3.32Å
360	H	87.3	Confident	84.9	Confident	7 Å²	7	47.5 Å²	47.5	3%	0.032	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-45.5	172.5	171.1	-82.2	0	0	0	112	F336 A354 S356 E357 D358 W363 M364	F336-H360 HydrophobicContact CB-CB 4.1Å; A354-H360 HydrophobicContact CB-CB 3.96Å; S356-H360 WeakPolarHBondContact O-CB 3.48Å; S356-H360 PolarHBondContact O-N 3.44Å; E357-H360 WeakPolarHBondContact O-CB 3.26Å; E357-H360 PolarHBondContact O-N 3.47Å; D358-H360 VanDerWaalsContact C-N 3.29Å; D358-H360 PolarHBondContact O-N 3.4Å; H360-W363 PolarHBondContact O-N 3.24Å; H360-M364 VanDerWaalsContact O-CB 3.31Å; H360-M364 WeakPolarHBondContact O-CB 3.4Å; H360-M364 VanDerWaalsContact O-CG 3.3Å; H360-M364 WeakPolarHBondContact O-CG 3.43Å; H360-M364 PolarHBondContact O-N 3.05Å
361	K	84.8	Confident	83.2	Confident	90 Å²	90	51.4 Å²	51.4	39%	0.391	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.9	-72.6	166.7	-175.3	162.9	0	111.5	E357 D358 M364 H365	E357-K361 WeakPolarHBondContact O-CG 3.38Å; E357-K361 PolarHBondContact O-N 2.87Å; E357-K361 WeakPolarHBondContact OE1-CE 3.41Å; E357-K361 IonicContact OE1-NZ 2.79Å; E357-K361 PolarHBondContact OE1-NZ 2.74Å; D358-K361 PolarHBondContact O-N 3.04Å; D358-K361 VanDerWaalsContact O-N 3.17Å; K361-M364 PolarHBondContact O-N 2.92Å; K361-H365 VanDerWaalsContact O-CB 3.31Å; K361-H365 WeakPolarHBondContact O-CB 3.49Å; K361-H365 PolarHBondContact O-N 3.33Å
362	L	84.4	Confident	80.8	Confident	48 Å²	48	56.1 Å²	56.1	25%	0.251	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-44.5	177.4	-68.9	170	0	0	0	112.3	F268 D358 D359 H365 A366	F268-L362 HydrophobicContact CE1-CB 4.14Å; F268-L362 HydrophobicContact CE2-CB 4.12Å; F268-L362 HydrophobicContact CZ-CB 3.54Å; F268-L362 HydrophobicContact CZ-CD1 4.2Å; F268-L362 HydrophobicContact CZ-CG 4.42Å; D358-L362 WeakPolarHBondContact O-CG 3.21Å; D358-L362 PolarHBondContact O-N 2.8Å; D359-L362 PolarHBondContact O-N 3.31Å; L362-H365 PolarHBondContact O-N 3.15Å; L362-A366 VanDerWaalsContact O-CB 3.26Å; L362-A366 WeakPolarHBondContact O-CB 3.46Å; L362-A366 PolarHBondContact O-N 2.97Å
363	W	87.8	Confident	78.2	Confident	5 Å²	5	64.8 Å²	64.8	2%	0.019	35%	0.348	C	S	.	.	H	α-helix	trans	-64.8	-43.7	175.1	-81.6	114.2	0	0	0	112.3	F268 L272 C291 F293 L300 L338 D359 H360 H365 A366 M367	F268-W363 AromaticContact CD1-CD2 3.73Å; F268-W363 HydrophobicContact CD1-CD2 3.73Å; F268-W363 AromaticContact CD1-CE2 3.97Å; F268-W363 AromaticContact CD1-CE3 3.58Å; F268-W363 HydrophobicContact CD1-CE3 3.58Å; F268-W363 HydrophobicContact CD1-CG 4.4Å; F268-W363 HydrophobicContact CD1-CH2 4.01Å; F268-W363 HydrophobicContact CD1-CZ2 4.12Å; F268-W363 AromaticContact CD1-CZ3 3.74Å; F268-W363 HydrophobicContact CD1-CZ3 3.74Å; F268-W363 AromaticContact CE1-CD2 3.59Å; F268-W363 HydrophobicContact CE1-CD2 3.59Å; F268-W363 AromaticContact CE1-CE2 3.66Å; F268-W363 AromaticContact CE1-CE3 3.98Å; F268-W363 HydrophobicContact CE1-CE3 3.98Å; F268-W363 AromaticContact CE1-CG 3.9Å; F268-W363 HydrophobicContact CE1-CG 3.9Å; F268-W363 HydrophobicContact CE1-CH2 4.47Å; F268-W363 HydrophobicContact CE1-CZ2 4.12Å; F268-W363 HydrophobicContact CE1-CZ3 4.4Å; F268-W363 AromaticContact CE1-NE1 3.91Å; L272-W363 HydrophobicContact CD1-CD2 4.12Å; L272-W363 HydrophobicContact CD1-CE3 4.37Å; L272-W363 HydrophobicContact CD1-CH2 4.29Å; L272-W363 HydrophobicContact CD1-CZ2 4.03Å; L272-W363 HydrophobicContact CD1-CZ3 4.45Å; L272-W363 HydrophobicContact CD2-CD2 4.26Å; L272-W363 HydrophobicContact CD2-CG 4.14Å; L272-W363 HydrophobicContact CG-CD2 4.4Å; L272-W363 HydrophobicContact CG-CZ2 3.98Å; C291-W363 HydrophobicContact CB-CH2 3.76Å; C291-W363 HydrophobicContact CB-CZ2 4.06Å; F293-W363 HydrophobicContact CB-CZ3 3.81Å; L300-W363 HydrophobicContact CD1-CH2 4.41Å; L300-W363 HydrophobicContact CD1-CZ3 4.11Å; L338-W363 HydrophobicContact CD2-CB 3.91Å; D359-W363 WeakPolarHBondContact O-CB 3.41Å; D359-W363 PolarHBondContact O-N 3.32Å; H360-W363 PolarHBondContact O-N 3.24Å; W363-H365 PolarHBondContact O-N 2.98Å; W363-A366 PolarHBondContact O-N 3.22Å; W363-M367 HydrophobicContact CD2-CE 4.3Å; W363-M367 HydrophobicContact CE3-CE 3.33Å; W363-M367 HydrophobicContact CE3-CG 4.43Å; W363-M367 HydrophobicContact CE3-SD 4.43Å; W363-M367 HydrophobicContact CZ3-CE 3.57Å; W363-M367 WeakPolarHBondContact O-CB 3.33Å; W363-M367 WeakPolarHBondContact O-CG 3.47Å; W363-M367 PolarHBondContact O-N 3.38Å
364	M	86.1	Confident	75.6	Confident	8 Å²	8	66 Å²	66	4%	0.039	37%	0.367	C	S	.	.	H	α-helix	trans	-57.3	-48.1	173.3	-81.9	-69.5	-65.8	0	0	111.4	R326 L338 H360 K361 G368 G369	R326-M364 HydrophobicContact CB-CE 4.03Å; R326-M364 HydrophobicContact CB-SD 4.2Å; L338-M364 HydrophobicContact CD2-CG 3.71Å; L338-M364 HydrophobicContact CD2-SD 3.86Å; L338-M364 HydrophobicContact CG-CG 4.44Å; L338-M364 HydrophobicContact CG-SD 4.41Å; H360-M364 VanDerWaalsContact O-CB 3.31Å; H360-M364 WeakPolarHBondContact O-CB 3.4Å; H360-M364 VanDerWaalsContact O-CG 3.3Å; H360-M364 WeakPolarHBondContact O-CG 3.43Å; H360-M364 PolarHBondContact O-N 3.05Å; K361-M364 PolarHBondContact O-N 2.92Å; M364-G368 PolarHBondContact O-N 2.78Å; M364-G369 PolarHBondContact O-N 2.66Å
365	H	83.9	Confident	72.7	Confident	156 Å²	156	70.8 Å²	70.8	72%	0.722	40%	0.4	S	S	*	.	H	α-helix	trans	-64.1	-47.7	178.7	-179.8	-87.5	0	0	0	111.8	K361 L362 W363 M367 G368	K361-H365 VanDerWaalsContact O-CB 3.31Å; K361-H365 WeakPolarHBondContact O-CB 3.49Å; K361-H365 PolarHBondContact O-N 3.33Å; L362-H365 PolarHBondContact O-N 3.15Å; W363-H365 PolarHBondContact O-N 2.98Å; H365-M367 PolarHBondContact O-N 3.49Å; H365-G368 PolarHBondContact O-N 2.96Å
366	A	84.6	Confident	70	Confident	17 Å²	17	77.5 Å²	77.5	14%	0.14	42%	0.421	C	S	.	.	H	α-helix	trans	-60.8	-43.4	179.9	0	0	0	0	0	112.3	F268 F293 L362 W363 G368	F268-A366 HydrophobicContact CB-CB 3.76Å; F268-A366 HydrophobicContact CD1-CB 3.99Å; F268-A366 HydrophobicContact CG-CB 3.86Å; F293-A366 WeakPolarHBondContact CE1-O 3.45Å; L362-A366 VanDerWaalsContact O-CB 3.26Å; L362-A366 WeakPolarHBondContact O-CB 3.46Å; L362-A366 PolarHBondContact O-N 2.97Å; W363-A366 PolarHBondContact O-N 3.22Å; A366-G368 VanDerWaalsContact C-N 3.28Å; A366-G368 PolarHBondContact O-N 3.41Å
367	M	87.9	Confident	67.5	Low	18 Å²	18	84.9 Å²	84.9	9%	0.089	46%	0.456	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	1.8	-179.8	-62.2	-177.2	177.9	0	0	114.1	L272 F293 L300 L321 C324 L340 W363 H365	L272-M367 HydrophobicContact CD1-CE 4.37Å; F293-M367 HydrophobicContact CD1-CG 4.31Å; F293-M367 HydrophobicContact CD2-CG 4.27Å; F293-M367 HydrophobicContact CE1-CG 4.35Å; F293-M367 HydrophobicContact CE2-CG 4.29Å; F293-M367 HydrophobicContact CG-CG 4.27Å; F293-M367 HydrophobicContact CZ-CB 4.48Å; F293-M367 HydrophobicContact CZ-CG 4.32Å; L300-M367 HydrophobicContact CD1-CE 3.72Å; L300-M367 HydrophobicContact CD2-CE 4.06Å; L300-M367 HydrophobicContact CG-CE 4.47Å; L321-M367 HydrophobicContact CD1-CB 4.37Å; L321-M367 HydrophobicContact CD1-CE 4.05Å; L321-M367 HydrophobicContact CD1-CG 3.94Å; L321-M367 HydrophobicContact CD1-SD 3.57Å; L321-M367 VanDerWaalsContact CD1-SD 3.57Å; C324-M367 HydrophobicContact CB-CB 3.67Å; C324-M367 HydrophobicContact CB-SD 4.36Å; L340-M367 HydrophobicContact CD1-CE 4.1Å; L340-M367 HydrophobicContact CD1-SD 4.08Å; L340-M367 HydrophobicContact CD2-SD 3.51Å; L340-M367 VanDerWaalsContact CD2-SD 3.51Å; L340-M367 HydrophobicContact CG-SD 4.48Å; W363-M367 HydrophobicContact CD2-CE 4.3Å; W363-M367 HydrophobicContact CE3-CE 3.33Å; W363-M367 HydrophobicContact CE3-CG 4.43Å; W363-M367 HydrophobicContact CE3-SD 4.43Å; W363-M367 HydrophobicContact CZ3-CE 3.57Å; W363-M367 WeakPolarHBondContact O-CB 3.33Å; W363-M367 WeakPolarHBondContact O-CG 3.47Å; W363-M367 PolarHBondContact O-N 3.38Å; H365-M367 PolarHBondContact O-N 3.49Å
368	G	77.4	Confident	64.9	Low	61 Å²	61	83.6 Å²	83.6	63%	0.629	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	32.7	178.1	0	0	0	0	0	114.7	M364 H365 A366	M364-G368 PolarHBondContact O-N 2.78Å; H365-G368 PolarHBondContact O-N 2.96Å; A366-G368 VanDerWaalsContact C-N 3.28Å; A366-G368 PolarHBondContact O-N 3.41Å
369	G	74.7	Confident	62.4	Low	22 Å²	22	91.8 Å²	91.8	23%	0.227	49%	0.494	C	S	.	.	P	Polyproline II helix	trans	-71.3	157.8	176.9	0	0	0	0	0	113.6	C324 M364	C324-G369 WeakPolarHBondContact O-CA 3.38Å; M364-G369 PolarHBondContact O-N 2.66Å
370	K	62.8	Low	59.6	Low	187 Å²	187	96.1 Å²	96.1	81%	0.813	52%	0.522	S	S	*	.	B	Isolated β-bridge	trans	-103.7	130.7	-178.9	-64.7	-179.2	179.8	179.3	0	111.5
371	E	53.5	Low	57	Low	106 Å²	106	103.7 Å²	103.7	50%	0.495	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-93	154.8	170.9	-65.7	-167.7	132.4	0	0	112.1
372	P	38.4	Very low	54.3	Low	111 Å²	111	104.2 Å²	104.2	72%	0.721	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-64.7	128.3	151.9	-7.7	24.8	0	0	0	108.5	G374	P372-G374 PolarHBondContact O-N 3.37Å
373	I	36.8	Very low	51.9	Low	183 Å²	183	111 Å²	111	94%	0.938	60%	0.604	S	S	*	*	S	Bend	trans	-58.2	116.4	-168.8	-62.1	162.9	0	0	0	112.1
374	G	35.4	Very low	49.2	Very low	52 Å²	52	118.7 Å²	118.7	54%	0.536	64%	0.641	S	S	.	*			trans	169.2	110	167.1	0	0	0	0	0	115.3	P372	P372-G374 PolarHBondContact O-N 3.37Å
375	C	31.6	Very low	47	Very low	103 Å²	103	130.5 Å²	130.5	70%	0.696	69%	0.685	S	S	*	*	S	Bend	trans	61.8	108.8	169	-54.3	0	0	0	0	115.5
376	Y	32.2	Very low	45.5	Very low	228 Å²	228	125.9 Å²	125.9	89%	0.894	68%	0.679	S	S	*	*				-161.8	103.9	59	-85.3	-86.3	0	0	0	110.9
377	L	35.9	Very low	44.4	Very low	187 Å²	187	126.2 Å²	126.2	98%	0.979	68%	0.679	S	S	*	*			trans	-96.6	144.8	163.7	-96.9	164.9	0	0	0	109.5
378	G	30.9	Very low	43.6	Very low	68 Å²	68	130.2 Å²	130.2	70%	0.701	70%	0.7	S	S	*	*			trans	97.9	56.3	165.3	0	0	0	0	0	116.6
379	R	27.9	Very low	43.7	Very low	240 Å²	240	127.4 Å²	127.4	91%	0.906	67%	0.671	S	S	*	*			trans	-101.9	77.3	135.1	-159.4	177	-69.5	-159.6	2.1	107.4	L381	R379-L381 PolarHBondContact O-N 3.26Å
380	T	26.6	Very low	44.2	Very low	121 Å²	121	130.9 Å²	130.9	74%	0.742	68%	0.681	S	S	*	*			trans	-47.8	140.5	158.3	33.9	0	0	0	0	107.5	S382	T380-S382 PolarHBondContact O-N 3.47Å
381	L	32.6	Very low	45.4	Very low	167 Å²	167	123.8 Å²	123.8	87%	0.874	65%	0.652	S	S	*	*			trans	-48.3	118.8	167.3	-79.9	80.5	0	0	0	106.6	R379 K383	R379-L381 PolarHBondContact O-N 3.26Å; L381-K383 PolarHBondContact O-N 3.48Å
382	S	29.1	Very low	47.1	Very low	100 Å²	100	121.7 Å²	121.7	70%	0.699	64%	0.644	S	S	*	*			trans	-59.3	102.3	152.6	45.7	0	0	0	0	104.5	T380 E384	T380-S382 PolarHBondContact O-N 3.47Å; S382-E384 PolarHBondContact O-N 3.4Å
383	K	33.1	Very low	49.4	Very low	190 Å²	190	121.2 Å²	121.2	83%	0.826	64%	0.636	S	S	*	*			trans	-48.4	104.2	141.3	-99.3	-170	170.8	-169.3	0	103.4	L381	L381-K383 PolarHBondContact O-N 3.48Å
384	E	32.5	Very low	51.8	Low	168 Å²	168	114.4 Å²	114.4	79%	0.785	60%	0.6	S	S	*	*			trans	-47.5	155.5	155.3	-68.7	-168.5	125.1	0	0	106.8	S382 G386	S382-E384 PolarHBondContact O-N 3.4Å; E384-G386 PolarHBondContact O-N 2.8Å
385	R	38.4	Very low	54.3	Low	255 Å²	255	112 Å²	112	96%	0.962	58%	0.575	S	S	*	*	S	Bend	trans	-72.3	58.7	170.1	-69.1	-178.3	176.1	-169.8	-1.3	109.6
386	G	53	Low	57.1	Low	59 Å²	59	108 Å²	108	61%	0.608	55%	0.547	S	S	*	.			trans	-66.1	136.5	166.4	0	0	0	0	0	108.1	E384 D388	E384-G386 PolarHBondContact O-N 2.8Å; G386-D388 PolarHBondContact O-N 2.95Å
387	I	62.3	Low	59.9	Low	25 Å²	25	99 Å²	99	13%	0.128	52%	0.517	C	S	.	.			trans	-63.1	128.2	175.2	-68.4	170.7	0	0	0	107.7	A389 L430 I434	I387-A389 HydrophobicContact CG2-CB 4.37Å; I387-A389 PolarHBondContact O-N 3.16Å; I387-L430 HydrophobicContact CD1-CB 3.86Å; I387-L430 HydrophobicContact CD1-CD2 3.67Å; I387-L430 HydrophobicContact CD1-CG 3.74Å; I387-L430 HydrophobicContact CG2-CD2 4.36Å; I387-L430 HydrophobicContact CG2-CG 4.15Å; I387-I434 HydrophobicContact CG2-CD1 3.44Å; I387-I434 VanDerWaalsContact CG2-CD1 3.44Å
388	D	70.7	Confident	62.5	Low	102 Å²	102	90.1 Å²	90.1	55%	0.545	47%	0.471	S	S	.	.			trans	-76.1	65.2	179.3	-161.5	-2.8	0	0	0	109.9	G386 Q390	G386-D388 PolarHBondContact O-N 2.95Å; D388-Q390 PolarHBondContact O-N 3.41Å; D388-Q390 PolarHBondContact OD1-NE2 2.85Å
389	A	79.9	Confident	65.5	Low	1 Å²	1	86.9 Å²	86.9	1%	0.008	44%	0.438	C	S	.	.			trans	-75.2	109.7	-177	0	0	0	0	0	109.7	I387 I434 Y461 L465 P466	I387-A389 HydrophobicContact CG2-CB 4.37Å; I387-A389 PolarHBondContact O-N 3.16Å; A389-I434 HydrophobicContact CB-CD1 4.13Å; A389-Y461 HydrophobicContact CB-CD2 3.84Å; A389-Y461 HydrophobicContact CB-CE2 4.05Å; A389-L465 HydrophobicContact CB-CD2 4.47Å; A389-P466 WeakPolarHBondContact O-CD 3.26Å
390	Q	85.4	Confident	68.6	Low	96 Å²	96	80.1 Å²	80.1	45%	0.449	42%	0.415	S	S	.	.			trans	-110	153.7	176.9	-58.4	-163.3	23.7	0	0	111.4	D388 D392 Y461	D388-Q390 PolarHBondContact O-N 3.41Å; D388-Q390 PolarHBondContact OD1-NE2 2.85Å; Q390-D392 HydrophobicContact CB-CB 4.5Å; Q390-D392 PolarHBondContact O-N 2.97Å; Q390-Y461 PolarHBondContact O-OH 2.97Å; Q390-Y461 VanDerWaalsContact O-OH 3.1Å
391	L	87.4	Confident	71.7	Confident	37 Å²	37	77.5 Å²	77.5	19%	0.194	39%	0.393	C	S	.	.	S	Bend	trans	-84.3	54.3	176.9	-157.7	74.3	0	0	0	110.5	L465 L469 R504 N505 V508	L391-L465 HydrophobicContact CB-CD2 4.4Å; L391-L465 HydrophobicContact CD1-CD1 4.15Å; L391-L465 HydrophobicContact CD1-CD2 4.32Å; L391-L469 HydrophobicContact CD1-CD1 4.03Å; L391-L469 HydrophobicContact CD2-CD1 4.14Å; L391-R504 HydrophobicContact CD2-CB 3.87Å; L391-R504 HydrophobicContact CG-CB 4.31Å; L391-R504 WeakPolarHBondContact O-CD 3.22Å; L391-N505 HydrophobicContact CD2-CB 4.29Å; L391-N505 VanDerWaalsContact CD2-OD1 3.23Å; L391-N505 WeakPolarHBondContact CD2-OD1 2.91Å; L391-V508 HydrophobicContact CD1-CB 4.31Å; L391-V508 HydrophobicContact CD1-CG1 4.31Å; L391-V508 HydrophobicContact CD1-CG2 3.96Å
392	D	88.6	Confident	74.6	Confident	62 Å²	62	69.5 Å²	69.5	33%	0.332	35%	0.351	S	S	.	.	S	Bend	trans	-100.9	-167.6	-179	65.2	21.7	0	0	0	111.6	Q390 M394 G395 L396	Q390-D392 HydrophobicContact CB-CB 4.5Å; Q390-D392 PolarHBondContact O-N 2.97Å; D392-M394 WeakPolarHBondContact OD1-CA 3.22Å; D392-M394 WeakPolarHBondContact OD1-CB 3.42Å; D392-M394 PolarHBondContact OD1-N 3.22Å; D392-G395 PolarHBondContact OD1-N 2.91Å; D392-L396 WeakPolarHBondContact O-CB 3.47Å; D392-L396 PolarHBondContact O-N 3.06Å
393	D	87.3	Confident	77.8	Confident	102 Å²	102	65.5 Å²	65.5	55%	0.545	32%	0.322	S	S	.	.	H	α-helix	trans	-75.2	-24.4	-178.4	-60.9	-40.5	0	0	0	112.8	S397 R504	D393-S397 VanDerWaalsContact O-CB 3.27Å; D393-S397 WeakPolarHBondContact O-CB 3.44Å; D393-S397 PolarHBondContact O-N 3.48Å; D393-R504 IonicContact OD1-CZ 3.98Å; D393-R504 IonicContact OD1-NE 2.88Å; D393-R504 IonicContact OD1-NH2 2.66Å; D393-R504 PolarHBondContact OD1-NH2 3.37Å; D393-R504 IonicContact OD2-NH2 3.65Å; D393-R504 PolarHBondContact OD2-NH2 3.45Å
394	M	86.7	Confident	80.7	Confident	39 Å²	39	59.9 Å²	59.9	19%	0.192	30%	0.304	C	S	.	.	H	α-helix	trans	-72	-47	171.5	-70.1	-60.4	-66.9	0	0	110.6	D392 L396 S397 F398	D392-M394 WeakPolarHBondContact OD1-CA 3.22Å; D392-M394 WeakPolarHBondContact OD1-CB 3.42Å; D392-M394 PolarHBondContact OD1-N 3.22Å; M394-L396 VanDerWaalsContact C-N 3.34Å; M394-L396 PolarHBondContact O-N 2.98Å; M394-S397 WeakPolarHBondContact O-CB 3.3Å; M394-S397 PolarHBondContact O-N 3.34Å; M394-S397 VanDerWaalsContact O-N 3.14Å; M394-F398 PolarHBondContact O-N 2.93Å
395	G	88.5	Confident	83.5	Confident	1 Å²	1	52 Å²	52	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-58.9	-42.2	172.8	0	0	0	0	0	112.8	D392 F398 V399 Y461	D392-G395 PolarHBondContact OD1-N 2.91Å; G395-F398 PolarHBondContact O-N 2.73Å; G395-V399 WeakPolarHBondContact O-CG2 3.48Å; G395-V399 PolarHBondContact O-N 2.86Å; G395-Y461 WeakPolarHBondContact CA-OH 3.34Å
396	L	90.8	Very high	86.2	Confident	19 Å²	19	39.9 Å²	39.9	10%	0.099	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-39	173.3	-179.3	62.6	0	0	0	112.5	D392 M394 K400 L507 V508 L511	D392-L396 WeakPolarHBondContact O-CB 3.47Å; D392-L396 PolarHBondContact O-N 3.06Å; M394-L396 VanDerWaalsContact C-N 3.34Å; M394-L396 PolarHBondContact O-N 2.98Å; L396-K400 HydrophobicContact CG-CD 4.41Å; L396-K400 WeakPolarHBondContact O-CG 3.31Å; L396-K400 PolarHBondContact O-N 2.8Å; L396-K400 VanDerWaalsContact O-N 3.12Å; L396-L507 HydrophobicContact CD1-CD2 4.28Å; L396-L507 HydrophobicContact CD2-CD2 4.03Å; L396-V508 HydrophobicContact CD1-CG2 3.74Å; L396-L511 HydrophobicContact CD1-CD1 3.82Å
397	S	89.6	Confident	88.2	Confident	39 Å²	39	40 Å²	40	27%	0.273	21%	0.206	S	C	.	.	H	α-helix	trans	-63.1	-45.6	174.3	-174.7	0	0	0	0	111.4	D393 M394 V399 K400 K401	D393-S397 VanDerWaalsContact O-CB 3.27Å; D393-S397 WeakPolarHBondContact O-CB 3.44Å; D393-S397 PolarHBondContact O-N 3.48Å; M394-S397 WeakPolarHBondContact O-CB 3.3Å; M394-S397 PolarHBondContact O-N 3.34Å; M394-S397 VanDerWaalsContact O-N 3.14Å; S397-V399 PolarHBondContact O-N 2.75Å; S397-K400 PolarHBondContact O-N 2.91Å; S397-K401 WeakPolarHBondContact O-CB 3.31Å; S397-K401 WeakPolarHBondContact O-CG 3.49Å; S397-K401 PolarHBondContact O-N 3.36Å
398	F	91.1	Very high	89.5	Confident	1 Å²	1	43.5 Å²	43.5	0%	0.004	23%	0.229	C	C	.	.	H	α-helix	trans	-59.6	-45.7	176.2	173	-114.4	0	0	0	112.6	M394 G395 S402 L430 M433 L443 A457 L458 Y461	M394-F398 PolarHBondContact O-N 2.93Å; G395-F398 PolarHBondContact O-N 2.73Å; F398-S402 WeakPolarHBondContact CE2-OG 3.37Å; F398-S402 VanDerWaalsContact O-CB 3.26Å; F398-S402 WeakPolarHBondContact O-CB 3.37Å; F398-S402 PolarHBondContact O-N 2.78Å; F398-S402 PolarHBondContact O-OG 2.86Å; F398-L430 HydrophobicContact CD1-CD1 4.19Å; F398-L430 HydrophobicContact CE1-CD1 3.68Å; F398-L430 HydrophobicContact CZ-CD1 3.91Å; F398-M433 HydrophobicContact CB-CB 4.28Å; F398-M433 HydrophobicContact CB-CE 4.46Å; F398-M433 HydrophobicContact CD2-CB 3.38Å; F398-M433 HydrophobicContact CD2-CE 3.78Å; F398-M433 HydrophobicContact CD2-CG 3.51Å; F398-M433 HydrophobicContact CD2-SD 4.45Å; F398-M433 HydrophobicContact CE2-CB 3.94Å; F398-M433 HydrophobicContact CE2-CG 3.78Å; F398-M433 HydrophobicContact CG-CB 3.98Å; F398-L443 HydrophobicContact CE2-CD1 4.45Å; F398-A457 HydrophobicContact CZ-CB 3.98Å; F398-L458 HydrophobicContact CE1-CD1 4.32Å; F398-Y461 HydrophobicContact CD1-CD1 4.02Å; F398-Y461 HydrophobicContact CD1-CD2 4.18Å; F398-Y461 AromaticContact CD1-CG 3.8Å; F398-Y461 HydrophobicContact CD1-CG 3.8Å; F398-Y461 HydrophobicContact CE1-CD1 4.23Å; F398-Y461 AromaticContact CE1-CG 3.86Å; F398-Y461 HydrophobicContact CE1-CG 3.86Å
399	V	93.9	Very high	90.4	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-48.7	176	171.4	0	0	0	0	110.9	G395 S397 S402 I403 L458 Y461 V508	G395-V399 WeakPolarHBondContact O-CG2 3.48Å; G395-V399 PolarHBondContact O-N 2.86Å; S397-V399 PolarHBondContact O-N 2.75Å; V399-S402 PolarHBondContact O-N 2.99Å; V399-I403 HydrophobicContact CG1-CD1 3.74Å; V399-I403 WeakPolarHBondContact O-CB 3.42Å; V399-I403 WeakPolarHBondContact O-CG1 3.47Å; V399-I403 PolarHBondContact O-N 2.86Å; V399-L458 HydrophobicContact CB-CD1 4.35Å; V399-L458 HydrophobicContact CG1-CD1 4.42Å; V399-L458 HydrophobicContact CG2-CD1 3.87Å; V399-Y461 HydrophobicContact CG2-CD1 3.88Å; V399-Y461 HydrophobicContact CG2-CE1 3.45Å; V399-Y461 VanDerWaalsContact CG2-CE1 3.45Å; V399-V508 HydrophobicContact CG1-CG1 4.45Å; V399-V508 HydrophobicContact CG2-CG1 4.25Å
400	K	93.4	Very high	90.8	Very high	98 Å²	98	44 Å²	44	43%	0.426	23%	0.225	S	C	.	.	H	α-helix	trans	-61.6	-51.9	179.2	-73.1	172.1	179.9	173.7	0	112	L396 S397 S402 I403 T404 L511	L396-K400 HydrophobicContact CG-CD 4.41Å; L396-K400 WeakPolarHBondContact O-CG 3.31Å; L396-K400 PolarHBondContact O-N 2.8Å; L396-K400 VanDerWaalsContact O-N 3.12Å; S397-K400 PolarHBondContact O-N 2.91Å; K400-S402 VanDerWaalsContact C-N 3.3Å; K400-S402 PolarHBondContact O-N 3.49Å; K400-I403 PolarHBondContact O-N 3.48Å; K400-T404 PolarHBondContact O-N 3.43Å; K400-T404 PolarHBondContact O-OG1 3.49Å; K400-L511 HydrophobicContact CG-CD1 4.12Å
401	K	91.7	Very high	91.2	Very high	65 Å²	65	40.5 Å²	40.5	28%	0.283	21%	0.209	S	C	.	.	H	α-helix	trans	-57.7	-41.7	178.4	-74.9	-179.5	170.8	-168.3	0	111.7	S397 A405 M433 N439 V441 L443	S397-K401 WeakPolarHBondContact O-CB 3.31Å; S397-K401 WeakPolarHBondContact O-CG 3.49Å; S397-K401 PolarHBondContact O-N 3.36Å; K401-A405 WeakPolarHBondContact O-CB 3.33Å; K401-A405 PolarHBondContact O-N 2.85Å; K401-M433 HydrophobicContact CB-CE 4.4Å; K401-M433 HydrophobicContact CD-CE 3.64Å; K401-N439 PolarHBondContact NZ-O 3.36Å; K401-V441 PolarHBondContact NZ-O 2.71Å; K401-L443 HydrophobicContact CB-CD1 4.16Å
402	S	93.6	Very high	91.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-47.1	178.3	-60.3	0	0	0	0	112.3	F398 V399 K400 A405 I406	F398-S402 WeakPolarHBondContact CE2-OG 3.37Å; F398-S402 VanDerWaalsContact O-CB 3.26Å; F398-S402 WeakPolarHBondContact O-CB 3.37Å; F398-S402 PolarHBondContact O-N 2.78Å; F398-S402 PolarHBondContact O-OG 2.86Å; V399-S402 PolarHBondContact O-N 2.99Å; K400-S402 VanDerWaalsContact C-N 3.3Å; K400-S402 PolarHBondContact O-N 3.49Å; S402-A405 PolarHBondContact O-N 2.89Å; S402-I406 WeakPolarHBondContact O-CD1 3.31Å; S402-I406 VanDerWaalsContact O-CG1 3.26Å; S402-I406 WeakPolarHBondContact O-CG1 3.17Å; S402-I406 PolarHBondContact O-N 2.85Å; S402-I406 VanDerWaalsContact O-N 3.08Å
403	I	95.5	Very high	91.8	Very high	16 Å²	16	42 Å²	42	8%	0.082	22%	0.218	C	C	.	.	H	α-helix	trans	-58.2	-51.9	176.1	-74.8	171.2	0	0	0	110.2	V399 K400 A405 I406 E407 L458 L511 H515	V399-I403 HydrophobicContact CG1-CD1 3.74Å; V399-I403 WeakPolarHBondContact O-CB 3.42Å; V399-I403 WeakPolarHBondContact O-CG1 3.47Å; V399-I403 PolarHBondContact O-N 2.86Å; K400-I403 PolarHBondContact O-N 3.48Å; I403-A405 VanDerWaalsContact C-N 3.34Å; I403-A405 PolarHBondContact O-N 2.95Å; I403-I406 PolarHBondContact O-N 3.41Å; I403-E407 HydrophobicContact CG2-CG 4.35Å; I403-E407 WeakPolarHBondContact O-CG 3.47Å; I403-E407 PolarHBondContact O-N 3.49Å; I403-L458 HydrophobicContact CG1-CD2 4.32Å; I403-L511 HydrophobicContact CD1-CB 4.43Å; I403-H515 HydrophobicContact CD1-CB 3.96Å; I403-H515 HydrophobicContact CG1-CB 4Å; I403-H515 HydrophobicContact CG2-CB 3.81Å
404	T	93.9	Very high	92.1	Very high	72 Å²	72	43.8 Å²	43.8	44%	0.442	22%	0.223	S	C	.	.	H	α-helix	trans	-58.2	-44.3	-179.9	-60.9	0	0	0	0	112	K400 I406 E407 T408	K400-T404 PolarHBondContact O-N 3.43Å; K400-T404 PolarHBondContact O-OG1 3.49Å; T404-I406 PolarHBondContact O-N 2.91Å; T404-E407 PolarHBondContact O-N 2.73Å; T404-T408 HydrophobicContact CG2-CG2 4.28Å; T404-T408 WeakPolarHBondContact O-CG2 3.13Å; T404-T408 PolarHBondContact O-N 2.83Å; T404-T408 PolarHBondContact O-OG1 3.09Å
405	A	92.4	Very high	92.3	Very high	2 Å²	2	42 Å²	42	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-38.8	178.3	0	0	0	0	0	113.4	K401 S402 I403 R409 L443 I454	K401-A405 WeakPolarHBondContact O-CB 3.33Å; K401-A405 PolarHBondContact O-N 2.85Å; S402-A405 PolarHBondContact O-N 2.89Å; I403-A405 VanDerWaalsContact C-N 3.34Å; I403-A405 PolarHBondContact O-N 2.95Å; A405-R409 WeakPolarHBondContact O-CB 3.18Å; A405-R409 WeakPolarHBondContact O-CG 3.33Å; A405-R409 PolarHBondContact O-N 2.84Å; A405-L443 HydrophobicContact CB-CB 3.72Å; A405-L443 VanDerWaalsContact CB-O 3.31Å; A405-L443 WeakPolarHBondContact CB-O 3.41Å; A405-I454 HydrophobicContact CB-CD1 4.39Å
406	I	94.6	Very high	92.6	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-68.9	-44.9	177.4	-65.5	161.5	0	0	0	110.3	S402 I403 T404 S410 I411 L416 Y417 V451 I454 T455	S402-I406 WeakPolarHBondContact O-CD1 3.31Å; S402-I406 VanDerWaalsContact O-CG1 3.26Å; S402-I406 WeakPolarHBondContact O-CG1 3.17Å; S402-I406 PolarHBondContact O-N 2.85Å; S402-I406 VanDerWaalsContact O-N 3.08Å; I403-I406 PolarHBondContact O-N 3.41Å; T404-I406 PolarHBondContact O-N 2.91Å; I406-S410 CarbonylContact O-C 3.42Å; I406-S410 PolarHBondContact O-N 3.11Å; I406-S410 VanDerWaalsContact O-N 3.08Å; I406-I411 PolarHBondContact O-N 3.43Å; I406-I411 VanDerWaalsContact O-N 3.12Å; I406-L416 HydrophobicContact CG2-CD1 4.13Å; I406-L416 HydrophobicContact CG2-CD2 4.22Å; I406-Y417 HydrophobicContact CD1-CE1 4.3Å; I406-Y417 VanDerWaalsContact CD1-OH 3.28Å; I406-Y417 WeakPolarHBondContact CD1-OH 3.44Å; I406-V451 HydrophobicContact CG1-CG2 4.26Å; I406-I454 HydrophobicContact CD1-CG2 4.07Å; I406-I454 HydrophobicContact CG1-CG2 4.04Å; I406-T455 HydrophobicContact CD1-CG2 3.61Å; I406-T455 HydrophobicContact CG1-CG2 4.09Å
407	E	94.9	Very high	92.8	Very high	61 Å²	61	41.3 Å²	41.3	29%	0.285	21%	0.211	S	C	.	.	H	α-helix	trans	-67.6	-35.8	-177.9	-68.2	-171.5	148.1	0	0	113.6	I403 T404 H515 N518	I403-E407 HydrophobicContact CG2-CG 4.35Å; I403-E407 WeakPolarHBondContact O-CG 3.47Å; I403-E407 PolarHBondContact O-N 3.49Å; T404-E407 PolarHBondContact O-N 2.73Å; E407-H515 VanDerWaalsContact CD-ND1 3.3Å; E407-H515 VanDerWaalsContact CG-CE1 3.44Å; E407-H515 WeakPolarHBondContact CG-CE1 3.33Å; E407-H515 WeakPolarHBondContact CG-ND1 3.4Å; E407-H515 IonicContact OE1-CE1 2.73Å; E407-H515 IonicContact OE1-CG 3.33Å; E407-H515 IonicContact OE1-ND1 3.15Å; E407-H515 PolarHBondContact OE1-ND1 3.49Å; E407-N518 VanDerWaalsContact CD-ND2 3.3Å; E407-N518 PolarHBondContact OE1-ND2 2.99Å
408	T	90.4	Very high	92.9	Very high	99 Å²	99	45.9 Å²	45.9	61%	0.607	22%	0.222	S	C	*	.	H	α-helix	trans	-83.5	-31.4	-178	56.7	0	0	0	0	113.9	T404	T404-T408 HydrophobicContact CG2-CG2 4.28Å; T404-T408 WeakPolarHBondContact O-CG2 3.13Å; T404-T408 PolarHBondContact O-N 2.83Å; T404-T408 PolarHBondContact O-OG1 3.09Å
409	R	88.9	Confident	92.8	Very high	98 Å²	98	48.4 Å²	48.4	37%	0.37	24%	0.237	S	C	.	.	H	α-helix	trans	-104.9	-35.5	-170.8	-57.4	171.5	71.2	175.9	2.4	114.4	A405 L443 S444 S446	A405-R409 WeakPolarHBondContact O-CB 3.18Å; A405-R409 WeakPolarHBondContact O-CG 3.33Å; A405-R409 PolarHBondContact O-N 2.84Å; R409-L443 PolarHBondContact NH1-O 2.99Å; R409-S444 WeakPolarHBondContact CD-O 3.42Å; R409-S446 VanDerWaalsContact CZ-O 3.28Å; R409-S446 PolarHBondContact NH1-O 3.12Å; R409-S446 PolarHBondContact NH2-O 2.95Å
410	S	88.4	Confident	92.5	Very high	16 Å²	16	51 Å²	51	11%	0.112	26%	0.263	C	S	.	.			trans	-141.4	16.9	-156.2	-75.2	0	0	0	0	114.4	I406 N412 D413	I406-S410 CarbonylContact O-C 3.42Å; I406-S410 PolarHBondContact O-N 3.11Å; I406-S410 VanDerWaalsContact O-N 3.08Å; S410-N412 PolarHBondContact O-N 3.1Å; S410-D413 WeakPolarHBondContact CB-OD2 3.46Å; S410-D413 WeakPolarHBondContact O-CB 3.29Å; S410-D413 PolarHBondContact O-N 3.4Å; S410-D413 PolarHBondContact OG-OD2 2.73Å
411	I	94.4	Very high	92.3	Very high	21 Å²	21	47 Å²	47	11%	0.108	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-22.4	-175.7	-164.9	58.7	0	0	0	114	I406 V519 H522 N526	I406-I411 PolarHBondContact O-N 3.43Å; I406-I411 VanDerWaalsContact O-N 3.12Å; I411-V519 HydrophobicContact CD1-CB 4.39Å; I411-V519 HydrophobicContact CD1-CG2 3.76Å; I411-H522 HydrophobicContact CG1-CB 4.32Å; I411-N526 PolarHBondContact O-ND2 2.86Å
412	N	94.3	Very high	92.2	Very high	64 Å²	64	48 Å²	48	34%	0.342	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-4.4	178.6	-61.9	-42.7	0	0	0	113.9	S410 Q414 H522 Q525	S410-N412 PolarHBondContact O-N 3.1Å; N412-Q414 PolarHBondContact O-N 3.4Å; N412-H522 PolarHBondContact OD1-CD2 3.02Å; N412-Q525 HydrophobicContact CB-CB 4.14Å; N412-Q525 PolarHBondContact OD1-OE1 2.74Å
413	D	93.7	Very high	91.8	Very high	68 Å²	68	52.4 Å²	52.4	36%	0.364	29%	0.293	S	S	.	.	S	Bend	trans	-66.2	132.8	-176.6	-70.8	-2.6	0	0	0	110.9	S410 G415 L416 V451 N526	S410-D413 WeakPolarHBondContact CB-OD2 3.46Å; S410-D413 WeakPolarHBondContact O-CB 3.29Å; S410-D413 PolarHBondContact O-N 3.4Å; S410-D413 PolarHBondContact OG-OD2 2.73Å; D413-G415 PolarHBondContact O-N 3.26Å; D413-L416 HydrophobicContact CB-CD2 4.21Å; D413-L416 WeakPolarHBondContact O-CG 3.5Å; D413-V451 HydrophobicContact CB-CG1 4.32Å; D413-V451 WeakPolarHBondContact OD2-CG1 3.4Å; D413-N526 VanDerWaalsContact O-CB 3.27Å; D413-N526 WeakPolarHBondContact O-CB 3.45Å
414	Q	93.5	Very high	91.5	Very high	139 Å²	139	56 Å²	56	65%	0.65	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	129.4	-173.1	-71	-175.2	-0.9	0	0	113.2	N412 Q525 L527	N412-Q414 PolarHBondContact O-N 3.4Å; Q414-Q525 WeakPolarHBondContact CG-O 3.29Å; Q414-L527 HydrophobicContact CG-CD1 4.25Å; Q414-L527 HydrophobicContact CG-CG 4.4Å
415	G	91.2	Very high	91.3	Very high	2 Å²	2	56.3 Å²	56.3	2%	0.021	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	32.6	173.8	0	0	0	0	0	114.6	D413 Y417 R418 V419 N526	D413-G415 PolarHBondContact O-N 3.26Å; G415-Y417 PolarHBondContact O-N 3.44Å; G415-R418 PolarHBondContact O-N 2.83Å; G415-V419 PolarHBondContact O-N 2.72Å; G415-N526 PolarHBondContact N-O 3.35Å
416	L	94.6	Very high	91.2	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.026	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-42.3	133	169.4	-71.8	178	0	0	0	111.1	I406 D413 R418 V451 T455 V519 M528	I406-L416 HydrophobicContact CG2-CD1 4.13Å; I406-L416 HydrophobicContact CG2-CD2 4.22Å; D413-L416 HydrophobicContact CB-CD2 4.21Å; D413-L416 WeakPolarHBondContact O-CG 3.5Å; L416-R418 PolarHBondContact O-N 2.81Å; L416-V451 HydrophobicContact CD2-CG1 4.48Å; L416-V451 HydrophobicContact CD2-CG2 3.5Å; L416-T455 HydrophobicContact CD2-CG2 4.16Å; L416-V519 HydrophobicContact CB-CG1 4.38Å; L416-V519 HydrophobicContact CD1-CG1 4.01Å; L416-V519 HydrophobicContact CD1-CG2 4.23Å; L416-M528 HydrophobicContact CB-CG 4.34Å; L416-M528 WeakPolarHBondContact O-CE 3.39Å; L416-M528 WeakPolarHBondContact O-CG 3.36Å
417	Y	95.1	Very high	90.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	62	-20.3	-174.6	-56.9	-76.4	0	0	0	117	I406 G415 T455 L458 K459 H515 L516 V519 L533 F537	I406-Y417 HydrophobicContact CD1-CE1 4.3Å; I406-Y417 VanDerWaalsContact CD1-OH 3.28Å; I406-Y417 WeakPolarHBondContact CD1-OH 3.44Å; G415-Y417 PolarHBondContact O-N 3.44Å; Y417-T455 VanDerWaalsContact CD1-CB 3.48Å; Y417-T455 HydrophobicContact CD1-CG2 3.83Å; Y417-T455 HydrophobicContact CD2-CG2 4.3Å; Y417-T455 HydrophobicContact CE1-CG2 3.76Å; Y417-T455 HydrophobicContact CE2-CG2 4.25Å; Y417-T455 HydrophobicContact CG-CG2 4.11Å; Y417-L458 HydrophobicContact CE1-CD2 4.1Å; Y417-L458 WeakPolarHBondContact OH-CD2 3.2Å; Y417-K459 HydrophobicContact CD1-CD 4.27Å; Y417-K459 HydrophobicContact CD1-CG 3.98Å; Y417-K459 WeakPolarHBondContact O-CE 3.46Å; Y417-K459 PolarHBondContact O-NZ 3.48Å; Y417-H515 AromaticContact CE2-NE2 3.62Å; Y417-H515 AromaticContact CZ-NE2 3.71Å; Y417-H515 PolarHBondContact OH-CD2 2.72Å; Y417-H515 PolarHBondContact OH-NE2 3.39Å; Y417-L516 HydrophobicContact CD2-CD2 4.17Å; Y417-L516 HydrophobicContact CE2-CD2 3.81Å; Y417-V519 HydrophobicContact CE2-CG2 4.42Å; Y417-L533 HydrophobicContact CD2-CD2 4.28Å; Y417-F537 AromaticContact CD1-CE2 3.9Å; Y417-F537 HydrophobicContact CD1-CE2 3.9Å; Y417-F537 AromaticContact CD1-CZ 3.6Å; Y417-F537 HydrophobicContact CD1-CZ 3.6Å; Y417-F537 HydrophobicContact CD2-CE2 4Å; Y417-F537 HydrophobicContact CD2-CZ 4.34Å; Y417-F537 HydrophobicContact CE1-CE2 4.35Å; Y417-F537 AromaticContact CE1-CZ 3.75Å; Y417-F537 HydrophobicContact CE1-CZ 3.75Å; Y417-F537 HydrophobicContact CE2-CE2 4.44Å; Y417-F537 HydrophobicContact CE2-CZ 4.46Å; Y417-F537 AromaticContact CG-CE2 3.69Å; Y417-F537 HydrophobicContact CG-CE2 3.69Å; Y417-F537 AromaticContact CG-CZ 3.9Å; Y417-F537 HydrophobicContact CG-CZ 3.9Å
418	R	91.1	Very high	90.5	Very high	135 Å²	135	64.3 Å²	64.3	51%	0.509	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-43.7	173.9	-170.8	176.9	71.1	-168.5	0.9	111.8	G415 L416 M528	G415-R418 PolarHBondContact O-N 2.83Å; L416-R418 PolarHBondContact O-N 2.81Å; R418-M528 HydrophobicContact CB-CE 3.96Å; R418-M528 HydrophobicContact CB-SD 3.78Å
419	V	90	Very high	90.5	Very high	54 Å²	54	59.6 Å²	59.6	33%	0.327	32%	0.321	S	S	.	.	S	Bend	trans	-79.9	124.1	-180	-176.1	0	0	0	0	110.2	G415 K452	G415-V419 PolarHBondContact O-N 2.72Å; V419-K452 HydrophobicContact CB-CG 4.48Å; V419-K452 HydrophobicContact CG1-CD 3.74Å; V419-K452 HydrophobicContact CG1-CG 4.16Å
420	G	87.4	Confident	90.4	Very high	54 Å²	54	55 Å²	55	56%	0.557	30%	0.304	S	S	*	.	P	Polyproline II helix	trans	-72.1	138.6	179.9	0	0	0	0	0	113.5
421	G	88.5	Confident	90.3	Very high	16 Å²	16	57.1 Å²	57.1	17%	0.165	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-81.1	168.1	166.4	0	0	0	0	0	112.4	S423 K452 S456	G421-S423 PolarHBondContact O-N 3.23Å; G421-K452 VanDerWaalsContact CA-C 3.49Å; G421-K452 WeakPolarHBondContact CA-O 3.45Å; G421-K452 PolarHBondContact N-O 3.32Å; G421-S456 PolarHBondContact N-OG 2.9Å
422	V	89.8	Confident	89.8	Confident	84 Å²	84	59 Å²	59	51%	0.509	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-68.4	116.9	-179.2	-179.5	0	0	0	0	109.9	S424 K425 V426	V422-S424 VanDerWaalsContact C-N 3.27Å; V422-S424 PolarHBondContact O-N 3.01Å; V422-S424 VanDerWaalsContact O-N 3.09Å; V422-K425 HydrophobicContact CB-CB 4.3Å; V422-K425 HydrophobicContact CB-CG 4.32Å; V422-K425 WeakPolarHBondContact O-CA 3.33Å; V422-K425 WeakPolarHBondContact O-CB 3.41Å; V422-K425 PolarHBondContact O-N 2.91Å; V422-V426 WeakPolarHBondContact O-CG2 3.45Å; V422-V426 PolarHBondContact O-N 3.49Å
423	S	86.3	Confident	89.2	Confident	94 Å²	94	56.4 Å²	56.4	66%	0.657	32%	0.315	S	S	*	.	H	α-helix	trans	-52.8	-38.8	-169.9	-49	0	0	0	0	114.5	G421 V426 Q427	G421-S423 PolarHBondContact O-N 3.23Å; S423-V426 PolarHBondContact O-N 3.17Å; S423-Q427 VanDerWaalsContact O-CG 3.25Å; S423-Q427 WeakPolarHBondContact O-CG 3.46Å; S423-Q427 PolarHBondContact O-N 3.38Å
424	S	87.8	Confident	88.3	Confident	90 Å²	90	54.9 Å²	54.9	63%	0.629	31%	0.306	S	S	*	.	H	α-helix	trans	-67.3	-38.2	176.9	54.8	0	0	0	0	113	V422 K428	V422-S424 VanDerWaalsContact C-N 3.27Å; V422-S424 PolarHBondContact O-N 3.01Å; V422-S424 VanDerWaalsContact O-N 3.09Å; S424-K428 WeakPolarHBondContact O-CB 3.45Å; S424-K428 PolarHBondContact O-N 3.32Å; S424-K428 VanDerWaalsContact O-N 3.09Å
425	K	90	Very high	87.5	Confident	80 Å²	80	52.2 Å²	52.2	35%	0.348	30%	0.297	S	S	.	.	H	α-helix	trans	-66.2	-43.6	171.5	-74.9	-163.5	173	-163.7	0	111.2	V422 Q427 K428 L429 D448 W449 D450 T453	V422-K425 HydrophobicContact CB-CB 4.3Å; V422-K425 HydrophobicContact CB-CG 4.32Å; V422-K425 WeakPolarHBondContact O-CA 3.33Å; V422-K425 WeakPolarHBondContact O-CB 3.41Å; V422-K425 PolarHBondContact O-N 2.91Å; K425-Q427 PolarHBondContact O-N 3.14Å; K425-K428 PolarHBondContact O-N 2.94Å; K425-L429 WeakPolarHBondContact O-CB 3.25Å; K425-L429 PolarHBondContact O-N 3.43Å; K425-D448 PolarHBondContact NZ-O 3.22Å; K425-W449 HydrophobicContact CB-CZ3 4.08Å; K425-W449 HydrophobicContact CG-CZ3 4.49Å; K425-W449 WeakPolarHBondContact O-CZ3 3.33Å; K425-D450 IonicContact NZ-OD2 3.07Å; K425-T453 HydrophobicContact CB-CG2 3.77Å
426	V	90.2	Very high	86.2	Confident	10 Å²	10	60 Å²	60	6%	0.061	33%	0.332	C	S	.	.	H	α-helix	trans	-58.8	-48.4	179.7	172	0	0	0	0	111.3	V422 S423 L430 T453 A457 L460	V422-V426 WeakPolarHBondContact O-CG2 3.45Å; V422-V426 PolarHBondContact O-N 3.49Å; S423-V426 PolarHBondContact O-N 3.17Å; V426-L430 WeakPolarHBondContact O-CB 3.37Å; V426-L430 PolarHBondContact O-N 2.77Å; V426-T453 HydrophobicContact CG2-CG2 4.05Å; V426-A457 HydrophobicContact CG1-CB 4.2Å; V426-L460 HydrophobicContact CG1-CB 4.38Å; V426-L460 HydrophobicContact CG1-CD2 3.8Å
427	Q	87.1	Confident	84.5	Confident	87 Å²	87	68.7 Å²	68.7	41%	0.407	37%	0.37	S	S	.	.	H	α-helix	trans	-63.3	-44.8	176	-65.7	-72.4	-12	0	0	111.4	S423 K425 L430 S431	S423-Q427 VanDerWaalsContact O-CG 3.25Å; S423-Q427 WeakPolarHBondContact O-CG 3.46Å; S423-Q427 PolarHBondContact O-N 3.38Å; K425-Q427 PolarHBondContact O-N 3.14Å; Q427-L430 PolarHBondContact O-N 2.79Å; Q427-S431 PolarHBondContact O-N 3.19Å; Q427-S431 PolarHBondContact O-OG 3.08Å
428	K	88.3	Confident	82.9	Confident	135 Å²	135	70.1 Å²	70.1	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-60.7	-47.1	178.2	-175	-175.1	174.7	-170.5	0	112.2	S424 K425 L432 W449	S424-K428 WeakPolarHBondContact O-CB 3.45Å; S424-K428 PolarHBondContact O-N 3.32Å; S424-K428 VanDerWaalsContact O-N 3.09Å; K425-K428 PolarHBondContact O-N 2.94Å; K428-L432 HydrophobicContact CG-CD1 4.04Å; K428-L432 WeakPolarHBondContact O-CB 3.46Å; K428-L432 VanDerWaalsContact O-CG 3.29Å; K428-L432 WeakPolarHBondContact O-CG 3.11Å; K428-L432 PolarHBondContact O-N 3.23Å; K428-L432 VanDerWaalsContact O-N 3.09Å; K428-W449 HydrophobicContact CB-CH2 4.28Å; K428-W449 HydrophobicContact CD-CH2 4.05Å; K428-W449 HydrophobicContact CG-CH2 4.07Å
429	L	89.1	Confident	81.2	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-59.6	-47.9	177.3	173.5	56.5	0	0	0	110.6	K425 S431 L432 M433 L443 W449 T453 I454 A457	K425-L429 WeakPolarHBondContact O-CB 3.25Å; K425-L429 PolarHBondContact O-N 3.43Å; L429-S431 PolarHBondContact O-N 3.25Å; L429-L432 PolarHBondContact O-N 3.43Å; L429-M433 HydrophobicContact CD1-CG 3.84Å; L429-M433 VanDerWaalsContact O-CG 3.32Å; L429-M433 WeakPolarHBondContact O-CG 3.45Å; L429-M433 PolarHBondContact O-N 2.79Å; L429-M433 VanDerWaalsContact O-N 3.1Å; L429-L443 HydrophobicContact CD1-CD2 3.69Å; L429-W449 HydrophobicContact CB-CD2 4.36Å; L429-W449 HydrophobicContact CB-CE3 3.96Å; L429-W449 HydrophobicContact CB-CH2 3.83Å; L429-W449 HydrophobicContact CB-CZ2 4.26Å; L429-W449 HydrophobicContact CB-CZ3 3.68Å; L429-W449 HydrophobicContact CD1-CD2 4.05Å; L429-W449 HydrophobicContact CD1-CE3 4.5Å; L429-W449 HydrophobicContact CD1-CG 4.37Å; L429-W449 HydrophobicContact CD1-CZ2 4.21Å; L429-W449 HydrophobicContact CD2-CD2 4.36Å; L429-W449 HydrophobicContact CD2-CE3 4.3Å; L429-W449 HydrophobicContact CG-CD2 4.49Å; L429-W449 HydrophobicContact CG-CE3 4.48Å; L429-T453 HydrophobicContact CB-CG2 4.45Å; L429-T453 HydrophobicContact CD2-CG2 3.99Å; L429-I454 HydrophobicContact CD2-CG1 4.19Å; L429-A457 HydrophobicContact CD2-CB 3.8Å; L429-A457 HydrophobicContact CG-CB 4.17Å
430	L	87.3	Confident	79.8	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-66.7	-39.3	-175.5	-173.7	56.6	0	0	0	112.2	I387 F398 V426 Q427 M433 I434 L460 Y461	I387-L430 HydrophobicContact CD1-CB 3.86Å; I387-L430 HydrophobicContact CD1-CD2 3.67Å; I387-L430 HydrophobicContact CD1-CG 3.74Å; I387-L430 HydrophobicContact CG2-CD2 4.36Å; I387-L430 HydrophobicContact CG2-CG 4.15Å; F398-L430 HydrophobicContact CD1-CD1 4.19Å; F398-L430 HydrophobicContact CE1-CD1 3.68Å; F398-L430 HydrophobicContact CZ-CD1 3.91Å; V426-L430 WeakPolarHBondContact O-CB 3.37Å; V426-L430 PolarHBondContact O-N 2.77Å; Q427-L430 PolarHBondContact O-N 2.79Å; L430-M433 PolarHBondContact O-N 2.86Å; L430-I434 HydrophobicContact CD1-CD1 3.52Å; L430-I434 HydrophobicContact CD1-CG1 4.32Å; L430-I434 HydrophobicContact CG-CD1 3.89Å; L430-I434 PolarHBondContact O-N 3.12Å; L430-L460 HydrophobicContact CD2-CB 4.04Å; L430-L460 HydrophobicContact CD2-CD2 3.74Å; L430-L460 HydrophobicContact CD2-CG 3.69Å; L430-Y461 HydrophobicContact CD1-CD2 4.27Å; L430-Y461 HydrophobicContact CD1-CG 4.38Å
431	S	85.8	Confident	78.9	Confident	61 Å²	61	73.6 Å²	73.6	43%	0.427	39%	0.388	S	S	.	.	H	α-helix	trans	-61.5	-41.6	171.2	-61.1	0	0	0	0	112.7	Q427 L429 M433 I434 D435	Q427-S431 PolarHBondContact O-N 3.19Å; Q427-S431 PolarHBondContact O-OG 3.08Å; L429-S431 PolarHBondContact O-N 3.25Å; S431-M433 PolarHBondContact O-N 3.18Å; S431-I434 PolarHBondContact O-N 3.46Å; S431-D435 PolarHBondContact O-N 3.02Å; S431-D435 VanDerWaalsContact O-N 3.1Å
432	L	85.1	Confident	78.1	Confident	61 Å²	61	76.6 Å²	76.6	32%	0.319	40%	0.401	S	S	.	.	H	α-helix	trans	-69.3	-17.1	178.6	-74	170.4	0	0	0	114.2	K428 L429 S438 W449	K428-L432 HydrophobicContact CG-CD1 4.04Å; K428-L432 WeakPolarHBondContact O-CB 3.46Å; K428-L432 VanDerWaalsContact O-CG 3.29Å; K428-L432 WeakPolarHBondContact O-CG 3.11Å; K428-L432 PolarHBondContact O-N 3.23Å; K428-L432 VanDerWaalsContact O-N 3.09Å; L429-L432 PolarHBondContact O-N 3.43Å; L432-S438 WeakPolarHBondContact O-CB 3.37Å; L432-S438 PolarHBondContact O-OG 3.09Å; L432-W449 HydrophobicContact CD1-CH2 4.36Å; L432-W449 HydrophobicContact CD1-CZ2 3.96Å
433	M	80.9	Confident	77.7	Confident	9 Å²	9	72.6 Å²	72.6	4%	0.044	38%	0.377	C	S	.	.	H	α-helix	trans	-99	-9.8	179.2	-65.7	-62.4	-64.1	0	0	113.5	F398 K401 L429 L430 S431 V441 L443	F398-M433 HydrophobicContact CB-CB 4.28Å; F398-M433 HydrophobicContact CB-CE 4.46Å; F398-M433 HydrophobicContact CD2-CB 3.38Å; F398-M433 HydrophobicContact CD2-CE 3.78Å; F398-M433 HydrophobicContact CD2-CG 3.51Å; F398-M433 HydrophobicContact CD2-SD 4.45Å; F398-M433 HydrophobicContact CE2-CB 3.94Å; F398-M433 HydrophobicContact CE2-CG 3.78Å; F398-M433 HydrophobicContact CG-CB 3.98Å; K401-M433 HydrophobicContact CB-CE 4.4Å; K401-M433 HydrophobicContact CD-CE 3.64Å; L429-M433 HydrophobicContact CD1-CG 3.84Å; L429-M433 VanDerWaalsContact O-CG 3.32Å; L429-M433 WeakPolarHBondContact O-CG 3.45Å; L429-M433 PolarHBondContact O-N 2.79Å; L429-M433 VanDerWaalsContact O-N 3.1Å; L430-M433 PolarHBondContact O-N 2.86Å; S431-M433 PolarHBondContact O-N 3.18Å; M433-V441 HydrophobicContact SD-CB 3.61Å; M433-V441 HydrophobicContact SD-CG1 3.77Å; M433-V441 HydrophobicContact SD-CG2 4.27Å; M433-L443 HydrophobicContact CE-CD1 4.15Å; M433-L443 HydrophobicContact CE-CG 4.47Å; M433-L443 HydrophobicContact SD-CD2 4.45Å
434	I	76.2	Confident	76.8	Confident	36 Å²	36	70.7 Å²	70.7	19%	0.185	36%	0.363	C	S	.	.	H	α-helix	trans	-110.4	-22.1	-179.2	-67.9	168	0	0	0	111.8	I387 A389 L430 S431 E436 Y461	I387-I434 HydrophobicContact CG2-CD1 3.44Å; I387-I434 VanDerWaalsContact CG2-CD1 3.44Å; A389-I434 HydrophobicContact CB-CD1 4.13Å; L430-I434 HydrophobicContact CD1-CD1 3.52Å; L430-I434 HydrophobicContact CD1-CG1 4.32Å; L430-I434 HydrophobicContact CG-CD1 3.89Å; L430-I434 PolarHBondContact O-N 3.12Å; S431-I434 PolarHBondContact O-N 3.46Å; I434-E436 PolarHBondContact O-N 3.36Å; I434-Y461 HydrophobicContact CD1-CD2 4.05Å
435	D	76.3	Confident	75.7	Confident	84 Å²	84	69.8 Å²	69.8	45%	0.449	36%	0.361	S	S	.	.	S	Bend	trans	-65.7	123.9	169.7	-171.5	-13.9	0	0	0	110.5	S431 K437 S438	S431-D435 PolarHBondContact O-N 3.02Å; S431-D435 VanDerWaalsContact O-N 3.1Å; D435-K437 PolarHBondContact O-N 2.96Å; D435-K437 WeakPolarHBondContact OD1-CB 3.44Å; D435-K437 PolarHBondContact OD1-N 2.71Å; D435-K437 VanDerWaalsContact OD1-N 3.07Å; D435-S438 PolarHBondContact O-N 3.13Å; D435-S438 PolarHBondContact O-OG 2.99Å; D435-S438 VanDerWaalsContact O-OG 3.08Å
436	E	62.8	Low	74.8	Confident	164 Å²	164	67 Å²	67	77%	0.766	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.4	-179.4	-146.7	178.5	-168.8	0	0	112.5	I434	I434-E436 PolarHBondContact O-N 3.36Å
437	K	60.5	Low	73.7	Confident	189 Å²	189	75.1 Å²	75.1	82%	0.822	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.1	-176.6	-63.2	173.4	-176.9	171	0	115	D435	D435-K437 PolarHBondContact O-N 2.96Å; D435-K437 WeakPolarHBondContact OD1-CB 3.44Å; D435-K437 PolarHBondContact OD1-N 2.71Å; D435-K437 VanDerWaalsContact OD1-N 3.07Å
438	S	60.2	Low	73.1	Confident	29 Å²	29	76.5 Å²	76.5	20%	0.203	40%	0.399	C	S	.	.			trans	-114.3	45.2	-169.7	46.3	0	0	0	0	114.2	L432 D435 E440	L432-S438 WeakPolarHBondContact O-CB 3.37Å; L432-S438 PolarHBondContact O-OG 3.09Å; D435-S438 PolarHBondContact O-N 3.13Å; D435-S438 PolarHBondContact O-OG 2.99Å; D435-S438 VanDerWaalsContact O-OG 3.08Å; S438-E440 PolarHBondContact O-N 3.23Å; S438-E440 VanDerWaalsContact O-N 3.08Å
439	N	55.4	Low	73	Confident	93 Å²	93	71.2 Å²	71.2	50%	0.497	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-12	-173.8	-101.8	-48.1	0	0	0	116.5	K401	K401-N439 PolarHBondContact NZ-O 3.36Å
440	E	60.7	Low	73	Confident	194 Å²	194	73.9 Å²	73.9	91%	0.907	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	11	-171.5	-63.7	-167.3	154	0	0	116	S438 D442	S438-E440 PolarHBondContact O-N 3.23Å; S438-E440 VanDerWaalsContact O-N 3.08Å; E440-D442 PolarHBondContact O-N 2.95Å
441	V	68.8	Low	73.1	Confident	29 Å²	29	74.8 Å²	74.8	18%	0.176	40%	0.396	C	S	.	.			trans	-75.2	114.3	174.1	-175.5	0	0	0	0	110.5	K401 M433 L443	K401-V441 PolarHBondContact NZ-O 2.71Å; M433-V441 HydrophobicContact SD-CB 3.61Å; M433-V441 HydrophobicContact SD-CG1 3.77Å; M433-V441 HydrophobicContact SD-CG2 4.27Å; V441-L443 HydrophobicContact CG1-CD2 3.72Å
442	D	72.4	Confident	73.5	Confident	79 Å²	79	76.7 Å²	76.7	42%	0.422	40%	0.396	S	S	.	.			trans	-98.8	108.4	169.2	-178.2	12.9	0	0	0	111.4	E440 S444 A445 S446	E440-D442 PolarHBondContact O-N 2.95Å; D442-S444 VanDerWaalsContact C-N 3.29Å; D442-S444 WeakPolarHBondContact OD1-CA 3.3Å; D442-S444 WeakPolarHBondContact OD1-CB 3.44Å; D442-S444 PolarHBondContact OD1-N 2.72Å; D442-S444 PolarHBondContact OD1-OG 3.02Å; D442-S444 PolarHBondContact OD2-OG 3.15Å; D442-A445 VanDerWaalsContact OD2-CB 3.26Å; D442-A445 WeakPolarHBondContact OD2-CB 3.11Å; D442-A445 PolarHBondContact OD2-N 2.85Å; D442-S446 VanDerWaalsContact O-CB 3.3Å; D442-S446 WeakPolarHBondContact O-CB 3.46Å; D442-S446 PolarHBondContact O-N 3.35Å
443	L	80.1	Confident	73.8	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-15.1	177.7	-55.4	-179.7	0	0	0	112.9	F398 K401 A405 R409 L429 M433 V441	F398-L443 HydrophobicContact CE2-CD1 4.45Å; K401-L443 HydrophobicContact CB-CD1 4.16Å; A405-L443 HydrophobicContact CB-CB 3.72Å; A405-L443 VanDerWaalsContact CB-O 3.31Å; A405-L443 WeakPolarHBondContact CB-O 3.41Å; R409-L443 PolarHBondContact NH1-O 2.99Å; L429-L443 HydrophobicContact CD1-CD2 3.69Å; M433-L443 HydrophobicContact CE-CD1 4.15Å; M433-L443 HydrophobicContact CE-CG 4.47Å; M433-L443 HydrophobicContact SD-CD2 4.45Å; V441-L443 HydrophobicContact CG1-CD2 3.72Å
444	S	67.1	Low	74.4	Confident	54 Å²	54	73.6 Å²	73.6	38%	0.378	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-26.5	-179.2	73.7	0	0	0	0	113.2	R409 D442	R409-S444 WeakPolarHBondContact CD-O 3.42Å; D442-S444 VanDerWaalsContact C-N 3.29Å; D442-S444 WeakPolarHBondContact OD1-CA 3.3Å; D442-S444 WeakPolarHBondContact OD1-CB 3.44Å; D442-S444 PolarHBondContact OD1-N 2.72Å; D442-S444 PolarHBondContact OD1-OG 3.02Å; D442-S444 PolarHBondContact OD2-OG 3.15Å
445	A	65.6	Low	75.4	Confident	71 Å²	71	71.9 Å²	71.9	59%	0.587	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-20.2	178.9	0	0	0	0	0	115.5	D442	D442-A445 VanDerWaalsContact OD2-CB 3.26Å; D442-A445 WeakPolarHBondContact OD2-CB 3.11Å; D442-A445 PolarHBondContact OD2-N 2.85Å
446	S	70.5	Confident	76.2	Confident	21 Å²	21	68.6 Å²	68.6	15%	0.147	36%	0.355	C	S	.	.			trans	-75	126.9	-175.4	172.1	0	0	0	0	113.6	R409 D442 D448	R409-S446 VanDerWaalsContact CZ-O 3.28Å; R409-S446 PolarHBondContact NH1-O 3.12Å; R409-S446 PolarHBondContact NH2-O 2.95Å; D442-S446 VanDerWaalsContact O-CB 3.3Å; D442-S446 WeakPolarHBondContact O-CB 3.46Å; D442-S446 PolarHBondContact O-N 3.35Å; S446-D448 PolarHBondContact OG-N 3.36Å; S446-D448 PolarHBondContact OG-OD2 2.91Å; S446-D448 VanDerWaalsContact OG-OD2 3.07Å
447	E	66.8	Low	77.7	Confident	181 Å²	181	60.8 Å²	60.8	85%	0.846	32%	0.318	S	S	*	.	S	Bend	trans	-79.4	-16.1	171.3	-65.3	-171.2	157.7	0	0	113.5	W449	E447-W449 PolarHBondContact O-N 3.17Å
448	D	75.9	Confident	79.3	Confident	115 Å²	115	51.8 Å²	51.8	62%	0.615	28%	0.279	S	S	*	.	S	Bend	trans	-65.6	-26.8	-176.7	-55.8	-69.8	0	0	0	113.4	K425 S446	K425-D448 PolarHBondContact NZ-O 3.22Å; S446-D448 PolarHBondContact OG-N 3.36Å; S446-D448 PolarHBondContact OG-OD2 2.91Å; S446-D448 VanDerWaalsContact OG-OD2 3.07Å
449	W	85.4	Confident	80.9	Confident	24 Å²	24	52.5 Å²	52.5	9%	0.091	28%	0.279	C	S	.	.	S	Bend	trans	-108.5	99.8	-174.8	-55.2	116.9	0	0	0	111	K425 K428 L429 L432 E447 T453 I454	K425-W449 HydrophobicContact CB-CZ3 4.08Å; K425-W449 HydrophobicContact CG-CZ3 4.49Å; K425-W449 WeakPolarHBondContact O-CZ3 3.33Å; K428-W449 HydrophobicContact CB-CH2 4.28Å; K428-W449 HydrophobicContact CD-CH2 4.05Å; K428-W449 HydrophobicContact CG-CH2 4.07Å; L429-W449 HydrophobicContact CB-CD2 4.36Å; L429-W449 HydrophobicContact CB-CE3 3.96Å; L429-W449 HydrophobicContact CB-CH2 3.83Å; L429-W449 HydrophobicContact CB-CZ2 4.26Å; L429-W449 HydrophobicContact CB-CZ3 3.68Å; L429-W449 HydrophobicContact CD1-CD2 4.05Å; L429-W449 HydrophobicContact CD1-CE3 4.5Å; L429-W449 HydrophobicContact CD1-CG 4.37Å; L429-W449 HydrophobicContact CD1-CZ2 4.21Å; L429-W449 HydrophobicContact CD2-CD2 4.36Å; L429-W449 HydrophobicContact CD2-CE3 4.3Å; L429-W449 HydrophobicContact CG-CD2 4.49Å; L429-W449 HydrophobicContact CG-CE3 4.48Å; L432-W449 HydrophobicContact CD1-CH2 4.36Å; L432-W449 HydrophobicContact CD1-CZ2 3.96Å; E447-W449 PolarHBondContact O-N 3.17Å; W449-T453 HydrophobicContact CE3-CG2 3.86Å; W449-T453 HydrophobicContact CZ3-CG2 4.29Å; W449-I454 HydrophobicContact CB-CD1 4.21Å; W449-I454 HydrophobicContact CB-CG1 4.08Å
450	D	88.4	Confident	82.7	Confident	56 Å²	56	49.2 Å²	49.2	30%	0.299	26%	0.261	S	S	.	.			trans	-67.8	154.2	172.2	64.8	90.5	0	0	0	111.8	K425 K452 T453 I454	K425-D450 IonicContact NZ-OD2 3.07Å; D450-K452 PolarHBondContact O-N 2.72Å; D450-K452 VanDerWaalsContact O-N 3.16Å; D450-K452 WeakPolarHBondContact OD1-CA 3.45Å; D450-K452 VanDerWaalsContact OD1-CB 3.31Å; D450-K452 WeakPolarHBondContact OD1-CB 3.36Å; D450-K452 PolarHBondContact OD1-N 2.82Å; D450-K452 VanDerWaalsContact OD1-N 3.16Å; D450-T453 VanDerWaalsContact CG-OG1 3.27Å; D450-T453 WeakPolarHBondContact O-CA 3.48Å; D450-T453 WeakPolarHBondContact O-CB 3.31Å; D450-T453 PolarHBondContact O-N 2.91Å; D450-T453 PolarHBondContact OD1-N 2.72Å; D450-T453 PolarHBondContact OD1-OG1 3.19Å; D450-T453 WeakPolarHBondContact OD2-CB 3.49Å; D450-T453 PolarHBondContact OD2-OG1 2.95Å; D450-I454 PolarHBondContact O-N 2.84Å
451	V	91.1	Very high	84.3	Confident	20 Å²	20	40 Å²	40	12%	0.121	22%	0.217	C	C	.	.	H	α-helix	trans	-59	-31.2	-177.4	69.9	0	0	0	0	113.5	I406 D413 L416 T453 I454 T455	I406-V451 HydrophobicContact CG1-CG2 4.26Å; D413-V451 HydrophobicContact CB-CG1 4.32Å; D413-V451 WeakPolarHBondContact OD2-CG1 3.4Å; L416-V451 HydrophobicContact CD2-CG1 4.48Å; L416-V451 HydrophobicContact CD2-CG2 3.5Å; V451-T453 VanDerWaalsContact C-N 3.32Å; V451-I454 PolarHBondContact O-N 3.05Å; V451-T455 HydrophobicContact CG2-CG2 3.99Å; V451-T455 WeakPolarHBondContact O-CB 3.37Å; V451-T455 WeakPolarHBondContact O-CG2 3.46Å; V451-T455 PolarHBondContact O-N 3.16Å; V451-T455 PolarHBondContact O-OG1 3.16Å
452	K	92.8	Very high	85.5	Confident	101 Å²	101	38.6 Å²	38.6	44%	0.439	21%	0.209	S	C	.	.	H	α-helix	trans	-69	-38.1	-179.8	-55.1	167.3	-180	177.4	0	109.4	V419 G421 D450 T455 S456	V419-K452 HydrophobicContact CB-CG 4.48Å; V419-K452 HydrophobicContact CG1-CD 3.74Å; V419-K452 HydrophobicContact CG1-CG 4.16Å; G421-K452 VanDerWaalsContact CA-C 3.49Å; G421-K452 WeakPolarHBondContact CA-O 3.45Å; G421-K452 PolarHBondContact N-O 3.32Å; D450-K452 PolarHBondContact O-N 2.72Å; D450-K452 VanDerWaalsContact O-N 3.16Å; D450-K452 WeakPolarHBondContact OD1-CA 3.45Å; D450-K452 VanDerWaalsContact OD1-CB 3.31Å; D450-K452 WeakPolarHBondContact OD1-CB 3.36Å; D450-K452 PolarHBondContact OD1-N 2.82Å; D450-K452 VanDerWaalsContact OD1-N 3.16Å; K452-T455 WeakPolarHBondContact CA-OG1 3.27Å; K452-T455 PolarHBondContact O-OG1 3.11Å; K452-S456 WeakPolarHBondContact O-CB 3.44Å; K452-S456 PolarHBondContact O-N 3.45Å; K452-S456 PolarHBondContact O-OG 3Å
453	T	92.9	Very high	86.3	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.1	-48.1	170.1	-63.6	0	0	0	0	111.9	K425 V426 L429 W449 D450 V451 S456 A457	K425-T453 HydrophobicContact CB-CG2 3.77Å; V426-T453 HydrophobicContact CG2-CG2 4.05Å; L429-T453 HydrophobicContact CB-CG2 4.45Å; L429-T453 HydrophobicContact CD2-CG2 3.99Å; W449-T453 HydrophobicContact CE3-CG2 3.86Å; W449-T453 HydrophobicContact CZ3-CG2 4.29Å; D450-T453 VanDerWaalsContact CG-OG1 3.27Å; D450-T453 WeakPolarHBondContact O-CA 3.48Å; D450-T453 WeakPolarHBondContact O-CB 3.31Å; D450-T453 PolarHBondContact O-N 2.91Å; D450-T453 PolarHBondContact OD1-N 2.72Å; D450-T453 PolarHBondContact OD1-OG1 3.19Å; D450-T453 WeakPolarHBondContact OD2-CB 3.49Å; D450-T453 PolarHBondContact OD2-OG1 2.95Å; V451-T453 VanDerWaalsContact C-N 3.32Å; T453-S456 PolarHBondContact O-N 2.87Å; T453-A457 WeakPolarHBondContact O-CB 3.08Å; T453-A457 PolarHBondContact O-N 2.89Å
454	I	93.5	Very high	86.7	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-63.3	-50.7	-179.7	-60.5	169.7	0	0	0	111.3	A405 I406 L429 W449 D450 V451 S456 A457 L458	A405-I454 HydrophobicContact CB-CD1 4.39Å; I406-I454 HydrophobicContact CD1-CG2 4.07Å; I406-I454 HydrophobicContact CG1-CG2 4.04Å; L429-I454 HydrophobicContact CD2-CG1 4.19Å; W449-I454 HydrophobicContact CB-CD1 4.21Å; W449-I454 HydrophobicContact CB-CG1 4.08Å; D450-I454 PolarHBondContact O-N 2.84Å; V451-I454 PolarHBondContact O-N 3.05Å; I454-S456 VanDerWaalsContact C-N 3.31Å; I454-S456 PolarHBondContact O-N 3.1Å; I454-A457 PolarHBondContact O-N 2.75Å; I454-L458 PolarHBondContact O-N 3.32Å
455	T	95.3	Very high	87.8	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-60.4	-38.8	177.7	51.5	0	0	0	0	112.2	I406 L416 Y417 V451 K452 K459	I406-T455 HydrophobicContact CD1-CG2 3.61Å; I406-T455 HydrophobicContact CG1-CG2 4.09Å; L416-T455 HydrophobicContact CD2-CG2 4.16Å; Y417-T455 VanDerWaalsContact CD1-CB 3.48Å; Y417-T455 HydrophobicContact CD1-CG2 3.83Å; Y417-T455 HydrophobicContact CD2-CG2 4.3Å; Y417-T455 HydrophobicContact CE1-CG2 3.76Å; Y417-T455 HydrophobicContact CE2-CG2 4.25Å; Y417-T455 HydrophobicContact CG-CG2 4.11Å; V451-T455 HydrophobicContact CG2-CG2 3.99Å; V451-T455 WeakPolarHBondContact O-CB 3.37Å; V451-T455 WeakPolarHBondContact O-CG2 3.46Å; V451-T455 PolarHBondContact O-N 3.16Å; V451-T455 PolarHBondContact O-OG1 3.16Å; K452-T455 WeakPolarHBondContact CA-OG1 3.27Å; K452-T455 PolarHBondContact O-OG1 3.11Å; T455-K459 WeakPolarHBondContact O-CG 3.4Å; T455-K459 PolarHBondContact O-N 3.3Å; T455-K459 VanDerWaalsContact O-N 3.13Å
456	S	94.3	Very high	88.8	Confident	14 Å²	14	42.6 Å²	42.6	10%	0.098	22%	0.216	C	C	.	.	H	α-helix	trans	-71.5	-35.9	176.4	-62	0	0	0	0	112.9	G421 K452 T453 I454 K459 L460	G421-S456 PolarHBondContact N-OG 2.9Å; K452-S456 WeakPolarHBondContact O-CB 3.44Å; K452-S456 PolarHBondContact O-N 3.45Å; K452-S456 PolarHBondContact O-OG 3Å; T453-S456 PolarHBondContact O-N 2.87Å; I454-S456 VanDerWaalsContact C-N 3.31Å; I454-S456 PolarHBondContact O-N 3.1Å; S456-K459 PolarHBondContact O-N 3.43Å; S456-L460 VanDerWaalsContact O-CB 3.29Å; S456-L460 WeakPolarHBondContact O-CB 3.5Å; S456-L460 PolarHBondContact O-N 2.86Å
457	A	93.5	Very high	89.6	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-40.1	174.8	0	0	0	0	0	111.8	F398 V426 L429 T453 I454 L460 Y461	F398-A457 HydrophobicContact CZ-CB 3.98Å; V426-A457 HydrophobicContact CG1-CB 4.2Å; L429-A457 HydrophobicContact CD2-CB 3.8Å; L429-A457 HydrophobicContact CG-CB 4.17Å; T453-A457 WeakPolarHBondContact O-CB 3.08Å; T453-A457 PolarHBondContact O-N 2.89Å; I454-A457 PolarHBondContact O-N 2.75Å; A457-L460 PolarHBondContact O-N 2.77Å; A457-Y461 WeakPolarHBondContact O-CB 3.13Å; A457-Y461 PolarHBondContact O-N 2.59Å
458	L	95	Very high	90.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-43	174.6	-179.7	56.8	0	0	0	112.3	F398 V399 I403 Y417 I454 Y461 L462	F398-L458 HydrophobicContact CE1-CD1 4.32Å; V399-L458 HydrophobicContact CB-CD1 4.35Å; V399-L458 HydrophobicContact CG1-CD1 4.42Å; V399-L458 HydrophobicContact CG2-CD1 3.87Å; I403-L458 HydrophobicContact CG1-CD2 4.32Å; Y417-L458 HydrophobicContact CE1-CD2 4.1Å; Y417-L458 WeakPolarHBondContact OH-CD2 3.2Å; I454-L458 PolarHBondContact O-N 3.32Å; L458-Y461 HydrophobicContact CD1-CD1 4.48Å; L458-L462 HydrophobicContact CD1-CD1 4.44Å; L458-L462 WeakPolarHBondContact O-CG 3.48Å; L458-L462 PolarHBondContact O-N 2.94Å
459	K	94.6	Very high	91.7	Very high	45 Å²	45	31.3 Å²	31.3	20%	0.196	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-46.1	171.7	-71.5	-172.5	-55.7	172.4	0	112	Y417 T455 S456 Y461 L462 R463 V536 F537	Y417-K459 HydrophobicContact CD1-CD 4.27Å; Y417-K459 HydrophobicContact CD1-CG 3.98Å; Y417-K459 WeakPolarHBondContact O-CE 3.46Å; Y417-K459 PolarHBondContact O-NZ 3.48Å; T455-K459 WeakPolarHBondContact O-CG 3.4Å; T455-K459 PolarHBondContact O-N 3.3Å; T455-K459 VanDerWaalsContact O-N 3.13Å; S456-K459 PolarHBondContact O-N 3.43Å; K459-Y461 PolarHBondContact O-N 2.88Å; K459-L462 PolarHBondContact O-N 3.2Å; K459-R463 WeakPolarHBondContact O-CB 3.35Å; K459-R463 PolarHBondContact O-N 2.82Å; K459-V536 HydrophobicContact CD-CG1 3.52Å; K459-F537 HydrophobicContact CG-CE1 4.29Å; K459-F537 HydrophobicContact CG-CZ 4.14Å
460	L	92.1	Very high	92.1	Very high	23 Å²	23	30.2 Å²	30.2	12%	0.12	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-43.4	-178.6	-179.3	62.7	0	0	0	111.3	V426 L430 S456 A457 L462 R463 S464	V426-L460 HydrophobicContact CG1-CB 4.38Å; V426-L460 HydrophobicContact CG1-CD2 3.8Å; L430-L460 HydrophobicContact CD2-CB 4.04Å; L430-L460 HydrophobicContact CD2-CD2 3.74Å; L430-L460 HydrophobicContact CD2-CG 3.69Å; S456-L460 VanDerWaalsContact O-CB 3.29Å; S456-L460 WeakPolarHBondContact O-CB 3.5Å; S456-L460 PolarHBondContact O-N 2.86Å; A457-L460 PolarHBondContact O-N 2.77Å; L460-L462 PolarHBondContact O-N 2.8Å; L460-R463 CarbonylContact O-C 3.59Å; L460-R463 PolarHBondContact O-N 2.82Å; L460-S464 VanDerWaalsContact O-CB 3.32Å; L460-S464 WeakPolarHBondContact O-CB 3.15Å; L460-S464 PolarHBondContact O-N 2.88Å; L460-S464 PolarHBondContact O-OG 3.5Å
461	Y	94.1	Very high	92.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-52.4	-55.2	173.2	169.2	-109.1	0	0	0	112.2	A389 Q390 G395 F398 V399 L430 I434 A457 L458 K459 R463 S464 L465	A389-Y461 HydrophobicContact CB-CD2 3.84Å; A389-Y461 HydrophobicContact CB-CE2 4.05Å; Q390-Y461 PolarHBondContact O-OH 2.97Å; Q390-Y461 VanDerWaalsContact O-OH 3.1Å; G395-Y461 WeakPolarHBondContact CA-OH 3.34Å; F398-Y461 HydrophobicContact CD1-CD1 4.02Å; F398-Y461 HydrophobicContact CD1-CD2 4.18Å; F398-Y461 AromaticContact CD1-CG 3.8Å; F398-Y461 HydrophobicContact CD1-CG 3.8Å; F398-Y461 HydrophobicContact CE1-CD1 4.23Å; F398-Y461 AromaticContact CE1-CG 3.86Å; F398-Y461 HydrophobicContact CE1-CG 3.86Å; V399-Y461 HydrophobicContact CG2-CD1 3.88Å; V399-Y461 HydrophobicContact CG2-CE1 3.45Å; V399-Y461 VanDerWaalsContact CG2-CE1 3.45Å; L430-Y461 HydrophobicContact CD1-CD2 4.27Å; L430-Y461 HydrophobicContact CD1-CG 4.38Å; I434-Y461 HydrophobicContact CD1-CD2 4.05Å; A457-Y461 WeakPolarHBondContact O-CB 3.13Å; A457-Y461 PolarHBondContact O-N 2.59Å; L458-Y461 HydrophobicContact CD1-CD1 4.48Å; K459-Y461 PolarHBondContact O-N 2.88Å; Y461-R463 PolarHBondContact O-N 2.83Å; Y461-S464 PolarHBondContact O-N 3.29Å; Y461-S464 VanDerWaalsContact O-N 3.09Å; Y461-L465 HydrophobicContact CE2-CD2 4.15Å; Y461-L465 PolarHBondContact O-N 2.86Å
462	L	94.1	Very high	92.2	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-33.9	179.7	-65.2	168.7	0	0	0	112.4	L458 K459 L460 L465 L469 V508 L512 F537 T540 L541 R543	L458-L462 HydrophobicContact CD1-CD1 4.44Å; L458-L462 WeakPolarHBondContact O-CG 3.48Å; L458-L462 PolarHBondContact O-N 2.94Å; K459-L462 PolarHBondContact O-N 3.2Å; L460-L462 PolarHBondContact O-N 2.8Å; L462-L465 HydrophobicContact CD2-CD1 4.5Å; L462-L469 HydrophobicContact CD2-CD2 4.25Å; L462-V508 HydrophobicContact CD2-CG1 4.33Å; L462-L512 HydrophobicContact CD1-CD2 3.75Å; L462-F537 HydrophobicContact CD1-CE1 4.08Å; L462-T540 HydrophobicContact CB-CG2 3.82Å; L462-T540 HydrophobicContact CD1-CG2 4.43Å; L462-L541 HydrophobicContact CD1-CD2 4.18Å; L462-R543 PolarHBondContact O-NH1 2.96Å
463	R	90.2	Very high	92.1	Very high	130 Å²	130	29.2 Å²	29.2	49%	0.491	16%	0.162	S	C	.	.	H	α-helix	trans	-73.8	-29.2	176.2	-159.1	175	71.7	146.3	3.5	113.1	K459 L460 Y461 R543	K459-R463 WeakPolarHBondContact O-CB 3.35Å; K459-R463 PolarHBondContact O-N 2.82Å; L460-R463 CarbonylContact O-C 3.59Å; L460-R463 PolarHBondContact O-N 2.82Å; Y461-R463 PolarHBondContact O-N 2.83Å; R463-R543 PolarHBondContact O-NE 2.85Å; R463-R543 PolarHBondContact O-NH1 3.44Å; R463-R543 PolarHBondContact O-NH2 3.1Å
464	S	88.8	Confident	92.1	Very high	44 Å²	44	30.1 Å²	30.1	31%	0.308	17%	0.167	S	C	.	.	H	α-helix	trans	-88.9	-4.8	-177.1	-62.1	0	0	0	0	114.8	L460 Y461	L460-S464 VanDerWaalsContact O-CB 3.32Å; L460-S464 WeakPolarHBondContact O-CB 3.15Å; L460-S464 PolarHBondContact O-N 2.88Å; L460-S464 PolarHBondContact O-OG 3.5Å; Y461-S464 PolarHBondContact O-N 3.29Å; Y461-S464 VanDerWaalsContact O-N 3.09Å
465	L	88.9	Confident	92	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.063	17%	0.169	C	C	.	.	S	Bend	trans	-56.9	144.6	173.5	-65.2	173.1	0	0	0	111.3	A389 L391 Y461 L462 E467 L469 R543	A389-L465 HydrophobicContact CB-CD2 4.47Å; L391-L465 HydrophobicContact CB-CD2 4.4Å; L391-L465 HydrophobicContact CD1-CD1 4.15Å; L391-L465 HydrophobicContact CD1-CD2 4.32Å; Y461-L465 HydrophobicContact CE2-CD2 4.15Å; Y461-L465 PolarHBondContact O-N 2.86Å; L462-L465 HydrophobicContact CD2-CD1 4.5Å; L465-E467 WeakPolarHBondContact CB-O 3.44Å; L465-E467 PolarHBondContact O-N 3.19Å; L465-E467 VanDerWaalsContact O-N 3.15Å; L465-L469 HydrophobicContact CD1-CD1 4.49Å; L465-R543 PolarHBondContact O-NH2 3.22Å
466	P	86.3	Confident	91.8	Very high	102 Å²	102	38.3 Å²	38.3	66%	0.662	20%	0.202	S	C	*	.	S	Bend	trans	-54.6	-33.2	176.7	-28.5	33.2	0	0	0	114.1	A389	A389-P466 WeakPolarHBondContact O-CD 3.26Å
467	E	87.2	Confident	91.8	Very high	79 Å²	79	41.4 Å²	41.4	37%	0.369	22%	0.215	S	C	.	.	S	Bend	trans	-125.9	145	172.9	-165.9	176.7	-165.8	0	0	109	L465 T471 Y472 R543	L465-E467 WeakPolarHBondContact CB-O 3.44Å; L465-E467 PolarHBondContact O-N 3.19Å; L465-E467 VanDerWaalsContact O-N 3.15Å; E467-T471 VanDerWaalsContact OE1-CA 3.27Å; E467-T471 WeakPolarHBondContact OE1-CA 3.42Å; E467-T471 VanDerWaalsContact OE1-CB 3.24Å; E467-T471 WeakPolarHBondContact OE1-CB 3.14Å; E467-Y472 HydrophobicContact CB-CE2 4.48Å; E467-Y472 HydrophobicContact CG-CD2 3.69Å; E467-Y472 HydrophobicContact CG-CE2 3.98Å; E467-Y472 HydrophobicContact CG-CG 4.34Å; E467-Y472 PolarHBondContact OE1-N 2.88Å; E467-R543 PolarHBondContact O-NH2 3.41Å
468	P	92.3	Very high	91.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.215	C	C	.	.			trans	-54	148.7	168.4	21.1	-33.9	0	0	0	111.7	M470 T471 Y472 L541 R543	P468-M470 PolarHBondContact O-N 3.42Å; P468-T471 WeakPolarHBondContact O-CA 3.17Å; P468-T471 PolarHBondContact O-N 3.44Å; P468-Y472 VanDerWaalsContact CD-CE1 3.42Å; P468-Y472 HydrophobicContact CG-CD1 3.73Å; P468-Y472 HydrophobicContact CG-CE1 3.67Å; P468-Y472 HydrophobicContact CG-CE2 4.48Å; P468-Y472 HydrophobicContact CG-CG 4.17Å; P468-L541 WeakPolarHBondContact CB-O 3.28Å; P468-R543 HydrophobicContact CB-CB 4.17Å; P468-R543 HydrophobicContact CG-CB 4.34Å
469	L	94.3	Very high	91.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-29.9	-177.5	-171.1	64.9	0	0	0	112.2	L391 L462 L465 N505 V508 L509 L541	L391-L469 HydrophobicContact CD1-CD1 4.03Å; L391-L469 HydrophobicContact CD2-CD1 4.14Å; L462-L469 HydrophobicContact CD2-CD2 4.25Å; L465-L469 HydrophobicContact CD1-CD1 4.49Å; L469-N505 HydrophobicContact CD1-CB 4.13Å; L469-N505 WeakPolarHBondContact O-CB 3.43Å; L469-N505 PolarHBondContact O-ND2 2.95Å; L469-V508 HydrophobicContact CD1-CB 4.15Å; L469-V508 HydrophobicContact CD1-CG1 4.05Å; L469-V508 HydrophobicContact CD2-CG1 3.99Å; L469-L509 HydrophobicContact CD2-CB 3.88Å; L469-L509 HydrophobicContact CD2-CD1 3.89Å; L469-L509 HydrophobicContact CG-CB 4.39Å; L469-L541 HydrophobicContact CB-CD2 4.15Å; L469-L541 HydrophobicContact CD2-CD2 3.91Å
470	M	94.6	Very high	91.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	7.5	177.6	-61.8	-173.7	59.8	0	0	114.8	P468 F478 L509 L541 M542 V561 L565	P468-M470 PolarHBondContact O-N 3.42Å; M470-F478 HydrophobicContact CB-CD2 4.49Å; M470-F478 HydrophobicContact CB-CE2 4.34Å; M470-F478 HydrophobicContact CE-CB 4.3Å; M470-F478 HydrophobicContact CE-CD1 3.5Å; M470-F478 HydrophobicContact CE-CD2 3.67Å; M470-F478 HydrophobicContact CE-CE1 3.56Å; M470-F478 HydrophobicContact CE-CE2 3.73Å; M470-F478 HydrophobicContact CE-CG 3.56Å; M470-F478 HydrophobicContact CE-CZ 3.68Å; M470-L509 HydrophobicContact CG-CD1 4.47Å; M470-L509 HydrophobicContact CG-CD2 4.41Å; M470-L541 HydrophobicContact CG-CB 4.36Å; M470-L541 PolarHBondContact N-O 3.38Å; M470-L541 HydrophobicContact SD-CB 4.18Å; M470-M542 HydrophobicContact CB-CG 4.08Å; M470-M542 HydrophobicContact CE-CE 4.45Å; M470-M542 HydrophobicContact CE-CG 4.13Å; M470-M542 HydrophobicContact CE-SD 3.91Å; M470-M542 HydrophobicContact CG-CG 4.21Å; M470-M542 HydrophobicContact SD-CG 3.45Å; M470-M542 WeakPolarHBondContact SD-CG 3.21Å; M470-M542 HydrophobicContact SD-SD 3.85Å; M470-V561 HydrophobicContact CE-CG1 3.73Å; M470-L565 HydrophobicContact CE-CD1 3.91Å; M470-L565 HydrophobicContact SD-CD1 4.01Å
471	T	93	Very high	91.6	Very high	13 Å²	13	44.6 Å²	44.6	8%	0.08	24%	0.235	C	C	.	.			trans	65.5	148.5	-179.8	73	0	0	0	0	115.6	E467 P468 G473 L474 Y475 L501 P502	E467-T471 VanDerWaalsContact OE1-CA 3.27Å; E467-T471 WeakPolarHBondContact OE1-CA 3.42Å; E467-T471 VanDerWaalsContact OE1-CB 3.24Å; E467-T471 WeakPolarHBondContact OE1-CB 3.14Å; P468-T471 WeakPolarHBondContact O-CA 3.17Å; P468-T471 PolarHBondContact O-N 3.44Å; T471-G473 VanDerWaalsContact C-N 3.35Å; T471-L474 WeakPolarHBondContact OG1-CB 3.14Å; T471-L474 PolarHBondContact OG1-N 3.07Å; T471-Y475 PolarHBondContact O-N 3.05Å; T471-L501 HydrophobicContact CG2-CD2 4.01Å; T471-P502 HydrophobicContact CG2-CG 4.42Å
472	Y	89.6	Confident	91.5	Very high	78 Å²	78	44.6 Å²	44.6	31%	0.306	24%	0.236	S	C	.	.	S	Bend	trans	-70.1	-36.7	170.7	-65.4	-59.1	0	0	0	110.7	E467 P468 L474 Y475 R543 Q545	E467-Y472 HydrophobicContact CB-CE2 4.48Å; E467-Y472 HydrophobicContact CG-CD2 3.69Å; E467-Y472 HydrophobicContact CG-CE2 3.98Å; E467-Y472 HydrophobicContact CG-CG 4.34Å; E467-Y472 PolarHBondContact OE1-N 2.88Å; P468-Y472 VanDerWaalsContact CD-CE1 3.42Å; P468-Y472 HydrophobicContact CG-CD1 3.73Å; P468-Y472 HydrophobicContact CG-CE1 3.67Å; P468-Y472 HydrophobicContact CG-CE2 4.48Å; P468-Y472 HydrophobicContact CG-CG 4.17Å; Y472-L474 PolarHBondContact O-N 3.19Å; Y472-Y475 WeakPolarHBondContact O-CB 3.43Å; Y472-Y475 PolarHBondContact O-N 2.79Å; Y472-R543 WeakPolarHBondContact CD1-O 3.3Å; Y472-R543 WeakPolarHBondContact CE1-O 3.44Å; Y472-Q545 HydrophobicContact CD1-CB 3.89Å; Y472-Q545 HydrophobicContact CE1-CB 4.29Å; Y472-Q545 HydrophobicContact CG-CB 4.39Å
473	G	89.4	Confident	91.3	Very high	65 Å²	65	46.3 Å²	46.3	67%	0.67	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-41.8	-178.4	0	0	0	0	0	113.7	T471	T471-G473 VanDerWaalsContact C-N 3.35Å
474	L	92.9	Very high	90.9	Very high	19 Å²	19	41.5 Å²	41.5	10%	0.099	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-3.3	179.2	-60.3	175.5	0	0	0	113.9	T471 Y472 K476 E477 F478 K500 L501	T471-L474 WeakPolarHBondContact OG1-CB 3.14Å; T471-L474 PolarHBondContact OG1-N 3.07Å; Y472-L474 PolarHBondContact O-N 3.19Å; L474-K476 PolarHBondContact O-N 3.18Å; L474-E477 WeakPolarHBondContact CD2-OE1 3.4Å; L474-E477 WeakPolarHBondContact O-CA 3.47Å; L474-E477 WeakPolarHBondContact O-CB 3.32Å; L474-E477 PolarHBondContact O-N 3.28Å; L474-F478 HydrophobicContact CB-CD2 3.79Å; L474-F478 HydrophobicContact CB-CE2 3.7Å; L474-F478 HydrophobicContact CD1-CE2 4.1Å; L474-F478 WeakPolarHBondContact O-CD2 3.45Å; L474-F478 PolarHBondContact O-N 3.49Å; L474-K500 HydrophobicContact CD1-CB 3.98Å; L474-K500 HydrophobicContact CD2-CB 4.49Å; L474-K500 HydrophobicContact CD2-CD 4.04Å; L474-L501 HydrophobicContact CD1-CD2 3.86Å; L474-L501 HydrophobicContact CD1-CG 4.25Å
475	Y	92.1	Very high	90.5	Very high	18 Å²	18	42.2 Å²	42.2	7%	0.071	25%	0.248	C	C	.	.	H	α-helix	trans	-50	-54	-175.8	175.6	-91.2	0	0	0	112.5	T471 Y472 E477 F478 I479 M542 P544 D554 Q558	T471-Y475 PolarHBondContact O-N 3.05Å; Y472-Y475 WeakPolarHBondContact O-CB 3.43Å; Y472-Y475 PolarHBondContact O-N 2.79Å; Y475-E477 VanDerWaalsContact C-N 3.32Å; Y475-E477 PolarHBondContact O-N 2.98Å; Y475-F478 PolarHBondContact O-N 2.93Å; Y475-I479 HydrophobicContact CD1-CG1 4.33Å; Y475-I479 HydrophobicContact CE1-CG1 3.91Å; Y475-I479 HydrophobicContact CE2-CD1 4.48Å; Y475-I479 HydrophobicContact CE2-CG1 4.26Å; Y475-I479 VanDerWaalsContact O-CG1 3.32Å; Y475-I479 WeakPolarHBondContact O-CG1 3.21Å; Y475-I479 PolarHBondContact O-N 3.2Å; Y475-I479 VanDerWaalsContact O-N 3.09Å; Y475-M542 HydrophobicContact CD2-CB 4.18Å; Y475-M542 HydrophobicContact CD2-CE 4.18Å; Y475-M542 HydrophobicContact CE2-CB 4.11Å; Y475-M542 HydrophobicContact CE2-CE 4.36Å; Y475-M542 WeakPolarHBondContact CE2-O 3.44Å; Y475-P544 HydrophobicContact CE2-CB 4.45Å; Y475-D554 VanDerWaalsContact OH-CB 3.31Å; Y475-D554 WeakPolarHBondContact OH-CB 3.39Å; Y475-Q558 HydrophobicContact CE2-CG 4.26Å; Y475-Q558 PolarHBondContact OH-NE2 3.2Å
476	K	91.3	Very high	90.5	Very high	159 Å²	159	44.2 Å²	44.2	69%	0.691	26%	0.264	S	S	*	.	H	α-helix	trans	-66.6	-33	179.3	-67.7	-175.7	178.2	177.5	0	112.4	L474 I479 N480	L474-K476 PolarHBondContact O-N 3.18Å; K476-I479 PolarHBondContact O-N 3.32Å; K476-N480 PolarHBondContact O-N 3.24Å; K476-N480 VanDerWaalsContact O-N 3.12Å; K476-N480 PolarHBondContact O-ND2 3.16Å
477	E	93.6	Very high	90.7	Very high	80 Å²	80	42.6 Å²	42.6	37%	0.374	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-36.9	175.4	-67.7	-165.4	-132	0	0	112.2	L474 Y475 P481 L497 K500	L474-E477 WeakPolarHBondContact CD2-OE1 3.4Å; L474-E477 WeakPolarHBondContact O-CA 3.47Å; L474-E477 WeakPolarHBondContact O-CB 3.32Å; L474-E477 PolarHBondContact O-N 3.28Å; Y475-E477 VanDerWaalsContact C-N 3.32Å; Y475-E477 PolarHBondContact O-N 2.98Å; E477-P481 WeakPolarHBondContact O-CD 3.32Å; E477-P481 WeakPolarHBondContact O-CG 3.25Å; E477-L497 HydrophobicContact CB-CD1 4.17Å; E477-L497 HydrophobicContact CB-CD2 3.73Å; E477-L497 HydrophobicContact CG-CD2 4.49Å; E477-L497 WeakPolarHBondContact O-CD1 3.32Å; E477-L497 WeakPolarHBondContact OE2-CD2 3.36Å; E477-K500 IonicContact OE1-NZ 2.87Å; E477-K500 IonicContact OE2-NZ 3.81Å; E477-K500 PolarHBondContact OE2-NZ 3.38Å
478	F	94.6	Very high	90.8	Very high	0 Å²	0	45 Å²	45	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-73.4	-36.5	175	-80.3	-71.2	0	0	0	113.2	M470 L474 Y475 I494 L497 V498 L501 M542 V561	M470-F478 HydrophobicContact CB-CD2 4.49Å; M470-F478 HydrophobicContact CB-CE2 4.34Å; M470-F478 HydrophobicContact CE-CB 4.3Å; M470-F478 HydrophobicContact CE-CD1 3.5Å; M470-F478 HydrophobicContact CE-CD2 3.67Å; M470-F478 HydrophobicContact CE-CE1 3.56Å; M470-F478 HydrophobicContact CE-CE2 3.73Å; M470-F478 HydrophobicContact CE-CG 3.56Å; M470-F478 HydrophobicContact CE-CZ 3.68Å; L474-F478 HydrophobicContact CB-CD2 3.79Å; L474-F478 HydrophobicContact CB-CE2 3.7Å; L474-F478 HydrophobicContact CD1-CE2 4.1Å; L474-F478 WeakPolarHBondContact O-CD2 3.45Å; L474-F478 PolarHBondContact O-N 3.49Å; Y475-F478 PolarHBondContact O-N 2.93Å; F478-I494 HydrophobicContact CE1-CG2 4.42Å; F478-L497 HydrophobicContact CD1-CB 3.9Å; F478-L497 HydrophobicContact CD1-CD1 3.87Å; F478-L497 HydrophobicContact CE1-CB 3.37Å; F478-L497 HydrophobicContact CE1-CD1 4.23Å; F478-L497 HydrophobicContact CE1-CG 4.45Å; F478-L497 HydrophobicContact CE2-CB 4.23Å; F478-L497 HydrophobicContact CG-CD1 4.19Å; F478-L497 HydrophobicContact CZ-CB 3.55Å; F478-V498 HydrophobicContact CE1-CG2 4.16Å; F478-V498 HydrophobicContact CZ-CG2 4.38Å; F478-L501 HydrophobicContact CE2-CD2 4.29Å; F478-L501 HydrophobicContact CZ-CD1 4.2Å; F478-L501 HydrophobicContact CZ-CG 4.33Å; F478-M542 HydrophobicContact CB-CE 3.53Å; F478-M542 HydrophobicContact CG-CE 4.41Å; F478-V561 HydrophobicContact CB-CG1 4.39Å; F478-V561 HydrophobicContact CB-CG2 4.47Å; F478-V561 HydrophobicContact CD1-CG1 4.07Å; F478-V561 VanDerWaalsContact O-CG2 3.24Å; F478-V561 WeakPolarHBondContact O-CG2 3.45Å
479	I	93.1	Very high	90.8	Very high	2 Å²	2	48 Å²	48	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-70.2	-42.1	-178.9	-68.2	-67	0	0	0	112.4	Y475 K476 A482 K483 M542 D554 F557 Q558	Y475-I479 HydrophobicContact CD1-CG1 4.33Å; Y475-I479 HydrophobicContact CE1-CG1 3.91Å; Y475-I479 HydrophobicContact CE2-CD1 4.48Å; Y475-I479 HydrophobicContact CE2-CG1 4.26Å; Y475-I479 VanDerWaalsContact O-CG1 3.32Å; Y475-I479 WeakPolarHBondContact O-CG1 3.21Å; Y475-I479 PolarHBondContact O-N 3.2Å; Y475-I479 VanDerWaalsContact O-N 3.09Å; K476-I479 PolarHBondContact O-N 3.32Å; I479-A482 WeakPolarHBondContact O-CB 3.33Å; I479-A482 PolarHBondContact O-N 2.95Å; I479-K483 HydrophobicContact CG2-CD 4.22Å; I479-K483 VanDerWaalsContact CG2-CE 3.48Å; I479-K483 HydrophobicContact CG2-CG 4.4Å; I479-K483 PolarHBondContact O-N 2.96Å; I479-M542 HydrophobicContact CD1-CE 3.8Å; I479-M542 HydrophobicContact CG1-CE 3.95Å; I479-D554 HydrophobicContact CD1-CB 4.43Å; I479-F557 HydrophobicContact CD1-CB 3.97Å; I479-F557 HydrophobicContact CG2-CB 4.24Å; I479-Q558 HydrophobicContact CD1-CB 4.42Å; I479-Q558 HydrophobicContact CD1-CG 3.62Å
480	N	92.3	Very high	90.8	Very high	107 Å²	107	49 Å²	49	57%	0.572	29%	0.289	S	S	*	.	H	α-helix	trans	-58	-44.6	-173.5	-72.9	-16.7	0	0	0	114	K476 A482 K483	K476-N480 PolarHBondContact O-N 3.24Å; K476-N480 VanDerWaalsContact O-N 3.12Å; K476-N480 PolarHBondContact O-ND2 3.16Å; N480-A482 VanDerWaalsContact C-N 3.32Å; N480-A482 PolarHBondContact O-N 3.32Å; N480-K483 PolarHBondContact O-N 3.22Å
481	P	92	Very high	90.8	Very high	25 Å²	25	49.9 Å²	49.9	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-60.8	-34.5	171.5	-24.9	34.3	0	0	0	113.7	E477 K483 G484 R490 A493 L497	E477-P481 WeakPolarHBondContact O-CD 3.32Å; E477-P481 WeakPolarHBondContact O-CG 3.25Å; P481-K483 PolarHBondContact O-N 3.39Å; P481-G484 PolarHBondContact O-N 2.7Å; P481-R490 WeakPolarHBondContact O-CD 3.4Å; P481-R490 WeakPolarHBondContact O-CG 3.5Å; P481-A493 HydrophobicContact CB-CB 3.89Å; P481-A493 HydrophobicContact CG-CB 3.72Å; P481-L497 HydrophobicContact CG-CD1 4.46Å
482	A	91.4	Very high	90.8	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-68.9	-20.3	179.1	0	0	0	0	0	113.2	I479 N480 F557 I560 V561	I479-A482 WeakPolarHBondContact O-CB 3.33Å; I479-A482 PolarHBondContact O-N 2.95Å; N480-A482 VanDerWaalsContact C-N 3.32Å; N480-A482 PolarHBondContact O-N 3.32Å; A482-F557 HydrophobicContact CB-CB 3.93Å; A482-F557 HydrophobicContact CB-CD1 4.3Å; A482-F557 WeakPolarHBondContact O-CD1 3.4Å; A482-I560 HydrophobicContact CB-CB 4.28Å; A482-I560 HydrophobicContact CB-CG2 3.99Å; A482-V561 HydrophobicContact CB-CG2 3.78Å
483	K	89.6	Confident	91	Very high	36 Å²	36	51.7 Å²	51.7	16%	0.157	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-16.2	177.7	-66.7	-172.7	172.6	-175	0	114.5	D74 A75 I479 N480 P481 D554 F557	D74-K483 WeakPolarHBondContact OD1-CE 3.33Å; D74-K483 IonicContact OD1-NZ 2.63Å; D74-K483 PolarHBondContact OD1-NZ 2.99Å; D74-K483 IonicContact OD2-NZ 3.76Å; D74-K483 PolarHBondContact OD2-NZ 3.47Å; A75-K483 HydrophobicContact CB-CB 3.89Å; A75-K483 HydrophobicContact CB-CD 4.45Å; A75-K483 HydrophobicContact CB-CG 4.19Å; I479-K483 HydrophobicContact CG2-CD 4.22Å; I479-K483 VanDerWaalsContact CG2-CE 3.48Å; I479-K483 HydrophobicContact CG2-CG 4.4Å; I479-K483 PolarHBondContact O-N 2.96Å; N480-K483 PolarHBondContact O-N 3.22Å; P481-K483 PolarHBondContact O-N 3.39Å; K483-D554 WeakPolarHBondContact CE-OD1 3.15Å; K483-D554 IonicContact NZ-OD1 3.55Å; K483-D554 PolarHBondContact NZ-OD1 3.38Å; K483-F557 HydrophobicContact CB-CE1 4.34Å; K483-F557 HydrophobicContact CD-CD2 4.26Å; K483-F557 HydrophobicContact CD-CE2 4.16Å; K483-F557 VanDerWaalsContact CE-CE2 3.49Å; K483-F557 HydrophobicContact CG-CD1 3.85Å; K483-F557 HydrophobicContact CG-CD2 3.83Å; K483-F557 HydrophobicContact CG-CE1 3.85Å; K483-F557 HydrophobicContact CG-CE2 3.83Å; K483-F557 HydrophobicContact CG-CG 3.85Å; K483-F557 HydrophobicContact CG-CZ 3.84Å
484	G	81.8	Confident	91.3	Very high	30 Å²	30	48.6 Å²	48.6	31%	0.309	28%	0.277	S	S	.	.	S	Bend	trans	-178.4	-176.7	-179.7	0	0	0	0	0	116	P481	P481-G484 PolarHBondContact O-N 2.7Å
485	G	81.2	Confident	91.4	Very high	58 Å²	58	48.2 Å²	48.2	60%	0.598	28%	0.275	S	S	*	.	S	Bend	trans	88.2	176.1	-174.5	0	0	0	0	0	113.7
486	S	88.6	Confident	91.5	Very high	55 Å²	55	50.5 Å²	50.5	39%	0.385	29%	0.286	S	S	.	.			trans	-75.7	156.4	178.4	90.4	0	0	0	0	111.5	E488 S489 R490	S486-E488 VanDerWaalsContact CB-OE2 3.32Å; S486-E488 WeakPolarHBondContact CB-OE2 3.29Å; S486-E488 PolarHBondContact O-N 2.87Å; S486-E488 PolarHBondContact OG-N 2.84Å; S486-E488 PolarHBondContact OG-OE2 3.24Å; S486-S489 PolarHBondContact O-N 2.73Å; S486-S489 VanDerWaalsContact O-N 3.1Å; S486-S489 PolarHBondContact OG-N 3.32Å; S486-R490 WeakPolarHBondContact O-CG 3.35Å; S486-R490 PolarHBondContact O-N 2.91Å
487	P	89.2	Confident	91.7	Very high	67 Å²	67	43.5 Å²	43.5	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-48	-45.3	173.9	-27.6	35.3	0	0	0	113.3	S489 R490 I491	P487-S489 PolarHBondContact O-N 2.77Å; P487-R490 PolarHBondContact O-N 3.25Å; P487-I491 WeakPolarHBondContact O-CD1 3.49Å; P487-I491 WeakPolarHBondContact O-CG1 3.45Å; P487-I491 PolarHBondContact O-N 3.24Å
488	E	90.6	Very high	91.8	Very high	129 Å²	129	39.7 Å²	39.7	60%	0.603	24%	0.238	S	C	*	.	H	α-helix	trans	-64.4	-42.3	-179.5	-55.4	73.6	-161.7	0	0	112.2	S486 I491 Q492	S486-E488 VanDerWaalsContact CB-OE2 3.32Å; S486-E488 WeakPolarHBondContact CB-OE2 3.29Å; S486-E488 PolarHBondContact O-N 2.87Å; S486-E488 PolarHBondContact OG-N 2.84Å; S486-E488 PolarHBondContact OG-OE2 3.24Å; E488-I491 PolarHBondContact O-N 3.48Å; E488-Q492 WeakPolarHBondContact O-CB 3.33Å; E488-Q492 PolarHBondContact O-N 3.47Å
489	S	92.8	Very high	91.8	Very high	65 Å²	65	42.3 Å²	42.3	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-41.1	177.2	-179.4	0	0	0	0	111.4	S486 P487 Q492 A493	S486-S489 PolarHBondContact O-N 2.73Å; S486-S489 VanDerWaalsContact O-N 3.1Å; S486-S489 PolarHBondContact OG-N 3.32Å; P487-S489 PolarHBondContact O-N 2.77Å; S489-Q492 PolarHBondContact O-N 3.17Å; S489-A493 WeakPolarHBondContact O-CB 3.36Å; S489-A493 PolarHBondContact O-N 2.97Å
490	R	93.9	Very high	91.9	Very high	21 Å²	21	48 Å²	48	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-64.5	-47.1	175.9	-63.2	-173.6	-64.9	-165.6	-6.3	112.1	D78 P481 S486 P487 Q492 A493 I494 I564	D78-R490 IonicContact OD1-NH1 2.8Å; D78-R490 IonicContact OD2-CZ 2.84Å; D78-R490 IonicContact OD2-NH1 3.23Å; D78-R490 PolarHBondContact OD2-NH1 3.23Å; D78-R490 IonicContact OD2-NH2 2.84Å; D78-R490 PolarHBondContact OD2-NH2 3.02Å; P481-R490 WeakPolarHBondContact O-CD 3.4Å; P481-R490 WeakPolarHBondContact O-CG 3.5Å; S486-R490 WeakPolarHBondContact O-CG 3.35Å; S486-R490 PolarHBondContact O-N 2.91Å; P487-R490 PolarHBondContact O-N 3.25Å; R490-Q492 VanDerWaalsContact C-N 3.31Å; R490-Q492 PolarHBondContact O-N 3.44Å; R490-A493 PolarHBondContact O-N 2.81Å; R490-I494 WeakPolarHBondContact O-CB 3.45Å; R490-I494 WeakPolarHBondContact O-CG1 3.39Å; R490-I494 PolarHBondContact O-N 3.24Å; R490-I564 HydrophobicContact CB-CD1 4.1Å
491	I	94.4	Very high	92.1	Very high	20 Å²	20	43.2 Å²	43.2	10%	0.103	25%	0.25	C	C	.	.	H	α-helix	trans	-58.3	-45	175.9	-65.3	157.8	0	0	0	110.3	P487 E488 H495 I564 H568	P487-I491 WeakPolarHBondContact O-CD1 3.49Å; P487-I491 WeakPolarHBondContact O-CG1 3.45Å; P487-I491 PolarHBondContact O-N 3.24Å; E488-I491 PolarHBondContact O-N 3.48Å; I491-H495 VanDerWaalsContact O-CB 3.25Å; I491-H495 WeakPolarHBondContact O-CB 3.38Å; I491-H495 PolarHBondContact O-N 3.28Å; I491-I564 HydrophobicContact CG1-CG2 3.98Å; I491-H568 VanDerWaalsContact CD1-NE2 3.29Å; I491-H568 WeakPolarHBondContact CD1-NE2 3.32Å; I491-H568 HydrophobicContact CG2-CB 4.37Å
492	Q	92.8	Very high	92.2	Very high	96 Å²	96	45.2 Å²	45.2	45%	0.449	26%	0.263	S	S	.	.	H	α-helix	trans	-66	-42.8	179.1	-171.3	174.4	17.4	0	0	112	E488 S489 R490 H495 H496	E488-Q492 WeakPolarHBondContact O-CB 3.33Å; E488-Q492 PolarHBondContact O-N 3.47Å; S489-Q492 PolarHBondContact O-N 3.17Å; R490-Q492 VanDerWaalsContact C-N 3.31Å; R490-Q492 PolarHBondContact O-N 3.44Å; Q492-H495 PolarHBondContact O-N 3.35Å; Q492-H496 PolarHBondContact O-N 3.31Å; Q492-H496 VanDerWaalsContact O-N 3.13Å; Q492-H496 PolarHBondContact O-ND1 3.48Å
493	A	94	Very high	92.2	Very high	32 Å²	32	50.8 Å²	50.8	26%	0.264	29%	0.289	S	S	.	.	H	α-helix	trans	-61.6	-49.9	176.5	0	0	0	0	0	111.5	P481 S489 R490 H495 H496 L497	P481-A493 HydrophobicContact CB-CB 3.89Å; P481-A493 HydrophobicContact CG-CB 3.72Å; S489-A493 WeakPolarHBondContact O-CB 3.36Å; S489-A493 PolarHBondContact O-N 2.97Å; R490-A493 PolarHBondContact O-N 2.81Å; A493-H495 VanDerWaalsContact C-N 3.31Å; A493-H495 PolarHBondContact O-N 2.68Å; A493-H496 PolarHBondContact O-N 2.87Å; A493-L497 VanDerWaalsContact O-CG 3.31Å; A493-L497 WeakPolarHBondContact O-CG 3.43Å; A493-L497 PolarHBondContact O-N 2.83Å
494	I	95.7	Very high	92.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-38.6	178.3	-69.3	167.1	0	0	0	111.1	F478 R490 H496 L497 V498 V561 I564 L565 I572	F478-I494 HydrophobicContact CE1-CG2 4.42Å; R490-I494 WeakPolarHBondContact O-CB 3.45Å; R490-I494 WeakPolarHBondContact O-CG1 3.39Å; R490-I494 PolarHBondContact O-N 3.24Å; I494-H496 PolarHBondContact O-N 2.9Å; I494-L497 PolarHBondContact O-N 3.49Å; I494-V498 HydrophobicContact CG2-CG2 4.37Å; I494-V498 WeakPolarHBondContact O-CG2 3.39Å; I494-V498 PolarHBondContact O-N 2.82Å; I494-V561 HydrophobicContact CD1-CG1 4.35Å; I494-V561 HydrophobicContact CD1-CG2 4.35Å; I494-I564 HydrophobicContact CD1-CB 4.06Å; I494-I564 HydrophobicContact CD1-CD1 3.66Å; I494-I564 HydrophobicContact CD1-CG1 4.46Å; I494-I564 HydrophobicContact CD1-CG2 3.81Å; I494-I564 HydrophobicContact CG2-CG2 4.47Å; I494-L565 HydrophobicContact CG2-CD2 3.55Å; I494-L565 HydrophobicContact CG2-CG 4.05Å; I494-I572 HydrophobicContact CG2-CD1 4.26Å
495	H	95.3	Very high	93.1	Very high	11 Å²	11	54.4 Å²	54.4	5%	0.051	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-46.9	174.4	-175.8	-165.8	0	0	0	112.1	I491 Q492 A493 L497 V498 H499 I572 D575	I491-H495 VanDerWaalsContact O-CB 3.25Å; I491-H495 WeakPolarHBondContact O-CB 3.38Å; I491-H495 PolarHBondContact O-N 3.28Å; Q492-H495 PolarHBondContact O-N 3.35Å; A493-H495 VanDerWaalsContact C-N 3.31Å; A493-H495 PolarHBondContact O-N 2.68Å; H495-L497 PolarHBondContact O-N 3.13Å; H495-V498 PolarHBondContact O-N 3.16Å; H495-H499 AromaticContact CD2-CD2 3.66Å; H495-H499 AromaticContact CD2-NE2 3.33Å; H495-H499 PolarHBondContact CD2-NE2 2.85Å; H495-H499 VanDerWaalsContact CD2-NE2 3.33Å; H495-H499 AromaticContact NE2-CD2 3.95Å; H495-H499 AromaticContact NE2-NE2 3.14Å; H495-H499 PolarHBondContact NE2-NE2 3.43Å; H495-H499 VanDerWaalsContact NE2-NE2 3.14Å; H495-H499 PolarHBondContact O-CD2 3.35Å; H495-H499 VanDerWaalsContact O-CD2 3.3Å; H495-H499 PolarHBondContact O-N 3.01Å; H495-I572 HydrophobicContact CB-CG1 4.24Å; H495-I572 PolarHBondContact CD2-O 2.79Å; H495-I572 VanDerWaalsContact CD2-O 3.24Å; H495-D575 PolarHBondContact CE1-O 3.14Å; H495-D575 PolarHBondContact NE2-O 3.49Å
496	H	94	Very high	93.8	Very high	67 Å²	67	54.3 Å²	54.3	31%	0.31	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-40.9	176	-72.8	80.5	0	0	0	112.3	Q492 A493 I494 H499 K500	Q492-H496 PolarHBondContact O-N 3.31Å; Q492-H496 VanDerWaalsContact O-N 3.13Å; Q492-H496 PolarHBondContact O-ND1 3.48Å; A493-H496 PolarHBondContact O-N 2.87Å; I494-H496 PolarHBondContact O-N 2.9Å; H496-H499 PolarHBondContact O-N 3.34Å; H496-K500 PolarHBondContact O-N 3.21Å
497	L	95.6	Very high	94.1	Very high	11 Å²	11	55.5 Å²	55.5	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-68.2	-36.5	-179.2	-65.4	171.5	0	0	0	112.8	E477 F478 P481 A493 I494 H495 H499 K500 L501	E477-L497 HydrophobicContact CB-CD1 4.17Å; E477-L497 HydrophobicContact CB-CD2 3.73Å; E477-L497 HydrophobicContact CG-CD2 4.49Å; E477-L497 WeakPolarHBondContact O-CD1 3.32Å; E477-L497 WeakPolarHBondContact OE2-CD2 3.36Å; F478-L497 HydrophobicContact CD1-CB 3.9Å; F478-L497 HydrophobicContact CD1-CD1 3.87Å; F478-L497 HydrophobicContact CE1-CB 3.37Å; F478-L497 HydrophobicContact CE1-CD1 4.23Å; F478-L497 HydrophobicContact CE1-CG 4.45Å; F478-L497 HydrophobicContact CE2-CB 4.23Å; F478-L497 HydrophobicContact CG-CD1 4.19Å; F478-L497 HydrophobicContact CZ-CB 3.55Å; P481-L497 HydrophobicContact CG-CD1 4.46Å; A493-L497 VanDerWaalsContact O-CG 3.31Å; A493-L497 WeakPolarHBondContact O-CG 3.43Å; A493-L497 PolarHBondContact O-N 2.83Å; I494-L497 PolarHBondContact O-N 3.49Å; H495-L497 PolarHBondContact O-N 3.13Å; L497-H499 PolarHBondContact O-N 3.09Å; L497-K500 HydrophobicContact CD2-CD 4.06Å; L497-K500 WeakPolarHBondContact O-CB 3.26Å; L497-K500 PolarHBondContact O-N 2.86Å; L497-L501 PolarHBondContact O-N 3.25Å
498	V	96.3	Very high	94.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.6	-34.3	173.2	167.2	0	0	0	0	111.9	F478 I494 H495 K500 L501 R506 L509 L565 I572 F573	F478-V498 HydrophobicContact CE1-CG2 4.16Å; F478-V498 HydrophobicContact CZ-CG2 4.38Å; I494-V498 HydrophobicContact CG2-CG2 4.37Å; I494-V498 WeakPolarHBondContact O-CG2 3.39Å; I494-V498 PolarHBondContact O-N 2.82Å; H495-V498 PolarHBondContact O-N 3.16Å; V498-K500 VanDerWaalsContact C-N 3.31Å; V498-L501 WeakPolarHBondContact O-CB 3.39Å; V498-L501 PolarHBondContact O-N 3.37Å; V498-R506 HydrophobicContact CG1-CG 4.12Å; V498-R506 WeakPolarHBondContact O-CD 3.4Å; V498-L509 HydrophobicContact CG2-CD2 4.44Å; V498-L565 HydrophobicContact CG2-CD2 3.52Å; V498-I572 HydrophobicContact CB-CG2 3.9Å; V498-I572 HydrophobicContact CG1-CG2 3.92Å; V498-I572 HydrophobicContact CG2-CG2 3.77Å; V498-F573 HydrophobicContact CG1-CD1 3.84Å; V498-F573 HydrophobicContact CG1-CE1 3.42Å; V498-F573 VanDerWaalsContact CG1-CE1 3.42Å; V498-F573 HydrophobicContact CG1-CZ 3.84Å; V498-F573 HydrophobicContact CG2-CZ 4.28Å
499	H	94	Very high	94.7	Very high	56 Å²	56	46.3 Å²	46.3	26%	0.259	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-6.7	175	-75.2	-108.4	0	0	0	114	H495 H496 L497 R506 I572 D575 P577	H495-H499 AromaticContact CD2-CD2 3.66Å; H495-H499 AromaticContact CD2-NE2 3.33Å; H495-H499 PolarHBondContact CD2-NE2 2.85Å; H495-H499 VanDerWaalsContact CD2-NE2 3.33Å; H495-H499 AromaticContact NE2-CD2 3.95Å; H495-H499 AromaticContact NE2-NE2 3.14Å; H495-H499 PolarHBondContact NE2-NE2 3.43Å; H495-H499 VanDerWaalsContact NE2-NE2 3.14Å; H495-H499 PolarHBondContact O-CD2 3.35Å; H495-H499 VanDerWaalsContact O-CD2 3.3Å; H495-H499 PolarHBondContact O-N 3.01Å; H496-H499 PolarHBondContact O-N 3.34Å; L497-H499 PolarHBondContact O-N 3.09Å; H499-R506 PolarHBondContact CE1-NH1 2.83Å; H499-R506 VanDerWaalsContact CE1-NH1 3.34Å; H499-R506 PolarHBondContact ND1-NH1 3.49Å; H499-R506 VanDerWaalsContact ND1-NH1 3.14Å; H499-I572 VanDerWaalsContact NE2-C 3.31Å; H499-I572 PolarHBondContact NE2-O 3.11Å; H499-D575 PolarHBondContact CE1-O 3.04Å; H499-D575 PolarHBondContact NE2-O 2.95Å; H499-P577 HydrophobicContact CB-CG 3.85Å
500	K	94.8	Very high	94.9	Very high	120 Å²	120	44 Å²	44	52%	0.522	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-16.5	164.9	-65.8	-173.1	-177.3	-179.4	0	113.4	L474 E477 H496 L497 V498	L474-K500 HydrophobicContact CD1-CB 3.98Å; L474-K500 HydrophobicContact CD2-CB 4.49Å; L474-K500 HydrophobicContact CD2-CD 4.04Å; E477-K500 IonicContact OE1-NZ 2.87Å; E477-K500 IonicContact OE2-NZ 3.81Å; E477-K500 PolarHBondContact OE2-NZ 3.38Å; H496-K500 PolarHBondContact O-N 3.21Å; L497-K500 HydrophobicContact CD2-CD 4.06Å; L497-K500 WeakPolarHBondContact O-CB 3.26Å; L497-K500 PolarHBondContact O-N 2.86Å; V498-K500 VanDerWaalsContact C-N 3.31Å
501	L	95.6	Very high	95.1	Very high	8 Å²	8	45.5 Å²	45.5	4%	0.042	22%	0.224	C	C	.	.	S	Bend	trans	-65.6	149.7	-178.3	-73	168.2	0	0	0	111.5	T471 L474 F478 L497 V498 N505 R506 L509	T471-L501 HydrophobicContact CG2-CD2 4.01Å; L474-L501 HydrophobicContact CD1-CD2 3.86Å; L474-L501 HydrophobicContact CD1-CG 4.25Å; F478-L501 HydrophobicContact CE2-CD2 4.29Å; F478-L501 HydrophobicContact CZ-CD1 4.2Å; F478-L501 HydrophobicContact CZ-CG 4.33Å; L497-L501 PolarHBondContact O-N 3.25Å; V498-L501 WeakPolarHBondContact O-CB 3.39Å; V498-L501 PolarHBondContact O-N 3.37Å; L501-N505 HydrophobicContact CB-CB 4.4Å; L501-R506 HydrophobicContact CB-CB 4.28Å; L501-L509 HydrophobicContact CD1-CD2 3.71Å
502	P	95.2	Very high	95.2	Very high	66 Å²	66	44.6 Å²	44.6	43%	0.429	22%	0.219	S	C	.	.			trans	-55.6	146.7	170.5	-21.8	31.6	0	0	0	111.8	T471 R504 N505 R506	T471-P502 HydrophobicContact CG2-CG 4.42Å; P502-R504 PolarHBondContact O-N 3.39Å; P502-N505 HydrophobicContact CB-CB 4.4Å; P502-N505 WeakPolarHBondContact O-CA 3.34Å; P502-N505 WeakPolarHBondContact O-CB 3.31Å; P502-N505 PolarHBondContact O-N 2.89Å; P502-R506 PolarHBondContact O-N 3.46Å
503	E	92.3	Very high	95.5	Very high	119 Å²	119	40 Å²	40	56%	0.556	20%	0.198	S	C	*	.	H	α-helix	trans	-59	-41.9	-167.6	-171.8	59	-160.9	0	0	113.7	R506 L507	E503-R506 PolarHBondContact O-N 3.02Å; E503-R506 IonicContact OE1-CZ 2.72Å; E503-R506 IonicContact OE1-NE 3.18Å; E503-R506 IonicContact OE1-NH2 2.66Å; E503-R506 PolarHBondContact OE1-NH2 3.04Å; E503-R506 IonicContact OE2-CZ 3.51Å; E503-R506 VanDerWaalsContact OE2-CZ 3.23Å; E503-R506 IonicContact OE2-NE 3.2Å; E503-R506 PolarHBondContact OE2-NE 3.28Å; E503-R506 VanDerWaalsContact OE2-NE 3.07Å; E503-R506 IonicContact OE2-NH2 3.49Å; E503-R506 PolarHBondContact OE2-NH2 3.31Å; E503-L507 WeakPolarHBondContact O-CB 3.47Å; E503-L507 PolarHBondContact O-N 2.84Å
504	R	93	Very high	95.7	Very high	120 Å²	120	45.1 Å²	45.1	45%	0.453	21%	0.214	S	C	.	.	H	α-helix	trans	-65.3	-38.2	175.2	-79.8	-160.1	165.7	109.2	-9	112.3	L391 D393 P502 L507 V508	L391-R504 HydrophobicContact CD2-CB 3.87Å; L391-R504 HydrophobicContact CG-CB 4.31Å; L391-R504 WeakPolarHBondContact O-CD 3.22Å; D393-R504 IonicContact OD1-CZ 3.98Å; D393-R504 IonicContact OD1-NE 2.88Å; D393-R504 IonicContact OD1-NH2 2.66Å; D393-R504 PolarHBondContact OD1-NH2 3.37Å; D393-R504 IonicContact OD2-NH2 3.65Å; D393-R504 PolarHBondContact OD2-NH2 3.45Å; P502-R504 PolarHBondContact O-N 3.39Å; R504-L507 PolarHBondContact O-N 2.89Å; R504-V508 WeakPolarHBondContact O-CG2 3.39Å; R504-V508 PolarHBondContact O-N 3.04Å
505	N	95.6	Very high	95.8	Very high	21 Å²	21	45.2 Å²	45.2	11%	0.112	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-48.7	175.4	-64.3	55.6	0	0	0	110.7	L391 L469 L501 P502 L507 V508 L509	L391-N505 HydrophobicContact CD2-CB 4.29Å; L391-N505 VanDerWaalsContact CD2-OD1 3.23Å; L391-N505 WeakPolarHBondContact CD2-OD1 2.91Å; L469-N505 HydrophobicContact CD1-CB 4.13Å; L469-N505 WeakPolarHBondContact O-CB 3.43Å; L469-N505 PolarHBondContact O-ND2 2.95Å; L501-N505 HydrophobicContact CB-CB 4.4Å; P502-N505 HydrophobicContact CB-CB 4.4Å; P502-N505 WeakPolarHBondContact O-CA 3.34Å; P502-N505 WeakPolarHBondContact O-CB 3.31Å; P502-N505 PolarHBondContact O-N 2.89Å; N505-L507 VanDerWaalsContact C-N 3.35Å; N505-L507 PolarHBondContact O-N 3.37Å; N505-V508 PolarHBondContact O-N 2.92Å; N505-L509 WeakPolarHBondContact O-CB 3.2Å; N505-L509 PolarHBondContact O-N 2.95Å
506	R	95.7	Very high	95.9	Very high	56 Å²	56	44.7 Å²	44.7	21%	0.211	21%	0.212	C	C	.	.	H	α-helix	trans	-59.4	-43.2	177.9	-171.2	174.7	69.3	132.5	3.4	111.9	V498 H499 L501 P502 E503 G510	V498-R506 HydrophobicContact CG1-CG 4.12Å; V498-R506 WeakPolarHBondContact O-CD 3.4Å; H499-R506 PolarHBondContact CE1-NH1 2.83Å; H499-R506 VanDerWaalsContact CE1-NH1 3.34Å; H499-R506 PolarHBondContact ND1-NH1 3.49Å; H499-R506 VanDerWaalsContact ND1-NH1 3.14Å; L501-R506 HydrophobicContact CB-CB 4.28Å; P502-R506 PolarHBondContact O-N 3.46Å; E503-R506 PolarHBondContact O-N 3.02Å; E503-R506 IonicContact OE1-CZ 2.72Å; E503-R506 IonicContact OE1-NE 3.18Å; E503-R506 IonicContact OE1-NH2 2.66Å; E503-R506 PolarHBondContact OE1-NH2 3.04Å; E503-R506 IonicContact OE2-CZ 3.51Å; E503-R506 VanDerWaalsContact OE2-CZ 3.23Å; E503-R506 IonicContact OE2-NE 3.2Å; E503-R506 PolarHBondContact OE2-NE 3.28Å; E503-R506 VanDerWaalsContact OE2-NE 3.07Å; E503-R506 IonicContact OE2-NH2 3.49Å; E503-R506 PolarHBondContact OE2-NH2 3.31Å; R506-G510 PolarHBondContact O-N 3.33Å
507	L	94.8	Very high	96.1	Very high	80 Å²	80	42.5 Å²	42.5	42%	0.419	21%	0.206	S	C	.	.	H	α-helix	trans	-62.8	-51.1	177.3	178.4	64.7	0	0	0	112.4	L396 E503 R504 N505 L509 G510 L511	L396-L507 HydrophobicContact CD1-CD2 4.28Å; L396-L507 HydrophobicContact CD2-CD2 4.03Å; E503-L507 WeakPolarHBondContact O-CB 3.47Å; E503-L507 PolarHBondContact O-N 2.84Å; R504-L507 PolarHBondContact O-N 2.89Å; N505-L507 VanDerWaalsContact C-N 3.35Å; N505-L507 PolarHBondContact O-N 3.37Å; L507-L509 VanDerWaalsContact C-N 3.35Å; L507-G510 PolarHBondContact O-N 3.01Å; L507-L511 WeakPolarHBondContact O-CG 3.46Å; L507-L511 PolarHBondContact O-N 2.83Å
508	V	96.2	Very high	96.2	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-65.6	-39.7	179.9	170.7	0	0	0	0	111	L391 L396 V399 L462 L469 R504 N505 L511 L512	L391-V508 HydrophobicContact CD1-CB 4.31Å; L391-V508 HydrophobicContact CD1-CG1 4.31Å; L391-V508 HydrophobicContact CD1-CG2 3.96Å; L396-V508 HydrophobicContact CD1-CG2 3.74Å; V399-V508 HydrophobicContact CG1-CG1 4.45Å; V399-V508 HydrophobicContact CG2-CG1 4.25Å; L462-V508 HydrophobicContact CD2-CG1 4.33Å; L469-V508 HydrophobicContact CD1-CB 4.15Å; L469-V508 HydrophobicContact CD1-CG1 4.05Å; L469-V508 HydrophobicContact CD2-CG1 3.99Å; R504-V508 WeakPolarHBondContact O-CG2 3.39Å; R504-V508 PolarHBondContact O-N 3.04Å; N505-V508 PolarHBondContact O-N 2.92Å; V508-L511 PolarHBondContact O-N 3.49Å; V508-L512 WeakPolarHBondContact O-CB 3.36Å; V508-L512 PolarHBondContact O-N 3.25Å
509	L	97.4	Very high	96.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-45.5	175.3	-173.2	68.6	0	0	0	111.1	L469 M470 V498 L501 N505 L507 L511 L512 M513 L541 L565 F573	L469-L509 HydrophobicContact CD2-CB 3.88Å; L469-L509 HydrophobicContact CD2-CD1 3.89Å; L469-L509 HydrophobicContact CG-CB 4.39Å; M470-L509 HydrophobicContact CG-CD1 4.47Å; M470-L509 HydrophobicContact CG-CD2 4.41Å; V498-L509 HydrophobicContact CG2-CD2 4.44Å; L501-L509 HydrophobicContact CD1-CD2 3.71Å; N505-L509 WeakPolarHBondContact O-CB 3.2Å; N505-L509 PolarHBondContact O-N 2.95Å; L507-L509 VanDerWaalsContact C-N 3.35Å; L509-L511 PolarHBondContact O-N 3.39Å; L509-L512 PolarHBondContact O-N 2.82Å; L509-M513 HydrophobicContact CD1-CE 4.01Å; L509-M513 HydrophobicContact CD1-CG 4.29Å; L509-M513 HydrophobicContact CG-CG 4.26Å; L509-M513 VanDerWaalsContact O-CG 3.28Å; L509-M513 WeakPolarHBondContact O-CG 3.39Å; L509-M513 PolarHBondContact O-N 3.07Å; L509-L541 HydrophobicContact CD1-CD1 4.02Å; L509-L565 HydrophobicContact CD2-CD1 4.41Å; L509-F573 HydrophobicContact CB-CE1 4.11Å; L509-F573 HydrophobicContact CB-CZ 4.35Å; L509-F573 HydrophobicContact CD2-CE1 3.98Å; L509-F573 HydrophobicContact CD2-CZ 3.75Å; L509-F573 HydrophobicContact CG-CE1 3.96Å; L509-F573 HydrophobicContact CG-CZ 3.71Å
510	G	96.9	Very high	96.5	Very high	16 Å²	16	42.6 Å²	42.6	17%	0.165	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-39.5	178.2	0	0	0	0	0	113.7	R506 L507 K514 F573	R506-G510 PolarHBondContact O-N 3.33Å; L507-G510 PolarHBondContact O-N 3.01Å; G510-K514 WeakPolarHBondContact O-CB 3.16Å; G510-K514 PolarHBondContact O-N 3.12Å; G510-K514 VanDerWaalsContact O-N 3.11Å; G510-F573 VanDerWaalsContact CA-CD1 3.41Å
511	L	97.1	Very high	96.6	Very high	52 Å²	52	40.6 Å²	40.6	27%	0.272	22%	0.216	S	C	.	.	H	α-helix	trans	-61.5	-46.3	172.2	-71.7	172.1	0	0	0	111.4	L396 K400 I403 L507 V508 L509 H515	L396-L511 HydrophobicContact CD1-CD1 3.82Å; K400-L511 HydrophobicContact CG-CD1 4.12Å; I403-L511 HydrophobicContact CD1-CB 4.43Å; L507-L511 WeakPolarHBondContact O-CG 3.46Å; L507-L511 PolarHBondContact O-N 2.83Å; V508-L511 PolarHBondContact O-N 3.49Å; L509-L511 PolarHBondContact O-N 3.39Å; L511-H515 PolarHBondContact O-N 3.46Å; L511-H515 VanDerWaalsContact O-N 3.12Å
512	L	98	Very high	96.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-47.9	179.2	-175.9	66.4	0	0	0	111.9	L462 V508 L509 K514 H515 L516 F537 L541	L462-L512 HydrophobicContact CD1-CD2 3.75Å; V508-L512 WeakPolarHBondContact O-CB 3.36Å; V508-L512 PolarHBondContact O-N 3.25Å; L509-L512 PolarHBondContact O-N 2.82Å; L512-K514 VanDerWaalsContact C-N 3.32Å; L512-K514 PolarHBondContact O-N 2.76Å; L512-H515 WeakPolarHBondContact O-CB 3.5Å; L512-H515 PolarHBondContact O-N 3.12Å; L512-H515 VanDerWaalsContact O-N 3.09Å; L512-L516 HydrophobicContact CD1-CD1 4.37Å; L512-L516 HydrophobicContact CD1-CD2 4.45Å; L512-L516 HydrophobicContact CD1-CG 4.21Å; L512-L516 HydrophobicContact CG-CD1 4.09Å; L512-L516 HydrophobicContact CG-CG 4.25Å; L512-L516 WeakPolarHBondContact O-CG 3.32Å; L512-L516 PolarHBondContact O-N 3.08Å; L512-F537 HydrophobicContact CD1-CE1 4.07Å; L512-F537 HydrophobicContact CD1-CZ 4.33Å; L512-F537 HydrophobicContact CD2-CD1 4.04Å; L512-F537 HydrophobicContact CD2-CE1 3.99Å; L512-L541 HydrophobicContact CD2-CD1 4.04Å; L512-L541 HydrophobicContact CD2-CD2 3.79Å; L512-L541 HydrophobicContact CD2-CG 4.47Å
513	M	98.3	Very high	96.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-38.2	-179.3	-65.7	-57.1	101.9	0	0	112	L509 L516 A517 L541 L565 I566 H569 F573	L509-M513 HydrophobicContact CD1-CE 4.01Å; L509-M513 HydrophobicContact CD1-CG 4.29Å; L509-M513 HydrophobicContact CG-CG 4.26Å; L509-M513 VanDerWaalsContact O-CG 3.28Å; L509-M513 WeakPolarHBondContact O-CG 3.39Å; L509-M513 PolarHBondContact O-N 3.07Å; M513-L516 HydrophobicContact CE-CD1 3.78Å; M513-L516 PolarHBondContact O-N 3.27Å; M513-A517 WeakPolarHBondContact O-CB 3.24Å; M513-A517 PolarHBondContact O-N 2.9Å; M513-L541 HydrophobicContact CE-CD1 3.69Å; M513-L565 HydrophobicContact CG-CB 3.95Å; M513-L565 HydrophobicContact SD-CB 3.49Å; M513-L565 WeakPolarHBondContact SD-CB 3.47Å; M513-L565 HydrophobicContact SD-CD1 4.43Å; M513-I566 HydrophobicContact SD-CG1 3.73Å; M513-H569 HydrophobicContact CB-CB 3.98Å; M513-F573 HydrophobicContact CB-CE2 4.05Å; M513-F573 HydrophobicContact CG-CE2 3.88Å; M513-F573 HydrophobicContact CG-CZ 3.99Å
514	K	97.9	Very high	96.8	Very high	139 Å²	139	45.4 Å²	45.4	60%	0.604	23%	0.233	S	C	*	.	H	α-helix	trans	-60.3	-44.1	171.8	-178.1	-174.2	175.6	-170.7	0	111.9	G510 L512 N518	G510-K514 WeakPolarHBondContact O-CB 3.16Å; G510-K514 PolarHBondContact O-N 3.12Å; G510-K514 VanDerWaalsContact O-N 3.11Å; L512-K514 VanDerWaalsContact C-N 3.32Å; L512-K514 PolarHBondContact O-N 2.76Å; K514-N518 PolarHBondContact O-N 3.4Å
515	H	97.9	Very high	96.8	Very high	2 Å²	2	45 Å²	45	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-65	-47	177.1	174.3	54.8	0	0	0	112.2	I403 E407 Y417 L511 L512 A517 N518 V519	I403-H515 HydrophobicContact CD1-CB 3.96Å; I403-H515 HydrophobicContact CG1-CB 4Å; I403-H515 HydrophobicContact CG2-CB 3.81Å; E407-H515 VanDerWaalsContact CD-ND1 3.3Å; E407-H515 VanDerWaalsContact CG-CE1 3.44Å; E407-H515 WeakPolarHBondContact CG-CE1 3.33Å; E407-H515 WeakPolarHBondContact CG-ND1 3.4Å; E407-H515 IonicContact OE1-CE1 2.73Å; E407-H515 IonicContact OE1-CG 3.33Å; E407-H515 IonicContact OE1-ND1 3.15Å; E407-H515 PolarHBondContact OE1-ND1 3.49Å; Y417-H515 AromaticContact CE2-NE2 3.62Å; Y417-H515 AromaticContact CZ-NE2 3.71Å; Y417-H515 PolarHBondContact OH-CD2 2.72Å; Y417-H515 PolarHBondContact OH-NE2 3.39Å; L511-H515 PolarHBondContact O-N 3.46Å; L511-H515 VanDerWaalsContact O-N 3.12Å; L512-H515 WeakPolarHBondContact O-CB 3.5Å; L512-H515 PolarHBondContact O-N 3.12Å; L512-H515 VanDerWaalsContact O-N 3.09Å; H515-A517 VanDerWaalsContact C-N 3.29Å; H515-A517 PolarHBondContact O-N 2.88Å; H515-N518 WeakPolarHBondContact O-CA 3.45Å; H515-N518 VanDerWaalsContact O-CB 3.3Å; H515-N518 WeakPolarHBondContact O-CB 3.21Å; H515-N518 PolarHBondContact O-N 3.44Å; H515-V519 PolarHBondContact O-N 3.42Å
516	L	98.3	Very high	96.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-33.4	179.5	-64.6	-174	0	0	0	112.2	Y417 L512 M513 N518 V519 A520 L533 F537 I566	Y417-L516 HydrophobicContact CD2-CD2 4.17Å; Y417-L516 HydrophobicContact CE2-CD2 3.81Å; L512-L516 HydrophobicContact CD1-CD1 4.37Å; L512-L516 HydrophobicContact CD1-CD2 4.45Å; L512-L516 HydrophobicContact CD1-CG 4.21Å; L512-L516 HydrophobicContact CG-CD1 4.09Å; L512-L516 HydrophobicContact CG-CG 4.25Å; L512-L516 WeakPolarHBondContact O-CG 3.32Å; L512-L516 PolarHBondContact O-N 3.08Å; M513-L516 HydrophobicContact CE-CD1 3.78Å; M513-L516 PolarHBondContact O-N 3.27Å; L516-N518 VanDerWaalsContact C-N 3.33Å; L516-V519 PolarHBondContact O-N 3.46Å; L516-A520 WeakPolarHBondContact O-CB 3.2Å; L516-A520 PolarHBondContact O-N 3.26Å; L516-L533 HydrophobicContact CB-CD1 4.17Å; L516-L533 HydrophobicContact CD2-CD1 4.47Å; L516-L533 HydrophobicContact CD2-CD2 4.27Å; L516-L533 WeakPolarHBondContact O-CD1 3.43Å; L516-F537 HydrophobicContact CD1-CB 4.34Å; L516-F537 HydrophobicContact CD1-CD1 4.23Å; L516-F537 HydrophobicContact CD1-CD2 3.56Å; L516-F537 HydrophobicContact CD1-CE1 4.44Å; L516-F537 HydrophobicContact CD1-CE2 3.82Å; L516-F537 HydrophobicContact CD1-CG 3.78Å; L516-F537 HydrophobicContact CD1-CZ 4.24Å; L516-F537 HydrophobicContact CD2-CD2 4.11Å; L516-F537 HydrophobicContact CD2-CE2 3.54Å; L516-F537 HydrophobicContact CD2-CZ 3.95Å; L516-F537 HydrophobicContact CG-CE2 4.33Å; L516-I566 HydrophobicContact CB-CD1 3.87Å; L516-I566 HydrophobicContact CB-CG1 3.91Å; L516-I566 HydrophobicContact CD1-CD1 3.98Å; L516-I566 HydrophobicContact CD1-CG1 4.36Å
517	A	97.9	Very high	96.7	Very high	22 Å²	22	45.1 Å²	45.1	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-36.9	170.8	0	0	0	0	0	112.4	M513 H515 A520 A521 I566 H569	M513-A517 WeakPolarHBondContact O-CB 3.24Å; M513-A517 PolarHBondContact O-N 2.9Å; H515-A517 VanDerWaalsContact C-N 3.29Å; H515-A517 PolarHBondContact O-N 2.88Å; A517-A520 PolarHBondContact O-N 2.93Å; A517-A521 PolarHBondContact O-N 2.97Å; A517-I566 HydrophobicContact CB-CG2 4.04Å; A517-H569 VanDerWaalsContact CB-CD2 3.49Å; A517-H569 WeakPolarHBondContact CB-CD2 3.35Å
518	N	97.8	Very high	96.7	Very high	56 Å²	56	41.3 Å²	41.3	30%	0.299	22%	0.22	S	C	.	.	H	α-helix	trans	-67.7	-41.9	173.9	-171.1	26.1	0	0	0	111.9	E407 K514 H515 L516 A521 H522	E407-N518 VanDerWaalsContact CD-ND2 3.3Å; E407-N518 PolarHBondContact OE1-ND2 2.99Å; K514-N518 PolarHBondContact O-N 3.4Å; H515-N518 WeakPolarHBondContact O-CA 3.45Å; H515-N518 VanDerWaalsContact O-CB 3.3Å; H515-N518 WeakPolarHBondContact O-CB 3.21Å; H515-N518 PolarHBondContact O-N 3.44Å; L516-N518 VanDerWaalsContact C-N 3.33Å; N518-A521 PolarHBondContact O-N 3.31Å; N518-H522 PolarHBondContact O-N 3.31Å; N518-H522 PolarHBondContact O-ND1 3.29Å; N518-H522 PolarHBondContact OD1-CE1 3.2Å
519	V	97.9	Very high	96.6	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-58.9	-47.5	171.8	174.9	0	0	0	0	110.8	I411 L416 Y417 H515 L516 A521 H522 S523 N526 M528 L533	I411-V519 HydrophobicContact CD1-CB 4.39Å; I411-V519 HydrophobicContact CD1-CG2 3.76Å; L416-V519 HydrophobicContact CB-CG1 4.38Å; L416-V519 HydrophobicContact CD1-CG1 4.01Å; L416-V519 HydrophobicContact CD1-CG2 4.23Å; Y417-V519 HydrophobicContact CE2-CG2 4.42Å; H515-V519 PolarHBondContact O-N 3.42Å; L516-V519 PolarHBondContact O-N 3.46Å; V519-A521 VanDerWaalsContact C-N 3.31Å; V519-A521 PolarHBondContact O-N 3.12Å; V519-H522 PolarHBondContact O-N 3.42Å; V519-S523 PolarHBondContact O-N 3.43Å; V519-N526 PolarHBondContact O-ND2 3.09Å; V519-M528 HydrophobicContact CG1-CB 4.03Å; V519-L533 HydrophobicContact CB-CD1 4.16Å; V519-L533 HydrophobicContact CG1-CD1 4.01Å; V519-L533 HydrophobicContact CG1-CD2 4.26Å
520	A	97.4	Very high	96.6	Very high	12 Å²	12	45 Å²	45	10%	0.099	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-33	179.6	0	0	0	0	0	113.4	L516 A517 H522 S523 M528 V530 L533	L516-A520 WeakPolarHBondContact O-CB 3.2Å; L516-A520 PolarHBondContact O-N 3.26Å; A517-A520 PolarHBondContact O-N 2.93Å; A520-H522 PolarHBondContact O-N 3.44Å; A520-S523 WeakPolarHBondContact O-CB 3.49Å; A520-S523 PolarHBondContact O-N 3.49Å; A520-S523 VanDerWaalsContact O-N 3.11Å; A520-S523 PolarHBondContact O-OG 2.68Å; A520-M528 WeakPolarHBondContact CA-O 3.27Å; A520-V530 HydrophobicContact CB-CG2 3.77Å; A520-L533 HydrophobicContact CB-CD1 4.1Å
521	A	97.3	Very high	96.4	Very high	78 Å²	78	44.8 Å²	44.8	65%	0.645	24%	0.24	S	C	*	.	H	α-helix	trans	-62.4	-26.5	173.5	0	0	0	0	0	112.9	A517 N518 V519	A517-A521 PolarHBondContact O-N 2.97Å; N518-A521 PolarHBondContact O-N 3.31Å; V519-A521 VanDerWaalsContact C-N 3.31Å; V519-A521 PolarHBondContact O-N 3.12Å
522	H	97.2	Very high	96.3	Very high	63 Å²	63	43.6 Å²	43.6	29%	0.292	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	10.9	177.1	-63.3	83.6	0	0	0	113.3	I411 N412 N518 V519 A520 K524 Q525 N526	I411-H522 HydrophobicContact CG1-CB 4.32Å; N412-H522 PolarHBondContact OD1-CD2 3.02Å; N518-H522 PolarHBondContact O-N 3.31Å; N518-H522 PolarHBondContact O-ND1 3.29Å; N518-H522 PolarHBondContact OD1-CE1 3.2Å; V519-H522 PolarHBondContact O-N 3.42Å; A520-H522 PolarHBondContact O-N 3.44Å; H522-K524 PolarHBondContact O-N 3.29Å; H522-Q525 PolarHBondContact O-N 3.15Å; H522-N526 WeakPolarHBondContact CB-ND2 3.32Å; H522-N526 PolarHBondContact O-N 3.32Å; H522-N526 VanDerWaalsContact O-N 3.1Å
523	S	95.6	Very high	96.2	Very high	34 Å²	34	43.6 Å²	43.6	24%	0.238	23%	0.234	C	C	.	.	H	α-helix	trans	-53.4	-24.6	-177.8	53	0	0	0	0	115.7	V519 A520 Q525 N526 L527 M528	V519-S523 PolarHBondContact O-N 3.43Å; A520-S523 WeakPolarHBondContact O-CB 3.49Å; A520-S523 PolarHBondContact O-N 3.49Å; A520-S523 VanDerWaalsContact O-N 3.11Å; A520-S523 PolarHBondContact O-OG 2.68Å; S523-Q525 PolarHBondContact O-N 3.1Å; S523-N526 VanDerWaalsContact CA-OD1 3.3Å; S523-N526 WeakPolarHBondContact CA-OD1 3.22Å; S523-L527 WeakPolarHBondContact O-CA 3.26Å; S523-L527 PolarHBondContact O-N 3.49Å; S523-M528 WeakPolarHBondContact CB-O 3.45Å
524	K	94.4	Very high	96.1	Very high	198 Å²	198	43.6 Å²	43.6	86%	0.861	23%	0.234	S	C	*	.	H	α-helix	trans	-63.4	-24.9	173.4	-66.1	-174.1	179.1	-177.4	0	113.9	H522	H522-K524 PolarHBondContact O-N 3.29Å
525	Q	94.1	Very high	95.9	Very high	112 Å²	112	38.1 Å²	38.1	52%	0.523	21%	0.212	S	C	.	.	H	α-helix	trans	-108	-50.1	178.5	-61.1	-174.5	32.8	0	0	111.1	N412 Q414 H522 S523 L527	N412-Q525 HydrophobicContact CB-CB 4.14Å; N412-Q525 PolarHBondContact OD1-OE1 2.74Å; Q414-Q525 WeakPolarHBondContact CG-O 3.29Å; H522-Q525 PolarHBondContact O-N 3.15Å; S523-Q525 PolarHBondContact O-N 3.1Å; Q525-L527 VanDerWaalsContact C-N 3.34Å; Q525-L527 PolarHBondContact O-N 3.15Å
526	N	95.4	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-82	-7.3	-176.2	69.7	33.9	0	0	0	114.4	I411 D413 G415 V519 H522 S523 M528	I411-N526 PolarHBondContact O-ND2 2.86Å; D413-N526 VanDerWaalsContact O-CB 3.27Å; D413-N526 WeakPolarHBondContact O-CB 3.45Å; G415-N526 PolarHBondContact N-O 3.35Å; V519-N526 PolarHBondContact O-ND2 3.09Å; H522-N526 WeakPolarHBondContact CB-ND2 3.32Å; H522-N526 PolarHBondContact O-N 3.32Å; H522-N526 VanDerWaalsContact O-N 3.1Å; S523-N526 VanDerWaalsContact CA-OD1 3.3Å; S523-N526 WeakPolarHBondContact CA-OD1 3.22Å; N526-M528 PolarHBondContact O-N 3.37Å; N526-M528 WeakPolarHBondContact OD1-CB 3.49Å; N526-M528 PolarHBondContact OD1-N 3.31Å
527	L	92.4	Very high	95.7	Very high	78 Å²	78	39.2 Å²	39.2	41%	0.408	22%	0.219	S	C	.	.			trans	61.9	14.9	179.1	-49.1	178.5	0	0	0	115.6	Q414 S523 Q525 N532	Q414-L527 HydrophobicContact CG-CD1 4.25Å; Q414-L527 HydrophobicContact CG-CG 4.4Å; S523-L527 WeakPolarHBondContact O-CA 3.26Å; S523-L527 PolarHBondContact O-N 3.49Å; Q525-L527 VanDerWaalsContact C-N 3.34Å; Q525-L527 PolarHBondContact O-N 3.15Å; L527-N532 PolarHBondContact O-ND2 3.09Å
528	M	94.8	Very high	95.5	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.			trans	-103.8	88.7	179.5	-64.7	-55.9	-62	0	0	111.2	L416 R418 V519 A520 S523 N526 N532 L533 V536	L416-M528 HydrophobicContact CB-CG 4.34Å; L416-M528 WeakPolarHBondContact O-CE 3.39Å; L416-M528 WeakPolarHBondContact O-CG 3.36Å; R418-M528 HydrophobicContact CB-CE 3.96Å; R418-M528 HydrophobicContact CB-SD 3.78Å; V519-M528 HydrophobicContact CG1-CB 4.03Å; A520-M528 WeakPolarHBondContact CA-O 3.27Å; S523-M528 WeakPolarHBondContact CB-O 3.45Å; N526-M528 PolarHBondContact O-N 3.37Å; N526-M528 WeakPolarHBondContact OD1-CB 3.49Å; N526-M528 PolarHBondContact OD1-N 3.31Å; M528-N532 HydrophobicContact CE-CB 3.76Å; M528-N532 HydrophobicContact SD-CB 4.27Å; M528-L533 HydrophobicContact CB-CD2 4.11Å; M528-L533 HydrophobicContact CB-CG 4.26Å; M528-L533 HydrophobicContact CE-CD2 3.65Å; M528-L533 HydrophobicContact CE-CG 4.22Å; M528-V536 HydrophobicContact CE-CG2 4.44Å
529	T	95.4	Very high	95.2	Very high	54 Å²	54	36.8 Å²	36.8	33%	0.331	20%	0.204	S	C	.	.			trans	-68.4	166.8	169.9	60.7	0	0	0	0	111.8	A531 N532 L533	T529-A531 VanDerWaalsContact C-N 3.3Å; T529-A531 PolarHBondContact O-N 3.41Å; T529-N532 PolarHBondContact O-N 2.91Å; T529-N532 VanDerWaalsContact O-N 3.13Å; T529-N532 PolarHBondContact OG1-N 2.85Å; T529-L533 WeakPolarHBondContact O-CG 3.35Å; T529-L533 PolarHBondContact O-N 3.29Å
530	V	96.3	Very high	95	Very high	28 Å²	28	37.3 Å²	37.3	17%	0.17	21%	0.207	C	C	.	.	H	α-helix	trans	-52.4	-48.2	172.6	-178.4	0	0	0	0	111.1	A520 N532 L533 G534 E563 I566 E567	A520-V530 HydrophobicContact CB-CG2 3.77Å; V530-N532 PolarHBondContact O-N 2.99Å; V530-L533 CarbonylContact O-C 3.58Å; V530-L533 PolarHBondContact O-N 3.43Å; V530-L533 VanDerWaalsContact O-N 3.14Å; V530-G534 PolarHBondContact O-N 2.96Å; V530-E563 HydrophobicContact CG1-CB 3.88Å; V530-E563 HydrophobicContact CG1-CG 4.01Å; V530-I566 HydrophobicContact CG1-CB 4.1Å; V530-I566 HydrophobicContact CG1-CD1 4.47Å; V530-I566 HydrophobicContact CG1-CG2 4.05Å; V530-I566 HydrophobicContact CG2-CG2 4.15Å; V530-E567 HydrophobicContact CG1-CG 3.88Å; V530-E567 HydrophobicContact CG2-CG 4.1Å
531	A	93.8	Very high	94.9	Very high	12 Å²	12	36.8 Å²	36.8	10%	0.099	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-41.7	177.1	0	0	0	0	0	113.1	T529 L533 G534 V535	T529-A531 VanDerWaalsContact C-N 3.3Å; T529-A531 PolarHBondContact O-N 3.41Å; A531-L533 VanDerWaalsContact C-N 3.31Å; A531-L533 PolarHBondContact O-N 2.82Å; A531-G534 PolarHBondContact O-N 3.3Å; A531-V535 WeakPolarHBondContact O-CG2 3.38Å; A531-V535 PolarHBondContact O-N 3.2Å
532	N	94.3	Very high	94.7	Very high	27 Å²	27	33.1 Å²	33.1	14%	0.144	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-35.6	175.5	-74.7	-14.1	0	0	0	112.1	S237 L527 M528 T529 V530 V536	S237-N532 PolarHBondContact OG-OD1 3.46Å; L527-N532 PolarHBondContact O-ND2 3.09Å; M528-N532 HydrophobicContact CE-CB 3.76Å; M528-N532 HydrophobicContact SD-CB 4.27Å; T529-N532 PolarHBondContact O-N 2.91Å; T529-N532 VanDerWaalsContact O-N 3.13Å; T529-N532 PolarHBondContact OG1-N 2.85Å; V530-N532 PolarHBondContact O-N 2.99Å; N532-V536 WeakPolarHBondContact O-CG2 3.48Å; N532-V536 PolarHBondContact O-N 2.96Å
533	L	96.4	Very high	94.3	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-73.2	-36.1	174	-65.5	172.3	0	0	0	111.7	Y417 L516 V519 A520 M528 T529 V530 A531 V536 F537 I566	Y417-L533 HydrophobicContact CD2-CD2 4.28Å; L516-L533 HydrophobicContact CB-CD1 4.17Å; L516-L533 HydrophobicContact CD2-CD1 4.47Å; L516-L533 HydrophobicContact CD2-CD2 4.27Å; L516-L533 WeakPolarHBondContact O-CD1 3.43Å; V519-L533 HydrophobicContact CB-CD1 4.16Å; V519-L533 HydrophobicContact CG1-CD1 4.01Å; V519-L533 HydrophobicContact CG1-CD2 4.26Å; A520-L533 HydrophobicContact CB-CD1 4.1Å; M528-L533 HydrophobicContact CB-CD2 4.11Å; M528-L533 HydrophobicContact CB-CG 4.26Å; M528-L533 HydrophobicContact CE-CD2 3.65Å; M528-L533 HydrophobicContact CE-CG 4.22Å; T529-L533 WeakPolarHBondContact O-CG 3.35Å; T529-L533 PolarHBondContact O-N 3.29Å; V530-L533 CarbonylContact O-C 3.58Å; V530-L533 PolarHBondContact O-N 3.43Å; V530-L533 VanDerWaalsContact O-N 3.14Å; A531-L533 VanDerWaalsContact C-N 3.31Å; A531-L533 PolarHBondContact O-N 2.82Å; L533-V536 PolarHBondContact O-N 3.47Å; L533-F537 WeakPolarHBondContact O-CB 3.49Å; L533-F537 PolarHBondContact O-N 3.23Å; L533-I566 HydrophobicContact CB-CD1 3.94Å
534	G	95.9	Very high	93.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54.7	-51.6	171.8	0	0	0	0	0	112	V530 A531 V536 F537 G538 N559	V530-G534 PolarHBondContact O-N 2.96Å; A531-G534 PolarHBondContact O-N 3.3Å; G534-V536 PolarHBondContact O-N 3.23Å; G534-F537 PolarHBondContact O-N 3.25Å; G534-G538 PolarHBondContact O-N 3.42Å; G534-N559 PolarHBondContact O-OD1 3.3Å; G534-N559 VanDerWaalsContact O-OD1 3.08Å
535	V	93.7	Very high	92.8	Very high	25 Å²	25	29.9 Å²	29.9	15%	0.152	16%	0.159	C	C	.	.	H	α-helix	trans	-56.8	-35.4	176.1	173.7	0	0	0	0	112.9	R238 A531	R238-V535 HydrophobicContact CB-CG2 4.44Å; R238-V535 HydrophobicContact CG-CG2 3.72Å; A531-V535 WeakPolarHBondContact O-CG2 3.38Å; A531-V535 PolarHBondContact O-N 3.2Å
536	V	93.9	Very high	92	Very high	24 Å²	24	31 Å²	31	15%	0.145	16%	0.164	C	C	.	.	H	α-helix	trans	-80.7	-39.7	-179.9	175	0	0	0	0	112.2	K459 M528 N532 L533 G534 T540	K459-V536 HydrophobicContact CD-CG1 3.52Å; M528-V536 HydrophobicContact CE-CG2 4.44Å; N532-V536 WeakPolarHBondContact O-CG2 3.48Å; N532-V536 PolarHBondContact O-N 2.96Å; L533-V536 PolarHBondContact O-N 3.47Å; G534-V536 PolarHBondContact O-N 3.23Å; V536-T540 PolarHBondContact O-OG1 3.26Å
537	F	96.8	Very high	91.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-96.8	-19.2	-171.2	-81	-83.4	0	0	0	114.8	Y417 K459 L462 L512 L516 L533 G534 T540 L541 V562	Y417-F537 AromaticContact CD1-CE2 3.9Å; Y417-F537 HydrophobicContact CD1-CE2 3.9Å; Y417-F537 AromaticContact CD1-CZ 3.6Å; Y417-F537 HydrophobicContact CD1-CZ 3.6Å; Y417-F537 HydrophobicContact CD2-CE2 4Å; Y417-F537 HydrophobicContact CD2-CZ 4.34Å; Y417-F537 HydrophobicContact CE1-CE2 4.35Å; Y417-F537 AromaticContact CE1-CZ 3.75Å; Y417-F537 HydrophobicContact CE1-CZ 3.75Å; Y417-F537 HydrophobicContact CE2-CE2 4.44Å; Y417-F537 HydrophobicContact CE2-CZ 4.46Å; Y417-F537 AromaticContact CG-CE2 3.69Å; Y417-F537 HydrophobicContact CG-CE2 3.69Å; Y417-F537 AromaticContact CG-CZ 3.9Å; Y417-F537 HydrophobicContact CG-CZ 3.9Å; K459-F537 HydrophobicContact CG-CE1 4.29Å; K459-F537 HydrophobicContact CG-CZ 4.14Å; L462-F537 HydrophobicContact CD1-CE1 4.08Å; L512-F537 HydrophobicContact CD1-CE1 4.07Å; L512-F537 HydrophobicContact CD1-CZ 4.33Å; L512-F537 HydrophobicContact CD2-CD1 4.04Å; L512-F537 HydrophobicContact CD2-CE1 3.99Å; L516-F537 HydrophobicContact CD1-CB 4.34Å; L516-F537 HydrophobicContact CD1-CD1 4.23Å; L516-F537 HydrophobicContact CD1-CD2 3.56Å; L516-F537 HydrophobicContact CD1-CE1 4.44Å; L516-F537 HydrophobicContact CD1-CE2 3.82Å; L516-F537 HydrophobicContact CD1-CG 3.78Å; L516-F537 HydrophobicContact CD1-CZ 4.24Å; L516-F537 HydrophobicContact CD2-CD2 4.11Å; L516-F537 HydrophobicContact CD2-CE2 3.54Å; L516-F537 HydrophobicContact CD2-CZ 3.95Å; L516-F537 HydrophobicContact CG-CE2 4.33Å; L533-F537 WeakPolarHBondContact O-CB 3.49Å; L533-F537 PolarHBondContact O-N 3.23Å; G534-F537 PolarHBondContact O-N 3.25Å; F537-T540 HydrophobicContact CD1-CG2 4.25Å; F537-T540 PolarHBondContact O-N 2.96Å; F537-L541 HydrophobicContact CB-CD1 4.08Å; F537-L541 HydrophobicContact CB-CG 4.35Å; F537-L541 HydrophobicContact CD1-CD1 4.31Å; F537-L541 HydrophobicContact CD1-CG 4.24Å; F537-L541 VanDerWaalsContact O-CB 3.32Å; F537-L541 WeakPolarHBondContact O-CB 3.22Å; F537-L541 VanDerWaalsContact O-CG 3.25Å; F537-L541 WeakPolarHBondContact O-CG 3.43Å; F537-L541 PolarHBondContact O-N 2.86Å; F537-V562 HydrophobicContact CB-CG1 3.89Å
538	G	95.1	Very high	90.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-48.7	-68.1	171.3	0	0	0	0	0	112.5	G534 T540 L541 M542 Q558	G534-G538 PolarHBondContact O-N 3.42Å; G538-T540 PolarHBondContact O-N 3.5Å; G538-L541 PolarHBondContact O-N 3Å; G538-M542 WeakPolarHBondContact O-CB 3.28Å; G538-M542 PolarHBondContact O-N 3.44Å; G538-Q558 PolarHBondContact O-OE1 3.19Å
539	P	91.4	Very high	89.8	Confident	27 Å²	27	38.3 Å²	38.3	18%	0.175	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-26.7	177.5	22.8	-33.2	0	0	0	113.7	R543 L555	P539-R543 WeakPolarHBondContact O-CG 3.29Å; P539-L555 HydrophobicContact CB-CD2 3.86Å; P539-L555 HydrophobicContact CG-CD2 4.43Å
540	T	92.6	Very high	89.2	Confident	12 Å²	12	38.8 Å²	38.8	7%	0.074	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-41.7	178.3	-59.6	0	0	0	0	111.6	L462 V536 F537 G538 R543	L462-T540 HydrophobicContact CB-CG2 3.82Å; L462-T540 HydrophobicContact CD1-CG2 4.43Å; V536-T540 PolarHBondContact O-OG1 3.26Å; F537-T540 HydrophobicContact CD1-CG2 4.25Å; F537-T540 PolarHBondContact O-N 2.96Å; G538-T540 PolarHBondContact O-N 3.5Å; T540-R543 PolarHBondContact O-NH1 3.33Å; T540-R543 VanDerWaalsContact O-NH1 3.15Å
541	L	95.8	Very high	88.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-95.8	-26	-172.7	-61.3	179.2	0	0	0	113.8	L462 P468 L469 M470 L509 L512 M513 F537 G538 V562	L462-L541 HydrophobicContact CD1-CD2 4.18Å; P468-L541 WeakPolarHBondContact CB-O 3.28Å; L469-L541 HydrophobicContact CB-CD2 4.15Å; L469-L541 HydrophobicContact CD2-CD2 3.91Å; M470-L541 HydrophobicContact CG-CB 4.36Å; M470-L541 PolarHBondContact N-O 3.38Å; M470-L541 HydrophobicContact SD-CB 4.18Å; L509-L541 HydrophobicContact CD1-CD1 4.02Å; L512-L541 HydrophobicContact CD2-CD1 4.04Å; L512-L541 HydrophobicContact CD2-CD2 3.79Å; L512-L541 HydrophobicContact CD2-CG 4.47Å; M513-L541 HydrophobicContact CE-CD1 3.69Å; F537-L541 HydrophobicContact CB-CD1 4.08Å; F537-L541 HydrophobicContact CB-CG 4.35Å; F537-L541 HydrophobicContact CD1-CD1 4.31Å; F537-L541 HydrophobicContact CD1-CG 4.24Å; F537-L541 VanDerWaalsContact O-CB 3.32Å; F537-L541 WeakPolarHBondContact O-CB 3.22Å; F537-L541 VanDerWaalsContact O-CG 3.25Å; F537-L541 WeakPolarHBondContact O-CG 3.43Å; F537-L541 PolarHBondContact O-N 2.86Å; G538-L541 PolarHBondContact O-N 3Å; L541-V562 HydrophobicContact CD1-CG2 4.17Å
542	M	93.3	Very high	88	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	21%	0.211	C	C	.	.			trans	-123.8	58.5	-174.3	-61.5	-175.2	67.8	0	0	111.6	M470 Y475 F478 I479 G538 Q558 V561	M470-M542 HydrophobicContact CB-CG 4.08Å; M470-M542 HydrophobicContact CE-CE 4.45Å; M470-M542 HydrophobicContact CE-CG 4.13Å; M470-M542 HydrophobicContact CE-SD 3.91Å; M470-M542 HydrophobicContact CG-CG 4.21Å; M470-M542 HydrophobicContact SD-CG 3.45Å; M470-M542 WeakPolarHBondContact SD-CG 3.21Å; M470-M542 HydrophobicContact SD-SD 3.85Å; Y475-M542 HydrophobicContact CD2-CB 4.18Å; Y475-M542 HydrophobicContact CD2-CE 4.18Å; Y475-M542 HydrophobicContact CE2-CB 4.11Å; Y475-M542 HydrophobicContact CE2-CE 4.36Å; Y475-M542 WeakPolarHBondContact CE2-O 3.44Å; F478-M542 HydrophobicContact CB-CE 3.53Å; F478-M542 HydrophobicContact CG-CE 4.41Å; I479-M542 HydrophobicContact CD1-CE 3.8Å; I479-M542 HydrophobicContact CG1-CE 3.95Å; G538-M542 WeakPolarHBondContact O-CB 3.28Å; G538-M542 PolarHBondContact O-N 3.44Å; M542-Q558 HydrophobicContact CB-CB 4.34Å; M542-Q558 HydrophobicContact CB-CG 3.89Å; M542-Q558 HydrophobicContact CE-CG 4.35Å; M542-Q558 VanDerWaalsContact O-CD 3.32Å; M542-Q558 PolarHBondContact O-NE2 3.05Å; M542-Q558 PolarHBondContact O-OE1 3.09Å; M542-Q558 HydrophobicContact SD-CB 4.07Å; M542-Q558 HydrophobicContact SD-CG 4.14Å; M542-V561 HydrophobicContact SD-CB 3.99Å; M542-V561 HydrophobicContact SD-CG1 3.92Å; M542-V561 HydrophobicContact SD-CG2 4.41Å
543	R	88.1	Confident	87.6	Confident	33 Å²	33	40.4 Å²	40.4	13%	0.125	22%	0.221	C	C	.	.			trans	-62.2	126.8	175.3	-64.4	-174.1	-63.8	-77.5	14.6	110.4	L462 R463 L465 E467 P468 Y472 P539 T540	L462-R543 PolarHBondContact O-NH1 2.96Å; R463-R543 PolarHBondContact O-NE 2.85Å; R463-R543 PolarHBondContact O-NH1 3.44Å; R463-R543 PolarHBondContact O-NH2 3.1Å; L465-R543 PolarHBondContact O-NH2 3.22Å; E467-R543 PolarHBondContact O-NH2 3.41Å; P468-R543 HydrophobicContact CB-CB 4.17Å; P468-R543 HydrophobicContact CG-CB 4.34Å; Y472-R543 WeakPolarHBondContact CD1-O 3.3Å; Y472-R543 WeakPolarHBondContact CE1-O 3.44Å; P539-R543 WeakPolarHBondContact O-CG 3.29Å; T540-R543 PolarHBondContact O-NH1 3.33Å; T540-R543 VanDerWaalsContact O-NH1 3.15Å
544	P	81.3	Confident	87.3	Confident	39 Å²	39	41.8 Å²	41.8	25%	0.253	23%	0.228	S	C	.	.			trans	-69.5	151.5	172.5	30.6	-34.6	0	0	0	110.3	Y475 E546 A551	Y475-P544 HydrophobicContact CE2-CB 4.45Å; P544-E546 VanDerWaalsContact C-N 3.29Å; P544-A551 HydrophobicContact CB-CB 3.79Å; P544-A551 HydrophobicContact CG-CB 3.95Å
545	Q	79.1	Confident	87	Confident	155 Å²	155	42.3 Å²	42.3	72%	0.724	23%	0.231	S	C	*	.	S	Bend	trans	-72.9	-23.8	177.1	-171.8	175.9	0.5	0	0	112.7	Y472	Y472-Q545 HydrophobicContact CD1-CB 3.89Å; Y472-Q545 HydrophobicContact CE1-CB 4.29Å; Y472-Q545 HydrophobicContact CG-CB 4.39Å
546	E	75.6	Confident	86.8	Confident	134 Å²	134	42.1 Å²	42.1	63%	0.626	23%	0.228	S	C	*	.	S	Bend	trans	-121.4	129.8	179.4	-65.1	177.9	-177.6	0	0	110.4	P544 T548 A551	P544-E546 VanDerWaalsContact C-N 3.29Å; E546-T548 HydrophobicContact CB-CG2 4.23Å; E546-T548 PolarHBondContact O-N 2.93Å; E546-T548 VanDerWaalsContact O-N 3.11Å; E546-A551 WeakPolarHBondContact O-CB 3.3Å
547	E	76.6	Confident	86.8	Confident	95 Å²	95	41.1 Å²	41.1	44%	0.444	22%	0.222	S	C	.	.			trans	-88.3	72.9	-177.7	-57.4	-165.4	126.6	0	0	111.5	L249 R252	L249-E547 HydrophobicContact CD1-CB 4.12Å; L249-E547 WeakPolarHBondContact CD1-O 3.47Å; R252-E547 IonicContact CZ-OE1 3.23Å; R252-E547 IonicContact CZ-OE2 3.91Å; R252-E547 IonicContact NH1-OE1 2.66Å; R252-E547 PolarHBondContact NH1-OE1 3.33Å; R252-E547 IonicContact NH1-OE2 3.76Å; R252-E547 PolarHBondContact NH1-OE2 3.33Å; R252-E547 VanDerWaalsContact NH2-CD 3.29Å; R252-E547 IonicContact NH2-OE1 3.7Å; R252-E547 PolarHBondContact NH2-OE1 3.47Å; R252-E547 IonicContact NH2-OE2 3.88Å; R252-E547 PolarHBondContact NH2-OE2 3.3Å
548	T	80.6	Confident	86.7	Confident	56 Å²	56	41.1 Å²	41.1	34%	0.344	22%	0.222	S	C	.	.			trans	-114.4	159.2	-178.5	67.4	0	0	0	0	112.4	E546 A550 A551 I552	E546-T548 HydrophobicContact CB-CG2 4.23Å; E546-T548 PolarHBondContact O-N 2.93Å; E546-T548 VanDerWaalsContact O-N 3.11Å; T548-A550 PolarHBondContact O-N 3.09Å; T548-A551 PolarHBondContact O-N 3.12Å; T548-A551 VanDerWaalsContact O-N 3.12Å; T548-A551 PolarHBondContact OG1-N 3.01Å; T548-A551 VanDerWaalsContact OG1-N 3.09Å; T548-I552 WeakPolarHBondContact O-CG1 3.32Å; T548-I552 PolarHBondContact O-N 2.84Å
549	V	80.7	Confident	86.7	Confident	81 Å²	81	41.3 Å²	41.3	49%	0.491	22%	0.223	S	C	.	.	H	α-helix	trans	-60.4	-32.8	172.9	-175.6	0	0	0	0	111.3	L249 I552 M553	L249-V549 HydrophobicContact CD2-CG2 4.28Å; V549-I552 WeakPolarHBondContact O-CB 3.38Å; V549-I552 PolarHBondContact O-N 3.2Å; V549-M553 HydrophobicContact CG1-CE 4.18Å; V549-M553 WeakPolarHBondContact O-CG 3.31Å; V549-M553 PolarHBondContact O-N 3.35Å
550	A	81.3	Confident	86.9	Confident	65 Å²	65	40.5 Å²	40.5	54%	0.537	22%	0.217	S	C	.	.	H	α-helix	trans	-65.7	-42.5	174	0	0	0	0	0	112	T548 I552 M553 D554	T548-A550 PolarHBondContact O-N 3.09Å; A550-I552 VanDerWaalsContact C-N 3.27Å; A550-I552 PolarHBondContact O-N 3.19Å; A550-M553 WeakPolarHBondContact O-CB 3.39Å; A550-M553 PolarHBondContact O-N 3.46Å; A550-M553 VanDerWaalsContact O-N 3.1Å; A550-D554 PolarHBondContact O-N 3.1Å
551	A	82.3	Confident	87.1	Confident	12 Å²	12	40 Å²	40	10%	0.099	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-32.1	173.4	0	0	0	0	0	112.5	P544 E546 T548 M553 D554	P544-A551 HydrophobicContact CB-CB 3.79Å; P544-A551 HydrophobicContact CG-CB 3.95Å; E546-A551 WeakPolarHBondContact O-CB 3.3Å; T548-A551 PolarHBondContact O-N 3.12Å; T548-A551 VanDerWaalsContact O-N 3.12Å; T548-A551 PolarHBondContact OG1-N 3.01Å; T548-A551 VanDerWaalsContact OG1-N 3.09Å; A551-M553 VanDerWaalsContact C-N 3.34Å; A551-D554 PolarHBondContact O-N 3.19Å
552	I	83.9	Confident	87.1	Confident	18 Å²	18	40 Å²	40	9%	0.092	21%	0.214	C	C	.	.	H	α-helix	trans	-68	-30.9	172.4	-69.9	171	0	0	0	111.9	T242 E245 V246 L249 T548 V549 A550 D554 L555	T242-I552 HydrophobicContact CG2-CG2 3.66Å; E245-I552 HydrophobicContact CB-CD1 4.33Å; E245-I552 HydrophobicContact CB-CG1 4.41Å; E245-I552 HydrophobicContact CB-CG2 4.32Å; V246-I552 HydrophobicContact CG2-CD1 4.41Å; V246-I552 HydrophobicContact CG2-CG2 3.71Å; L249-I552 HydrophobicContact CB-CD1 4.01Å; L249-I552 HydrophobicContact CD2-CD1 3.56Å; L249-I552 HydrophobicContact CG-CD1 4.42Å; T548-I552 WeakPolarHBondContact O-CG1 3.32Å; T548-I552 PolarHBondContact O-N 2.84Å; V549-I552 WeakPolarHBondContact O-CB 3.38Å; V549-I552 PolarHBondContact O-N 3.2Å; A550-I552 VanDerWaalsContact C-N 3.27Å; A550-I552 PolarHBondContact O-N 3.19Å; I552-D554 VanDerWaalsContact C-N 3.26Å; I552-D554 PolarHBondContact O-N 3.3Å; I552-L555 HydrophobicContact CB-CD1 4.4Å; I552-L555 HydrophobicContact CG2-CD1 3.84Å; I552-L555 VanDerWaalsContact O-CB 3.29Å; I552-L555 WeakPolarHBondContact O-CB 3.48Å; I552-L555 WeakPolarHBondContact O-CD1 3.38Å; I552-L555 WeakPolarHBondContact O-CG 3.46Å; I552-L555 PolarHBondContact O-N 3.08Å
553	M	85.3	Confident	87.3	Confident	70 Å²	70	41 Å²	41	35%	0.345	22%	0.219	S	C	.	.	H	α-helix	trans	-66.3	-28	173.1	-66.5	177.1	-174.7	0	0	112.6	I72 V549 A550 A551 L555	I72-M553 HydrophobicContact CG2-CE 3.38Å; I72-M553 HydrophobicContact CG2-SD 3.82Å; V549-M553 HydrophobicContact CG1-CE 4.18Å; V549-M553 WeakPolarHBondContact O-CG 3.31Å; V549-M553 PolarHBondContact O-N 3.35Å; A550-M553 WeakPolarHBondContact O-CB 3.39Å; A550-M553 PolarHBondContact O-N 3.46Å; A550-M553 VanDerWaalsContact O-N 3.1Å; A551-M553 VanDerWaalsContact C-N 3.34Å; M553-L555 VanDerWaalsContact C-N 3.25Å; M553-L555 PolarHBondContact O-N 3.35Å
554	D	89.4	Confident	87.7	Confident	29 Å²	29	40.2 Å²	40.2	16%	0.155	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13	175.8	-81	-21.9	0	0	0	113.6	Y475 I479 K483 A550 A551 I552 K556 F557 Q558	Y475-D554 VanDerWaalsContact OH-CB 3.31Å; Y475-D554 WeakPolarHBondContact OH-CB 3.39Å; I479-D554 HydrophobicContact CD1-CB 4.43Å; K483-D554 WeakPolarHBondContact CE-OD1 3.15Å; K483-D554 IonicContact NZ-OD1 3.55Å; K483-D554 PolarHBondContact NZ-OD1 3.38Å; A550-D554 PolarHBondContact O-N 3.1Å; A551-D554 PolarHBondContact O-N 3.19Å; I552-D554 VanDerWaalsContact C-N 3.26Å; I552-D554 PolarHBondContact O-N 3.3Å; D554-K556 PolarHBondContact O-N 2.81Å; D554-K556 VanDerWaalsContact O-N 3.17Å; D554-F557 WeakPolarHBondContact O-CA 3.26Å; D554-F557 WeakPolarHBondContact O-CB 3.36Å; D554-F557 PolarHBondContact O-N 3.4Å; D554-Q558 PolarHBondContact O-N 2.96Å
555	L	89.8	Confident	88.5	Confident	12 Å²	12	38.3 Å²	38.3	6%	0.063	20%	0.204	C	C	.	.	H	α-helix	trans	-53	-38.8	177.7	-69.3	174.6	0	0	0	112.4	E245 P539 I552 M553 F557 Q558 N559	E245-L555 HydrophobicContact CB-CD1 3.96Å; E245-L555 HydrophobicContact CG-CD1 3.75Å; P539-L555 HydrophobicContact CB-CD2 3.86Å; P539-L555 HydrophobicContact CG-CD2 4.43Å; I552-L555 HydrophobicContact CB-CD1 4.4Å; I552-L555 HydrophobicContact CG2-CD1 3.84Å; I552-L555 VanDerWaalsContact O-CB 3.29Å; I552-L555 WeakPolarHBondContact O-CB 3.48Å; I552-L555 WeakPolarHBondContact O-CD1 3.38Å; I552-L555 WeakPolarHBondContact O-CG 3.46Å; I552-L555 PolarHBondContact O-N 3.08Å; M553-L555 VanDerWaalsContact C-N 3.25Å; M553-L555 PolarHBondContact O-N 3.35Å; L555-F557 PolarHBondContact O-N 3.5Å; L555-Q558 WeakPolarHBondContact O-CB 3.43Å; L555-Q558 PolarHBondContact O-N 3.43Å; L555-Q558 VanDerWaalsContact O-N 3.16Å; L555-N559 PolarHBondContact O-N 2.85Å; L555-N559 PolarHBondContact O-ND2 2.93Å; L555-N559 PolarHBondContact O-OD1 2.91Å
556	K	90.7	Very high	89.4	Confident	21 Å²	21	31 Å²	31	9%	0.091	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-28.2	178.9	73.7	-172.6	-171.8	168.7	0	112.5	A75 T77 E80 D554 I560	A75-K556 WeakPolarHBondContact O-CE 3.24Å; A75-K556 PolarHBondContact O-NZ 3.27Å; T77-K556 HydrophobicContact CG2-CB 4.09Å; T77-K556 HydrophobicContact CG2-CD 3.85Å; T77-K556 HydrophobicContact CG2-CG 3.75Å; E80-K556 VanDerWaalsContact CD-NZ 3.27Å; E80-K556 IonicContact OE1-NZ 3.16Å; E80-K556 PolarHBondContact OE1-NZ 2.97Å; E80-K556 IonicContact OE2-NZ 3.31Å; E80-K556 PolarHBondContact OE2-NZ 3.02Å; D554-K556 PolarHBondContact O-N 2.81Å; D554-K556 VanDerWaalsContact O-N 3.17Å; K556-I560 WeakPolarHBondContact O-CG1 3.17Å; K556-I560 PolarHBondContact O-N 3.31Å
557	F	93.6	Very high	90.4	Very high	2 Å²	2	30 Å²	30	1%	0.009	17%	0.166	C	C	.	.	H	α-helix	trans	-85.5	-34.8	174.7	-58.1	-62.6	0	0	0	112.4	A75 T77 I479 A482 K483 D554 L555 N559 I560 V561	A75-F557 HydrophobicContact CB-CE1 4.3Å; A75-F557 HydrophobicContact CB-CZ 3.72Å; T77-F557 HydrophobicContact CG2-CD1 4.23Å; T77-F557 HydrophobicContact CG2-CE1 3.84Å; T77-F557 HydrophobicContact CG2-CZ 4.46Å; I479-F557 HydrophobicContact CD1-CB 3.97Å; I479-F557 HydrophobicContact CG2-CB 4.24Å; A482-F557 HydrophobicContact CB-CB 3.93Å; A482-F557 HydrophobicContact CB-CD1 4.3Å; A482-F557 WeakPolarHBondContact O-CD1 3.4Å; K483-F557 HydrophobicContact CB-CE1 4.34Å; K483-F557 HydrophobicContact CD-CD2 4.26Å; K483-F557 HydrophobicContact CD-CE2 4.16Å; K483-F557 VanDerWaalsContact CE-CE2 3.49Å; K483-F557 HydrophobicContact CG-CD1 3.85Å; K483-F557 HydrophobicContact CG-CD2 3.83Å; K483-F557 HydrophobicContact CG-CE1 3.85Å; K483-F557 HydrophobicContact CG-CE2 3.83Å; K483-F557 HydrophobicContact CG-CG 3.85Å; K483-F557 HydrophobicContact CG-CZ 3.84Å; D554-F557 WeakPolarHBondContact O-CA 3.26Å; D554-F557 WeakPolarHBondContact O-CB 3.36Å; D554-F557 PolarHBondContact O-N 3.4Å; L555-F557 PolarHBondContact O-N 3.5Å; F557-N559 VanDerWaalsContact C-N 3.26Å; F557-N559 PolarHBondContact O-N 3.02Å; F557-I560 HydrophobicContact CD1-CD1 4.3Å; F557-I560 PolarHBondContact O-N 3.15Å; F557-V561 WeakPolarHBondContact O-CG2 3.27Å; F557-V561 PolarHBondContact O-N 3.26Å
558	Q	94.6	Very high	91.3	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-56.2	-43.5	169.1	-62.3	175	17.5	0	0	111.2	Y475 I479 G538 M542 D554 L555 I560 V561 V562	Y475-Q558 HydrophobicContact CE2-CG 4.26Å; Y475-Q558 PolarHBondContact OH-NE2 3.2Å; I479-Q558 HydrophobicContact CD1-CB 4.42Å; I479-Q558 HydrophobicContact CD1-CG 3.62Å; G538-Q558 PolarHBondContact O-OE1 3.19Å; M542-Q558 HydrophobicContact CB-CB 4.34Å; M542-Q558 HydrophobicContact CB-CG 3.89Å; M542-Q558 HydrophobicContact CE-CG 4.35Å; M542-Q558 VanDerWaalsContact O-CD 3.32Å; M542-Q558 PolarHBondContact O-NE2 3.05Å; M542-Q558 PolarHBondContact O-OE1 3.09Å; M542-Q558 HydrophobicContact SD-CB 4.07Å; M542-Q558 HydrophobicContact SD-CG 4.14Å; D554-Q558 PolarHBondContact O-N 2.96Å; L555-Q558 WeakPolarHBondContact O-CB 3.43Å; L555-Q558 PolarHBondContact O-N 3.43Å; L555-Q558 VanDerWaalsContact O-N 3.16Å; Q558-I560 PolarHBondContact O-N 2.63Å; Q558-V561 PolarHBondContact O-N 2.8Å; Q558-V562 PolarHBondContact O-N 3.44Å
559	N	94.8	Very high	92	Very high	4 Å²	4	27.4 Å²	27.4	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-59	-47.7	177.2	-60.7	-15.3	0	0	0	110.8	G534 L555 F557 V561 V562 E563	G534-N559 PolarHBondContact O-OD1 3.3Å; G534-N559 VanDerWaalsContact O-OD1 3.08Å; L555-N559 PolarHBondContact O-N 2.85Å; L555-N559 PolarHBondContact O-ND2 2.93Å; L555-N559 PolarHBondContact O-OD1 2.91Å; F557-N559 VanDerWaalsContact C-N 3.26Å; F557-N559 PolarHBondContact O-N 3.02Å; N559-V561 PolarHBondContact O-N 2.93Å; N559-V562 PolarHBondContact O-N 2.9Å; N559-E563 WeakPolarHBondContact O-CB 3.47Å; N559-E563 WeakPolarHBondContact O-CG 3.34Å; N559-E563 PolarHBondContact O-N 3.38Å
560	I	94.6	Very high	92.6	Very high	11 Å²	11	30.7 Å²	30.7	6%	0.056	16%	0.157	C	C	.	.	H	α-helix	trans	-61	-40.7	176.4	-69.7	167.3	0	0	0	112.2	T77 A482 K556 F557 Q558 V562 E563 I564	T77-I560 HydrophobicContact CG2-CD1 3.47Å; T77-I560 VanDerWaalsContact CG2-CD1 3.47Å; A482-I560 HydrophobicContact CB-CB 4.28Å; A482-I560 HydrophobicContact CB-CG2 3.99Å; K556-I560 WeakPolarHBondContact O-CG1 3.17Å; K556-I560 PolarHBondContact O-N 3.31Å; F557-I560 HydrophobicContact CD1-CD1 4.3Å; F557-I560 PolarHBondContact O-N 3.15Å; Q558-I560 PolarHBondContact O-N 2.63Å; I560-V562 VanDerWaalsContact C-N 3.33Å; I560-V562 PolarHBondContact O-N 2.91Å; I560-E563 PolarHBondContact O-N 3.42Å; I560-I564 HydrophobicContact CG2-CD1 3.87Å; I560-I564 WeakPolarHBondContact O-CG1 3.31Å; I560-I564 PolarHBondContact O-N 3.39Å
561	V	96.9	Very high	93.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-46.2	175.2	174.5	0	0	0	0	110.2	M470 F478 A482 I494 M542 F557 Q558 N559 I564 L565	M470-V561 HydrophobicContact CE-CG1 3.73Å; F478-V561 HydrophobicContact CB-CG1 4.39Å; F478-V561 HydrophobicContact CB-CG2 4.47Å; F478-V561 HydrophobicContact CD1-CG1 4.07Å; F478-V561 VanDerWaalsContact O-CG2 3.24Å; F478-V561 WeakPolarHBondContact O-CG2 3.45Å; A482-V561 HydrophobicContact CB-CG2 3.78Å; I494-V561 HydrophobicContact CD1-CG1 4.35Å; I494-V561 HydrophobicContact CD1-CG2 4.35Å; M542-V561 HydrophobicContact SD-CB 3.99Å; M542-V561 HydrophobicContact SD-CG1 3.92Å; M542-V561 HydrophobicContact SD-CG2 4.41Å; F557-V561 WeakPolarHBondContact O-CG2 3.27Å; F557-V561 PolarHBondContact O-N 3.26Å; Q558-V561 PolarHBondContact O-N 2.8Å; N559-V561 PolarHBondContact O-N 2.93Å; V561-I564 PolarHBondContact O-N 2.86Å; V561-L565 HydrophobicContact CG1-CD1 4.01Å; V561-L565 HydrophobicContact CG1-CG 4.44Å; V561-L565 WeakPolarHBondContact O-CB 3.42Å; V561-L565 WeakPolarHBondContact O-CG 3.19Å; V561-L565 PolarHBondContact O-N 3.06Å
562	V	97.4	Very high	93.8	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.2	-39	178	174.4	0	0	0	0	112	F537 L541 Q558 N559 I560 I564 L565 I566	F537-V562 HydrophobicContact CB-CG1 3.89Å; L541-V562 HydrophobicContact CD1-CG2 4.17Å; Q558-V562 PolarHBondContact O-N 3.44Å; N559-V562 PolarHBondContact O-N 2.9Å; I560-V562 VanDerWaalsContact C-N 3.33Å; I560-V562 PolarHBondContact O-N 2.91Å; V562-I564 PolarHBondContact O-N 2.9Å; V562-L565 PolarHBondContact O-N 2.88Å; V562-I566 HydrophobicContact CG1-CD1 3.8Å; V562-I566 HydrophobicContact CG1-CG1 4.34Å; V562-I566 VanDerWaalsContact O-CG1 3.27Å; V562-I566 WeakPolarHBondContact O-CG1 3.41Å; V562-I566 PolarHBondContact O-N 3.01Å
563	E	96.7	Very high	94.2	Very high	25 Å²	25	33 Å²	33	12%	0.117	15%	0.152	C	C	.	.	H	α-helix	trans	-57.2	-49.7	174.2	-70.4	162.2	-152.2	0	0	110.8	R238 V530 N559 I560 L565 I566 E567	R238-E563 IonicContact CZ-OE1 2.67Å; R238-E563 IonicContact CZ-OE2 3.91Å; R238-E563 IonicContact NE-OE1 3.97Å; R238-E563 PolarHBondContact NE-OE1 3.49Å; R238-E563 IonicContact NH2-OE1 2.94Å; R238-E563 PolarHBondContact NH2-OE1 3.45Å; R238-E563 IonicContact NH2-OE2 3.07Å; R238-E563 PolarHBondContact NH2-OE2 3.24Å; V530-E563 HydrophobicContact CG1-CB 3.88Å; V530-E563 HydrophobicContact CG1-CG 4.01Å; N559-E563 WeakPolarHBondContact O-CB 3.47Å; N559-E563 WeakPolarHBondContact O-CG 3.34Å; N559-E563 PolarHBondContact O-N 3.38Å; I560-E563 PolarHBondContact O-N 3.42Å; E563-L565 PolarHBondContact O-N 3.45Å; E563-I566 PolarHBondContact O-N 3.05Å; E563-E567 WeakPolarHBondContact O-CG 3.36Å; E563-E567 PolarHBondContact O-N 3.1Å
564	I	96.6	Very high	94.2	Very high	15 Å²	15	34.9 Å²	34.9	8%	0.077	17%	0.168	C	C	.	.	H	α-helix	trans	-61.1	-41.6	176.3	-68.7	167.1	0	0	0	111.8	R490 I491 I494 I560 V561 V562 I566 H568 I572	R490-I564 HydrophobicContact CB-CD1 4.1Å; I491-I564 HydrophobicContact CG1-CG2 3.98Å; I494-I564 HydrophobicContact CD1-CB 4.06Å; I494-I564 HydrophobicContact CD1-CD1 3.66Å; I494-I564 HydrophobicContact CD1-CG1 4.46Å; I494-I564 HydrophobicContact CD1-CG2 3.81Å; I494-I564 HydrophobicContact CG2-CG2 4.47Å; I560-I564 HydrophobicContact CG2-CD1 3.87Å; I560-I564 WeakPolarHBondContact O-CG1 3.31Å; I560-I564 PolarHBondContact O-N 3.39Å; V561-I564 PolarHBondContact O-N 2.86Å; V562-I564 PolarHBondContact O-N 2.9Å; I564-I566 VanDerWaalsContact C-N 3.32Å; I564-I566 PolarHBondContact O-N 3.29Å; I564-H568 WeakPolarHBondContact O-CB 3.17Å; I564-H568 PolarHBondContact O-N 2.82Å; I564-I572 HydrophobicContact CG2-CD1 4.23Å
565	L	97.8	Very high	93.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-35	178.5	-73.2	171.9	0	0	0	112.6	M470 I494 V498 L509 M513 V561 V562 E563 H569 I572 F573	M470-L565 HydrophobicContact CE-CD1 3.91Å; M470-L565 HydrophobicContact SD-CD1 4.01Å; I494-L565 HydrophobicContact CG2-CD2 3.55Å; I494-L565 HydrophobicContact CG2-CG 4.05Å; V498-L565 HydrophobicContact CG2-CD2 3.52Å; L509-L565 HydrophobicContact CD2-CD1 4.41Å; M513-L565 HydrophobicContact CG-CB 3.95Å; M513-L565 HydrophobicContact SD-CB 3.49Å; M513-L565 WeakPolarHBondContact SD-CB 3.47Å; M513-L565 HydrophobicContact SD-CD1 4.43Å; V561-L565 HydrophobicContact CG1-CD1 4.01Å; V561-L565 HydrophobicContact CG1-CG 4.44Å; V561-L565 WeakPolarHBondContact O-CB 3.42Å; V561-L565 WeakPolarHBondContact O-CG 3.19Å; V561-L565 PolarHBondContact O-N 3.06Å; V562-L565 PolarHBondContact O-N 2.88Å; E563-L565 PolarHBondContact O-N 3.45Å; L565-H569 VanDerWaalsContact O-CA 3.26Å; L565-H569 WeakPolarHBondContact O-CA 3.39Å; L565-H569 VanDerWaalsContact O-CB 3.22Å; L565-H569 WeakPolarHBondContact O-CB 3.25Å; L565-H569 PolarHBondContact O-N 2.98Å; L565-I572 HydrophobicContact CD2-CD1 4.24Å; L565-I572 HydrophobicContact CD2-CG2 4.08Å; L565-F573 HydrophobicContact CD2-CE2 4.09Å; L565-F573 HydrophobicContact CD2-CZ 4.09Å
566	I	97.8	Very high	93.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-72.4	-51.9	175.8	-68.3	168.4	0	0	0	110.4	M513 L516 A517 V530 L533 V562 E563 I564 H568 H569	M513-I566 HydrophobicContact SD-CG1 3.73Å; L516-I566 HydrophobicContact CB-CD1 3.87Å; L516-I566 HydrophobicContact CB-CG1 3.91Å; L516-I566 HydrophobicContact CD1-CD1 3.98Å; L516-I566 HydrophobicContact CD1-CG1 4.36Å; A517-I566 HydrophobicContact CB-CG2 4.04Å; V530-I566 HydrophobicContact CG1-CB 4.1Å; V530-I566 HydrophobicContact CG1-CD1 4.47Å; V530-I566 HydrophobicContact CG1-CG2 4.05Å; V530-I566 HydrophobicContact CG2-CG2 4.15Å; L533-I566 HydrophobicContact CB-CD1 3.94Å; V562-I566 HydrophobicContact CG1-CD1 3.8Å; V562-I566 HydrophobicContact CG1-CG1 4.34Å; V562-I566 VanDerWaalsContact O-CG1 3.27Å; V562-I566 WeakPolarHBondContact O-CG1 3.41Å; V562-I566 PolarHBondContact O-N 3.01Å; E563-I566 PolarHBondContact O-N 3.05Å; I564-I566 VanDerWaalsContact C-N 3.32Å; I564-I566 PolarHBondContact O-N 3.29Å; I566-H568 PolarHBondContact O-N 3.21Å; I566-H569 WeakPolarHBondContact O-CB 3.2Å; I566-H569 PolarHBondContact O-CD2 3Å; I566-H569 PolarHBondContact O-N 3.05Å
567	E	96.7	Very high	92.7	Very high	113 Å²	113	41.9 Å²	41.9	53%	0.528	22%	0.215	S	C	.	.	H	α-helix	trans	-64.2	-41.1	-175.8	-72.8	177.1	169.3	0	0	112.7	V530 E563	V530-E567 HydrophobicContact CG1-CG 3.88Å; V530-E567 HydrophobicContact CG2-CG 4.1Å; E563-E567 WeakPolarHBondContact O-CG 3.36Å; E563-E567 PolarHBondContact O-N 3.1Å
568	H	95.9	Very high	91.3	Very high	64 Å²	64	47.6 Å²	47.6	30%	0.296	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	18.4	-176.3	-60.9	-69.4	0	0	0	113.4	I491 I564 I566 K570 K571 I572	I491-H568 VanDerWaalsContact CD1-NE2 3.29Å; I491-H568 WeakPolarHBondContact CD1-NE2 3.32Å; I491-H568 HydrophobicContact CG2-CB 4.37Å; I564-H568 WeakPolarHBondContact O-CB 3.17Å; I564-H568 PolarHBondContact O-N 2.82Å; I566-H568 PolarHBondContact O-N 3.21Å; H568-K570 PolarHBondContact O-N 3.01Å; H568-K571 PolarHBondContact O-N 3.46Å; H568-I572 HydrophobicContact CB-CD1 3.72Å; H568-I572 HydrophobicContact CB-CG1 4.09Å; H568-I572 PolarHBondContact O-N 3.46Å
569	H	95.8	Very high	89.1	Confident	31 Å²	31	55.9 Å²	55.9	14%	0.144	29%	0.286	C	S	.	.	H	α-helix	trans	-52.5	-35.4	-174.7	84.3	93.2	0	0	0	113.7	M513 A517 L565 I566 F573	M513-H569 HydrophobicContact CB-CB 3.98Å; A517-H569 VanDerWaalsContact CB-CD2 3.49Å; A517-H569 WeakPolarHBondContact CB-CD2 3.35Å; L565-H569 VanDerWaalsContact O-CA 3.26Å; L565-H569 WeakPolarHBondContact O-CA 3.39Å; L565-H569 VanDerWaalsContact O-CB 3.22Å; L565-H569 WeakPolarHBondContact O-CB 3.25Å; L565-H569 PolarHBondContact O-N 2.98Å; I566-H569 WeakPolarHBondContact O-CB 3.2Å; I566-H569 PolarHBondContact O-CD2 3Å; I566-H569 PolarHBondContact O-N 3.05Å; H569-F573 HydrophobicContact CB-CD2 4.44Å; H569-F573 WeakPolarHBondContact O-CD2 3.35Å; H569-F573 PolarHBondContact O-N 3.33Å
570	K	93.6	Very high	86.7	Confident	150 Å²	150	64.7 Å²	64.7	65%	0.652	32%	0.319	S	S	*	.	H	α-helix	trans	-62.7	-53.1	177.2	-62.4	-177.6	-176.9	171.1	0	110.9	H568 T574	H568-K570 PolarHBondContact O-N 3.01Å; K570-T574 WeakPolarHBondContact O-CB 3.44Å; K570-T574 PolarHBondContact O-N 3.48Å; K570-T574 VanDerWaalsContact O-N 3.08Å; K570-T574 PolarHBondContact O-OG1 2.76Å
571	K	92.6	Very high	84.1	Confident	101 Å²	101	69.7 Å²	69.7	44%	0.439	35%	0.352	S	S	.	.	H	α-helix	trans	-64.7	-51.5	-178.4	-178.3	-179.3	-179.6	-178.9	0	111	H568 F573 D575	H568-K571 PolarHBondContact O-N 3.46Å; K571-F573 VanDerWaalsContact C-N 3.34Å; K571-F573 PolarHBondContact O-N 3.03Å; K571-D575 WeakPolarHBondContact CA-OD2 3.28Å; K571-D575 WeakPolarHBondContact CG-OD2 3.37Å; K571-D575 WeakPolarHBondContact O-CB 3.21Å; K571-D575 PolarHBondContact O-N 3.35Å; K571-D575 VanDerWaalsContact O-N 3.12Å
572	I	94.8	Very high	81.5	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-63.2	-37.2	-170.7	-69.5	174.3	0	0	0	112.5	I494 H495 V498 H499 I564 L565 H568	I494-I572 HydrophobicContact CG2-CD1 4.26Å; H495-I572 HydrophobicContact CB-CG1 4.24Å; H495-I572 PolarHBondContact CD2-O 2.79Å; H495-I572 VanDerWaalsContact CD2-O 3.24Å; V498-I572 HydrophobicContact CB-CG2 3.9Å; V498-I572 HydrophobicContact CG1-CG2 3.92Å; V498-I572 HydrophobicContact CG2-CG2 3.77Å; H499-I572 VanDerWaalsContact NE2-C 3.31Å; H499-I572 PolarHBondContact NE2-O 3.11Å; I564-I572 HydrophobicContact CG2-CD1 4.23Å; L565-I572 HydrophobicContact CD2-CD1 4.24Å; L565-I572 HydrophobicContact CD2-CG2 4.08Å; H568-I572 HydrophobicContact CB-CD1 3.72Å; H568-I572 HydrophobicContact CB-CG1 4.09Å; H568-I572 PolarHBondContact O-N 3.46Å
573	F	92.4	Very high	78.4	Confident	42 Å²	42	83.1 Å²	83.1	18%	0.184	43%	0.43	C	S	.	.	H	α-helix	trans	-104.1	-12.2	-174.8	-64.2	-90.5	0	0	0	114.8	V498 L509 G510 M513 L565 H569 K571	V498-F573 HydrophobicContact CG1-CD1 3.84Å; V498-F573 HydrophobicContact CG1-CE1 3.42Å; V498-F573 VanDerWaalsContact CG1-CE1 3.42Å; V498-F573 HydrophobicContact CG1-CZ 3.84Å; V498-F573 HydrophobicContact CG2-CZ 4.28Å; L509-F573 HydrophobicContact CB-CE1 4.11Å; L509-F573 HydrophobicContact CB-CZ 4.35Å; L509-F573 HydrophobicContact CD2-CE1 3.98Å; L509-F573 HydrophobicContact CD2-CZ 3.75Å; L509-F573 HydrophobicContact CG-CE1 3.96Å; L509-F573 HydrophobicContact CG-CZ 3.71Å; G510-F573 VanDerWaalsContact CA-CD1 3.41Å; M513-F573 HydrophobicContact CB-CE2 4.05Å; M513-F573 HydrophobicContact CG-CE2 3.88Å; M513-F573 HydrophobicContact CG-CZ 3.99Å; L565-F573 HydrophobicContact CD2-CE2 4.09Å; L565-F573 HydrophobicContact CD2-CZ 4.09Å; H569-F573 HydrophobicContact CB-CD2 4.44Å; H569-F573 WeakPolarHBondContact O-CD2 3.35Å; H569-F573 PolarHBondContact O-N 3.33Å; K571-F573 VanDerWaalsContact C-N 3.34Å; K571-F573 PolarHBondContact O-N 3.03Å
574	T	85.2	Confident	75.8	Confident	110 Å²	110	87.9 Å²	87.9	68%	0.675	46%	0.463	S	S	*	.	H	α-helix	trans	-100.9	-39.5	178.1	-42.9	0	0	0	0	112.4	K570	K570-T574 WeakPolarHBondContact O-CB 3.44Å; K570-T574 PolarHBondContact O-N 3.48Å; K570-T574 VanDerWaalsContact O-N 3.08Å; K570-T574 PolarHBondContact O-OG1 2.76Å
575	D	83.3	Confident	73.2	Confident	80 Å²	80	92.3 Å²	92.3	43%	0.428	50%	0.502	S	S	.	.	S	Bend	trans	-90.4	140.5	-173.2	-54	-30.5	0	0	0	110.4	H495 H499 K571	H495-D575 PolarHBondContact CE1-O 3.14Å; H495-D575 PolarHBondContact NE2-O 3.49Å; H499-D575 PolarHBondContact CE1-O 3.04Å; H499-D575 PolarHBondContact NE2-O 2.95Å; K571-D575 WeakPolarHBondContact CA-OD2 3.28Å; K571-D575 WeakPolarHBondContact CG-OD2 3.37Å; K571-D575 WeakPolarHBondContact O-CB 3.21Å; K571-D575 PolarHBondContact O-N 3.35Å; K571-D575 VanDerWaalsContact O-N 3.12Å
576	S	77.9	Confident	70.2	Confident	99 Å²	99	94.7 Å²	94.7	69%	0.692	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-70.7	140.8	168.6	-66	0	0	0	0	110.4	E578	S576-E578 PolarHBondContact O-N 2.93Å
577	P	77	Confident	67.7	Low	30 Å²	30	101.3 Å²	101.3	20%	0.195	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-60.7	134.3	175.3	-21.2	32.1	0	0	0	111.6	H499 L579	H499-P577 HydrophobicContact CB-CG 3.85Å; P577-L579 PolarHBondContact O-N 3.39Å; P577-L579 VanDerWaalsContact O-N 3.17Å
578	E	65.6	Low	64.7	Low	122 Å²	122	102.4 Å²	102.4	57%	0.57	58%	0.584	S	S	*	*			trans	-65.9	113.9	173.8	-73.2	-171.4	-166.2	0	0	110.5	S576 R580	S576-E578 PolarHBondContact O-N 2.93Å; E578-R580 VanDerWaalsContact C-N 3.31Å; E578-R580 PolarHBondContact O-N 2.84Å; E578-R580 IonicContact OE2-CZ 3.06Å; E578-R580 IonicContact OE2-NE 2.74Å; E578-R580 IonicContact OE2-NH2 3.61Å
579	L	47.7	Very low	61.8	Low	175 Å²	175	107.2 Å²	107.2	92%	0.916	61%	0.611	S	S	*	*			trans	-67.4	83.9	174	-72.1	169.8	0	0	0	111.2	P577	P577-L579 PolarHBondContact O-N 3.39Å; P577-L579 VanDerWaalsContact O-N 3.17Å
580	R	43.5	Very low	59	Low	189 Å²	189	111.9 Å²	111.9	71%	0.713	65%	0.647	S	S	*	*			trans	-119.3	122.3	163.5	-67.9	-172.8	-173.8	-179.5	6.2	109.5	E578 L582	E578-R580 VanDerWaalsContact C-N 3.31Å; E578-R580 PolarHBondContact O-N 2.84Å; E578-R580 IonicContact OE2-CZ 3.06Å; E578-R580 IonicContact OE2-NE 2.74Å; E578-R580 IonicContact OE2-NH2 3.61Å; R580-L582 PolarHBondContact O-N 3.12Å
581	P	40.9	Very low	55.9	Low	116 Å²	116	109 Å²	109	75%	0.753	65%	0.651	S	S	*	*			trans	-65.6	135.1	177	27	-33.1	0	0	0	110.5	S583	P581-S583 PolarHBondContact O-N 3.3Å
582	L	42.5	Very low	53	Low	181 Å²	181	110.3 Å²	110.3	95%	0.948	67%	0.671	S	S	*	*			trans	-66.6	92.6	170.4	-74.9	160.6	0	0	0	109.4	R580	R580-L582 PolarHBondContact O-N 3.12Å
583	S	31.8	Very low	50	Low	100 Å²	100	115.8 Å²	115.8	70%	0.699	70%	0.704	S	S	*	*			trans	-76.1	140.7	170.4	-65.3	0	0	0	0	110.6	P581	P581-S583 PolarHBondContact O-N 3.3Å
584	P	42.8	Very low	47.2	Very low	125 Å²	125	125.7 Å²	125.7	81%	0.812	74%	0.74	S	S	*	*			trans	-65.2	147.9	178.3	27.8	-34.6	0	0	0	111.4	G586	P584-G586 PolarHBondContact O-N 3.42Å
585	A	42	Very low	44.6	Very low	108 Å²	108	126.5 Å²	126.5	89%	0.893	74%	0.736	S	S	*	*			trans	-61.6	115.8	-169.4	0	0	0	0	0	113.6
586	G	34.9	Very low	42.1	Very low	51 Å²	51	128.4 Å²	128.4	53%	0.526	76%	0.756	S	S	.	*			trans	-90.5	152.5	153.9	0	0	0	0	0	110.3	P584 V588	P584-G586 PolarHBondContact O-N 3.42Å; G586-V588 PolarHBondContact O-N 2.97Å
587	P	44.4	Very low	39.8	Very low	140 Å²	140	132.8 Å²	132.8	91%	0.909	76%	0.762	S	S	*	*			trans	-73	99.5	-177.9	29.8	-33.8	0	0	0	110.7
588	V	34.1	Very low	37.7	Very low	136 Å²	136	139.6 Å²	139.6	82%	0.824	79%	0.789	S	S	*	*			trans	-89.2	127.4	172.6	-177.4	0	0	0	0	109.5	G586	G586-V588 PolarHBondContact O-N 2.97Å
589	L	35.2	Very low	36	Very low	165 Å²	165	138.6 Å²	138.6	86%	0.864	79%	0.791	S	S	*	*			trans	-55.2	137.4	179.4	-73.8	154	0	0	0	112.3	A591	L589-A591 PolarHBondContact O-N 3.12Å; L589-A591 VanDerWaalsContact O-N 3.15Å
590	S	36.5	Very low	35.1	Very low	129 Å²	129	134.7 Å²	134.7	90%	0.902	78%	0.778	S	S	*	*			trans	-60.5	110.4	-176.5	-45.7	0	0	0	0	112.9
591	A	29.5	Very low	34.9	Very low	89 Å²	89	133.6 Å²	133.6	74%	0.736	77%	0.774	S	S	*	*			trans	-104.5	147.7	159.6	0	0	0	0	0	109.1	L589	L589-A591 PolarHBondContact O-N 3.12Å; L589-A591 VanDerWaalsContact O-N 3.15Å
592	P	31.8	Very low	34.8	Very low	130 Å²	130	135.6 Å²	135.6	84%	0.844	77%	0.774	S	S	*	*			trans	-75.2	137.7	-150.3	27.3	-35.4	0	0	0	114.2
593	T	30.9	Very low	34.4	Very low	114 Å²	114	134.6 Å²	134.6	70%	0.699	77%	0.769	S	S	*	*			trans	-52.7	141.6	167	-27	0	0	0	0	110.3	Q595	T593-Q595 PolarHBondContact O-N 2.64Å
594	R	34	Very low	34.2	Very low	250 Å²	250	140.8 Å²	140.8	94%	0.943	78%	0.777	S	S	*	*			trans	-71.8	69.2	167.8	-168	-177.2	-174.4	-172.1	1.8	109.8	S596	R594-S596 PolarHBondContact O-N 3.07Å
595	Q	29.8	Very low	33.5	Very low	127 Å²	127	140.5 Å²	140.5	59%	0.593	78%	0.775	S	S	*	*			trans	-59.5	125.5	170.5	-62.1	179	-1.7	0	0	108.2	T593 K597	T593-Q595 PolarHBondContact O-N 2.64Å; Q595-K597 PolarHBondContact O-N 3.08Å; Q595-K597 VanDerWaalsContact O-N 3.12Å
596	S	31.3	Very low	33.1	Very low	120 Å²	120	141.7 Å²	141.7	84%	0.839	77%	0.766	S	S	*	*	S	Bend	trans	-50.3	121.3	148.6	-83.9	0	0	0	0	106.3	R594 K598	R594-S596 PolarHBondContact O-N 3.07Å; S596-K598 PolarHBondContact O-N 2.88Å
597	K	30.1	Very low	32.8	Very low	191 Å²	191	144.2 Å²	144.2	83%	0.83	78%	0.782	S	S	*	*			trans	-52.1	97.9	-160.6	-68.8	174.5	176.9	174.6	0	111.6	Q595 V599	Q595-K597 PolarHBondContact O-N 3.08Å; Q595-K597 VanDerWaalsContact O-N 3.12Å; K597-V599 HydrophobicContact CB-CG2 4.17Å; K597-V599 PolarHBondContact O-N 3.17Å
598	K	33.2	Very low	32.1	Very low	174 Å²	174	142.8 Å²	142.8	76%	0.757	77%	0.77	S	S	*	*			trans	-67.6	78.3	154.3	-86.6	-169.8	173.8	-179.2	0	106.6	S596 S600	S596-K598 PolarHBondContact O-N 2.88Å; K598-S600 PolarHBondContact O-N 3.36Å; K598-S600 VanDerWaalsContact O-N 3.14Å
599	V	28.8	Very low	31.9	Very low	101 Å²	101	145.3 Å²	145.3	61%	0.612	77%	0.766	S	S	*	*			trans	-56.8	117.9	161.9	175.8	0	0	0	0	105.4	K597 R601	K597-V599 HydrophobicContact CB-CG2 4.17Å; K597-V599 PolarHBondContact O-N 3.17Å; V599-R601 PolarHBondContact O-N 2.95Å
600	S	29.9	Very low	31.6	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	75%	0.748	S	S	*	*			trans	-57.6	103.4	167.3	-177.6	0	0	0	0	107.5	K598 Q602	K598-S600 PolarHBondContact O-N 3.36Å; K598-S600 VanDerWaalsContact O-N 3.14Å; S600-Q602 PolarHBondContact O-N 3.02Å
601	R	39.5	Very low	31.4	Very low	166 Å²	166	141 Å²	141	63%	0.626	74%	0.74	S	S	*	*			trans	-82.7	45.6	177.8	-76	-172.8	172.3	-159.9	-0.1	110.9	D220 V599	D220-R601 IonicContact OD1-CZ 3.48Å; D220-R601 IonicContact OD1-NH2 3.39Å; D220-R601 PolarHBondContact OD1-NH2 3.08Å; D220-R601 IonicContact OD2-CZ 2.73Å; D220-R601 IonicContact OD2-NH1 2.65Å; D220-R601 PolarHBondContact OD2-NH1 3.03Å; D220-R601 IonicContact OD2-NH2 2.66Å; D220-R601 PolarHBondContact OD2-NH2 3.24Å; V599-R601 PolarHBondContact O-N 2.95Å
602	Q	38.5	Very low	31.4	Very low	158 Å²	158	144.2 Å²	144.2	74%	0.738	74%	0.74	S	S	*	*	S	Bend	trans	-102.7	124.5	155.9	-73.4	-176.7	-18.9	0	0	107.1	S600	S600-Q602 PolarHBondContact O-N 3.02Å
603	N	33.4	Very low	31.5	Very low	159 Å²	159	144.2 Å²	144.2	85%	0.85	74%	0.737	S	S	*	*			trans	67.2	65.5	178.6	-49.7	-22.5	0	0	0	116
604	R	28.7	Very low	31.5	Very low	231 Å²	231	146.2 Å²	146.2	87%	0.872	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-72.9	135.9	130.2	-106.9	-175	177.6	178.8	-0.6	106.6	L606	R604-L606 PolarHBondContact O-N 3.21Å
605	P	27.6	Very low	31.3	Very low	119 Å²	119	141.4 Å²	141.4	77%	0.773	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-58.9	132.3	170.3	26.4	-32.6	0	0	0	107.9	A607	P605-A607 PolarHBondContact O-N 2.67Å
606	L	32.4	Very low	31.4	Very low	132 Å²	132	142.2 Å²	142.2	69%	0.691	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-51.2	136.5	164.9	-71.4	163.3	0	0	0	107.4	R604 V608	R604-L606 PolarHBondContact O-N 3.21Å; L606-V608 HydrophobicContact CB-CG2 3.96Å; L606-V608 PolarHBondContact O-N 3.2Å
607	A	30	Very low	31.4	Very low	105 Å²	105	144.7 Å²	144.7	87%	0.868	74%	0.741	S	S	*	*			trans	-68.1	80.8	160.7	0	0	0	0	0	107	P605 Y609	P605-A607 PolarHBondContact O-N 2.67Å; A607-Y609 VanDerWaalsContact C-N 3.28Å; A607-Y609 PolarHBondContact O-N 2.96Å
608	V	29.3	Very low	31.2	Very low	109 Å²	109	142.9 Å²	142.9	66%	0.661	74%	0.741	S	S	*	*			trans	-66.8	95.4	173.3	179.7	0	0	0	0	106	L606 N610	L606-V608 HydrophobicContact CB-CG2 3.96Å; L606-V608 PolarHBondContact O-N 3.2Å; V608-N610 HydrophobicContact CG1-CB 4.34Å; V608-N610 PolarHBondContact O-N 3.04Å
609	Y	29.4	Very low	31	Very low	189 Å²	189	138.7 Å²	138.7	74%	0.741	74%	0.738	S	S	*	*			trans	-66.7	92.6	162.9	-161.3	-86.4	0	0	0	106.4	A607 P611	A607-Y609 VanDerWaalsContact C-N 3.28Å; A607-Y609 PolarHBondContact O-N 2.96Å; Y609-P611 WeakPolarHBondContact O-CD 3.26Å
610	N	29	Very low	31	Very low	90 Å²	90	140.9 Å²	140.9	48%	0.481	75%	0.752	S	S	.	*			trans	-75.1	112.4	-172.6	-171.3	21.6	0	0	0	109.3	V608 Q612	V608-N610 HydrophobicContact CG1-CB 4.34Å; V608-N610 PolarHBondContact O-N 3.04Å; N610-Q612 PolarHBondContact O-N 3.25Å
611	P	32.1	Very low	30.8	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	76%	0.755	S	S	*	*			trans	-77.3	-1.4	-177.8	-12.1	30.6	0	0	0	113.1	Y609 V613	Y609-P611 WeakPolarHBondContact O-CD 3.26Å; P611-V613 PolarHBondContact O-N 3.43Å
612	Q	30.7	Very low	30.3	Very low	158 Å²	158	140 Å²	140	74%	0.738	77%	0.769	S	S	*	*			trans	-95.1	66.7	-169.9	-63.7	-178.5	-21.5	0	0	112.9	N610	N610-Q612 PolarHBondContact O-N 3.25Å
613	V	32.9	Very low	29.7	Very low	129 Å²	129	136 Å²	136	78%	0.782	77%	0.77	S	S	*	*			trans	-141.6	66.9	157.9	-168.5	0	0	0	0	109.9	P611	P611-V613 PolarHBondContact O-N 3.43Å
614	L	31.1	Very low	29.5	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	77%	0.77	S	S	*	*			trans	-148.7	57.1	163.8	-94.4	179.7	0	0	0	109.7
615	D	28.9	Very low	29.6	Very low	149 Å²	149	127.2 Å²	127.2	80%	0.797	76%	0.762	S	S	*	*			trans	-95.9	105.5	163.3	-99.2	-29.4	0	0	0	109
616	I	32.1	Very low	29.7	Very low	144 Å²	144	129.1 Å²	129.1	74%	0.738	77%	0.765	S	S	*	*			trans	-86	107.7	166.7	-63.4	173.4	0	0	0	106.9
617	Q	31.1	Very low	29.6	Very low	172 Å²	172	128.8 Å²	128.8	80%	0.804	77%	0.768	S	S	*	*			trans	-102.2	127.2	165.8	-70.7	-169.3	10.4	0	0	110.5
618	N	27.6	Very low	29.7	Very low	153 Å²	153	127.5 Å²	127.5	82%	0.818	76%	0.757	S	S	*	*			trans	-85.7	135	179.2	-95.6	-26.7	0	0	0	111.8
619	A	27.3	Very low	29.6	Very low	85 Å²	85	129.4 Å²	129.4	70%	0.702	76%	0.764	S	S	*	*			trans	89.7	144.3	137.6	0	0	0	0	0	122.2
620	T	28.9	Very low	29.6	Very low	147 Å²	147	127.7 Å²	127.7	90%	0.902	76%	0.762	S	S	*	*			trans	79.6	120.1	159.1	61.9	0	0	0	0	120.9
621	G	26.4	Very low	29.6	Very low	70 Å²	70	129.4 Å²	129.4	72%	0.722	78%	0.777	S	S	*	*			trans	120.8	93.6	131.6	0	0	0	0	0	118.3
622	D	28.3	Very low	29.3	Very low	171 Å²	171	128.2 Å²	128.2	91%	0.914	77%	0.771	S	S	*	*			trans	48.6	122.6	148.9	-64.3	-13.4	0	0	0	123
623	G	26.6	Very low	29.1	Very low	73 Å²	73	129.3 Å²	129.3	75%	0.753	78%	0.778	S	S	*	*				123.5	102.8	107.6	0	0	0	0	0	119.7
624	S	29.4	Very low	28.8	Very low	123 Å²	123	126 Å²	126	86%	0.86	77%	0.77	S	S	*	*			trans	67.6	113	159.3	-93.4	0	0	0	0	118.7
625	A	30.1	Very low	28.9	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	77%	0.768	S	S	*	*				85.6	126.5	82.2	0	0	0	0	0	112.2
626	L	30.7	Very low	28.9	Very low	159 Å²	159	123.6 Å²	123.6	83%	0.832	77%	0.766	S	S	*	*			cis	-146.5	-179.9	7.1	-81.9	130.7	0	0	0	108.4
627	T	30.6	Very low	28.7	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	77%	0.772	S	S	*	*			cis	-154.4	170.4	13.6	-15.6	0	0	0	0	112.3
628	A	31.7	Very low	28.6	Very low	78 Å²	78	122.3 Å²	122.3	65%	0.645	77%	0.769	S	S	*	*			trans	-36.3	166.1	153.7	0	0	0	0	0	118.3
629	D	27.1	Very low	28.6	Very low	149 Å²	149	121.1 Å²	121.1	80%	0.797	77%	0.767	S	S	*	*			cis	-147.5	136.3	13	-114.5	-4.4	0	0	0	107.7
630	E	28.8	Very low	28.6	Very low	153 Å²	153	122.1 Å²	122.1	72%	0.715	77%	0.769	S	S	*	*				89.3	150.3	68	-92.6	-65.4	163.4	0	0	117.2
631	T	28.5	Very low	28.5	Very low	127 Å²	127	119.7 Å²	119.7	78%	0.779	76%	0.758	S	S	*	*			trans	81.7	144.6	172.6	70.4	0	0	0	0	120.9
632	S	25.8	Very low	28.4	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	77%	0.766	S	S	*	*			cis	-173.8	159	-31.9	-158	0	0	0	0	109.9
633	M	28.3	Very low	28.3	Very low	181 Å²	181	122.4 Å²	122.4	89%	0.892	76%	0.758	S	S	*	*			trans	62.8	142.8	168.1	-54.4	-65.3	161	0	0	117.1
634	G	26.6	Very low	28.5	Very low	59 Å²	59	124.5 Å²	124.5	61%	0.608	76%	0.761	S	S	*	*			cis	168.1	145.5	-6.2	0	0	0	0	0	111.2
635	S	31.7	Very low	28.3	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	76%	0.755	S	S	*	*				45.9	139.9	122.1	-76.3	0	0	0	0	120.7
636	N	30.1	Very low	28.1	Very low	145 Å²	145	124 Å²	124	78%	0.775	76%	0.758	S	S	*	*			cis	-153.5	-175.8	8.6	-82.1	-28.8	0	0	0	107.1
637	E	28.2	Very low	28	Very low	185 Å²	185	121.4 Å²	121.4	86%	0.864	75%	0.753	S	S	*	*			cis	-148.5	152.2	30.1	-68.3	-178.4	127	0	0	114.2
638	S	28.8	Very low	27.7	Very low	105 Å²	105	121.6 Å²	121.6	73%	0.734	75%	0.754	S	S	*	*			trans	-79.8	-177.3	160.6	-52.1	0	0	0	0	109.6
639	V	27	Very low	27.5	Very low	127 Å²	127	122.5 Å²	122.5	77%	0.77	76%	0.756	S	S	*	*			cis	-170.7	157.9	33.8	-113.9	0	0	0	0	108.9
640	S	26.5	Very low	27.5	Very low	107 Å²	107	123.2 Å²	123.2	75%	0.748	75%	0.754	S	S	*	*			trans	67.6	157.7	143.6	-77.2	0	0	0	0	120.5
641	S	27.6	Very low	27.3	Very low	95 Å²	95	122.8 Å²	122.8	66%	0.664	76%	0.756	S	S	*	*			cis	-170.9	167.7	-19.5	-100.1	0	0	0	0	110.2
642	Q	25.2	Very low	27.2	Very low	193 Å²	193	122.8 Å²	122.8	90%	0.902	75%	0.747	S	S	*	*			trans	79.8	158.3	156.5	-76.5	171.1	16.6	0	0	120.1
643	S	25.2	Very low	27.2	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	75%	0.752	S	S	*	*			trans	-144.1	-173.6	-149	51.3	0	0	0	0	110.9
644	S	30	Very low	27.1	Very low	117 Å²	117	121.5 Å²	121.5	82%	0.818	74%	0.74	S	S	*	*			trans	91.8	140.4	178.2	-38.7	0	0	0	0	113
645	S	26.7	Very low	26.9	Very low	105 Å²	105	126.4 Å²	126.4	73%	0.734	75%	0.752	S	S	*	*			cis	-158.4	156.7	10.3	50.5	0	0	0	0	112.4
646	A	26.1	Very low	26.7	Very low	90 Å²	90	129.8 Å²	129.8	74%	0.744	76%	0.755	S	S	*	*				31.5	145.2	128.9	0	0	0	0	0	120.5
647	S	26.8	Very low	27.1	Very low	105 Å²	105	128 Å²	128	73%	0.734	75%	0.752	S	S	*	*			cis	-174.3	-169.7	3.4	-105.9	0	0	0	0	109.6
648	T	25.2	Very low	27	Very low	128 Å²	128	126.6 Å²	126.6	79%	0.785	75%	0.749	S	S	*	*			trans	86.5	110.9	170.4	68.7	0	0	0	0	115
649	S	27.5	Very low	26.8	Very low	97 Å²	97	128.8 Å²	128.8	68%	0.678	75%	0.752	S	S	*	*				75.3	133.1	57.4	73.6	0	0	0	0	112.1
650	E	26.4	Very low	26.7	Very low	165 Å²	165	128.4 Å²	128.4	77%	0.771	75%	0.75	S	S	*	*			cis	-160.4	150.6	9.2	-117.7	166.6	-179	0	0	108.3
651	L	26.3	Very low	26.6	Very low	143 Å²	143	127.8 Å²	127.8	75%	0.749	75%	0.751	S	S	*	*				54	138.3	106	-96.1	70.9	0	0	0	115.8
652	E	25.7	Very low	26.5	Very low	127 Å²	127	128.2 Å²	128.2	59%	0.593	76%	0.755	S	S	*	*			cis	-160.1	160.5	10.7	-93.8	-157.7	141.8	0	0	112.6
653	K	25.1	Very low	26.5	Very low	167 Å²	167	126.3 Å²	126.3	73%	0.726	75%	0.749	S	S	*	*			trans	50.7	162.9	138.2	-67.5	175.3	-170.8	146.3	0	122.1
654	A	26	Very low	26.5	Very low	75 Å²	75	126.1 Å²	126.1	62%	0.62	75%	0.748	S	S	*	*			cis	-171.3	173	-29.3	0	0	0	0	0	109.3
655	D	24	Very low	26.2	Very low	162 Å²	162	126.5 Å²	126.5	87%	0.866	75%	0.751	S	S	*	*			trans	105.1	123.3	152.9	-61.8	-23.9	0	0	0	121.3
656	H	26.4	Very low	26.1	Very low	182 Å²	182	124.6 Å²	124.6	84%	0.843	75%	0.748	S	S	*	*			trans	-84.4	169.4	163.2	-79.6	-59.8	0	0	0	109
657	P	39.5	Very low	25.9	Very low	108 Å²	108	125.9 Å²	125.9	70%	0.701	75%	0.75	S	S	*	*			cis	-158.8	168.7	49.3	41.8	-17.9	0	0	0	121.8
658	L	25.4	Very low	25.8	Very low	154 Å²	154	127.2 Å²	127.2	81%	0.806	75%	0.749	S	S	*	*			trans	36.3	129.5	140.4	-58.5	165.2	0	0	0	121.6
659	L	25.1	Very low	25.9	Very low	151 Å²	151	125.7 Å²	125.7	79%	0.791	74%	0.744	S	S	*	*				176.7	131.7	98.8	-91.7	174.5	0	0	0	115.5
660	T	23.7	Very low	25.9	Very low	119 Å²	119	132.7 Å²	132.7	73%	0.73	76%	0.755	S	S	*	*			trans	9.8	148.4	147.9	54	0	0	0	0	125.5
661	A	25.6	Very low	25.9	Very low	94 Å²	94	129.9 Å²	129.9	78%	0.777	75%	0.753	S	S	*	*			trans	75.3	152	143.7	0	0	0	0	0	118.2
662	S	25.6	Very low	25.9	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	76%	0.763	S	S	*	*			cis	-170.3	162	-13.3	-103.5	0	0	0	0	110.7
663	L	24.3	Very low	25.9	Very low	152 Å²	152	134.3 Å²	134.3	80%	0.796	78%	0.775	S	S	*	*			trans	66.7	109.2	149.5	-71.2	165.5	0	0	0	122.3
664	S	24.5	Very low	25.9	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	78%	0.775	S	S	*	*				79.2	140.1	117.2	77.2	0	0	0	0	123.6
665	S	25.2	Very low	25.8	Very low	125 Å²	125	131.4 Å²	131.4	87%	0.874	78%	0.777	S	S	*	*			trans	91.8	122.9	142.3	-152.8	0	0	0	0	120
666	G	23.1	Very low	25.9	Very low	65 Å²	65	133.8 Å²	133.8	67%	0.67	78%	0.78	S	S	*	*				115.5	76.2	114	0	0	0	0	0	120.5
667	C	22.9	Very low	25.8	Very low	117 Å²	117	130.5 Å²	130.5	79%	0.791	78%	0.777	S	S	*	*				74.3	152	126.5	-150.6	0	0	0	0	121.9
668	N	25.5	Very low	25.3	Very low	132 Å²	132	129.8 Å²	129.8	71%	0.706	78%	0.781	S	S	*	*			trans	75.9	94.2	158.1	-74.8	-29.3	0	0	0	122
669	S	26.7	Very low	25.3	Very low	96 Å²	96	128.2 Å²	128.2	67%	0.671	78%	0.783	S	S	*	*				22.8	127.1	110.5	71.4	0	0	0	0	119.6
670	R	26.2	Very low	25.3	Very low	245 Å²	245	124.8 Å²	124.8	93%	0.925	78%	0.783	S	S	*	*				-167.2	138.7	117.7	-105.9	168.3	-173.1	-166.1	1.2	113.2
671	S	26.3	Very low	25.4	Very low	105 Å²	105	123.3 Å²	123.3	73%	0.734	78%	0.783	S	S	*	*			trans	-72.2	151.3	170.4	52.7	0	0	0	0	113
672	L	26.6	Very low	25.6	Very low	182 Å²	182	125.1 Å²	125.1	95%	0.953	79%	0.79	S	S	*	*			trans	-139.6	140.9	147.4	-89.9	176.3	0	0	0	110.9
673	Q	26.1	Very low	25.6	Very low	181 Å²	181	123.4 Å²	123.4	85%	0.846	79%	0.789	S	S	*	*			trans	-98.8	147.8	178	-61	166.1	-69.1	0	0	111
674	A	24.9	Very low	25.7	Very low	87 Å²	87	123.6 Å²	123.6	72%	0.719	79%	0.791	S	S	*	*			trans	-173.6	116	137.6	0	0	0	0	0	106.3
675	S	24.9	Very low	25.8	Very low	94 Å²	94	123.3 Å²	123.3	66%	0.657	79%	0.789	S	S	*	*				60.3	108.8	63	-54.1	0	0	0	0	112.6
676	F	24.9	Very low	25.9	Very low	213 Å²	213	124.6 Å²	124.6	93%	0.934	79%	0.785	S	S	*	*				-171.4	164.2	126.1	-82	-53	0	0	0	110
677	S	25.4	Very low	26	Very low	113 Å²	113	127.7 Å²	127.7	79%	0.79	79%	0.791	S	S	*	*			trans	-132.1	165.9	-154.4	-46.4	0	0	0	0	113.5
678	A	27.5	Very low	26.1	Very low	93 Å²	93	127 Å²	127	77%	0.769	79%	0.794	S	S	*	*			trans	70.3	152.5	155.1	0	0	0	0	0	117.9
679	S	26.8	Very low	26.2	Very low	121 Å²	121	125.1 Å²	125.1	85%	0.846	80%	0.796	S	S	*	*			cis	-170.2	153.3	-14.7	-96.9	0	0	0	0	111.9
680	G	24	Very low	26.2	Very low	78 Å²	78	126.4 Å²	126.4	80%	0.804	80%	0.801	S	S	*	*			trans	80.6	171.1	154.2	0	0	0	0	0	119
681	A	27.3	Very low	26.2	Very low	89 Å²	89	121.1 Å²	121.1	74%	0.736	80%	0.796	S	S	*	*			cis	-177.8	154.2	-30.4	0	0	0	0	0	110.1
682	S	28.1	Very low	26.4	Very low	132 Å²	132	121.4 Å²	121.4	92%	0.923	81%	0.805	S	S	*	*			trans	61.1	151	168.3	46.4	0	0	0	0	118.8
683	G	26.2	Very low	26.3	Very low	68 Å²	68	116.2 Å²	116.2	70%	0.701	80%	0.795	S	S	*	*			cis	175.4	168.7	-4.3	0	0	0	0	0	112.9
684	D	26.4	Very low	26.6	Very low	156 Å²	156	112.4 Å²	112.4	83%	0.834	79%	0.794	S	S	*	*			trans	68.7	127.2	167.3	-66.8	-37.7	0	0	0	120.6
685	S	25.9	Very low	26.8	Very low	98 Å²	98	114.5 Å²	114.5	69%	0.685	79%	0.793	S	S	*	*				83.9	138.3	57.4	-61.1	0	0	0	0	112.6
686	L	27.5	Very low	27.1	Very low	151 Å²	151	117.8 Å²	117.8	79%	0.791	80%	0.796	S	S	*	*			cis	-167.9	-175.7	-0.4	-118.2	169.9	0	0	0	110.5
687	T	25.6	Very low	27.3	Very low	131 Å²	131	115.6 Å²	115.6	80%	0.804	79%	0.788	S	S	*	*			trans	79.9	127.4	170.6	71.3	0	0	0	0	117.4
688	A	26.1	Very low	27.4	Very low	102 Å²	102	120.4 Å²	120.4	84%	0.843	80%	0.795	S	S	*	*			cis	103	113.6	2.4	0	0	0	0	0	118.7
689	A	27	Very low	27.5	Very low	92 Å²	92	123.9 Å²	123.9	76%	0.76	80%	0.796	S	S	*	*			trans	-167.4	102.5	153.9	0	0	0	0	0	113.7
690	T	25.7	Very low	27.7	Very low	124 Å²	124	127.4 Å²	127.4	76%	0.761	80%	0.799	S	S	*	*			trans	35.2	127.2	132.1	54.4	0	0	0	0	122
691	T	27.2	Very low	28.1	Very low	133 Å²	133	131 Å²	131	82%	0.816	80%	0.795	S	S	*	*			cis	93.2	111.2	32.4	65	0	0	0	0	117.8
692	A	29.2	Very low	28.5	Very low	112 Å²	112	131.9 Å²	131.9	93%	0.926	80%	0.795	S	S	*	*			trans	170.1	142.9	140.2	0	0	0	0	0	110
693	G	26.5	Very low	29.3	Very low	72 Å²	72	130.7 Å²	130.7	74%	0.742	78%	0.782	S	S	*	*			cis	170.3	145.6	-11.1	0	0	0	0	0	112.8
694	A	30.8	Very low	30.5	Very low	102 Å²	102	132.5 Å²	132.5	84%	0.843	78%	0.78	S	S	*	*			trans	66	146.6	170.5	0	0	0	0	0	118.4
695	D	30.5	Very low	32.2	Very low	130 Å²	130	131.3 Å²	131.3	70%	0.695	77%	0.773	S	S	*	*			cis	-155.5	147.9	10	-141.9	-2	0	0	0	113.1
696	K	30.3	Very low	35.1	Very low	164 Å²	164	133.4 Å²	133.4	71%	0.713	77%	0.766	S	S	*	*			trans	52.6	148.2	154.7	-74.5	175.7	-177.5	174.3	0	123.2
697	E	28.7	Very low	38.3	Very low	166 Å²	166	130.8 Å²	130.8	78%	0.776	75%	0.748	S	S	*	*			cis	-172.5	116.8	-23.6	-134.3	173.4	-172.7	0	0	109.9
698	K	28.8	Very low	41.6	Very low	214 Å²	214	124.5 Å²	124.5	93%	0.93	71%	0.71	S	S	*	*			trans	-176	126.3	142.7	-110.9	176.7	179.9	179.1	0	110.2	E700	K698-E700 PolarHBondContact O-N 3.36Å
699	Q	27.9	Very low	44.9	Very low	167 Å²	167	123.8 Å²	123.8	78%	0.78	69%	0.688	S	S	*	*			trans	-83.6	113.9	-166.8	-71	163.1	-42.2	0	0	112.9
700	E	32	Very low	48.1	Very low	194 Å²	194	119.5 Å²	119.5	91%	0.907	65%	0.652	S	S	*	*			trans	-84	124.2	140	-69.7	-176.9	137.9	0	0	107.9	K698	K698-E700 PolarHBondContact O-N 3.36Å
701	Q	33	Very low	51.4	Low	155 Å²	155	116.2 Å²	116.2	72%	0.724	63%	0.632	S	S	*	*			trans	-135.7	114.8	169.8	-83.4	-168.5	-16.5	0	0	112.6
702	S	36.1	Very low	54.3	Low	106 Å²	106	116.5 Å²	116.5	74%	0.741	62%	0.619	S	S	*	*			trans	60.7	91.2	141.3	-160.8	0	0	0	0	119
703	V	44.7	Very low	57.4	Low	107 Å²	107	114.3 Å²	114.3	65%	0.648	60%	0.595	S	S	*	*			trans	-126.6	67.9	160.9	-169.6	0	0	0	0	110.2
704	T	50.6	Low	60.5	Low	106 Å²	106	111.7 Å²	111.7	65%	0.65	57%	0.565	S	S	*	*	S	Bend	trans	-137.3	0.8	-179.8	48.9	0	0	0	0	116.2
705	N	62.3	Low	63.4	Low	131 Å²	131	114.6 Å²	114.6	70%	0.701	56%	0.561	S	S	*	*			trans	-141.5	28.5	-174.8	-106	-30.7	0	0	0	116	K707	N705-K707 PolarHBondContact O-N 3.48Å
706	R	86.6	Confident	66.2	Low	142 Å²	142	110 Å²	110	54%	0.536	54%	0.542	S	S	.	.			trans	-68.8	130.7	168.3	-74.4	-175.7	179.3	-167.2	-0.6	110.5	R732 V733 M760	R706-R732 PolarHBondContact O-N 3.42Å; R706-R732 VanDerWaalsContact O-N 3.15Å; R706-V733 HydrophobicContact CB-CB 4.39Å; R706-V733 VanDerWaalsContact CB-O 3.27Å; R706-V733 WeakPolarHBondContact CB-O 3.07Å; R706-V733 PolarHBondContact O-N 3.45Å; R706-M760 HydrophobicContact CB-CE 4.01Å; R706-M760 HydrophobicContact CG-CE 4.33Å
707	K	94.1	Very high	68.4	Low	96 Å²	96	110.4 Å²	110.4	42%	0.417	55%	0.546	S	S	.	.			trans	-121.3	159.5	173.7	-68.8	-178.4	-179.9	179.4	0	109.5	N705 F730 L761	N705-K707 PolarHBondContact O-N 3.48Å; K707-F730 VanDerWaalsContact CA-O 3.24Å; K707-F730 WeakPolarHBondContact CA-O 3.45Å; K707-F730 WeakPolarHBondContact CB-O 3.42Å; K707-L761 HydrophobicContact CB-CB 4.03Å; K707-L761 HydrophobicContact CB-CD1 4.24Å; K707-L761 PolarHBondContact O-N 3.24Å
708	A	94.6	Very high	71	Confident	0 Å²	0	108.3 Å²	108.3	0%	0	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	161.1	172.8	0	0	0	0	0	109.9	I729 F730 V733 V758 E759 M760	A708-I729 CarbonylContact O-C 3.49Å; A708-I729 WeakPolarHBondContact O-CA 3.34Å; A708-F730 HydrophobicContact CB-CD2 4.35Å; A708-F730 PolarHBondContact N-O 3.33Å; A708-F730 VanDerWaalsContact N-O 3.16Å; A708-F730 PolarHBondContact O-N 3.24Å; A708-V733 HydrophobicContact CB-CG1 4.37Å; A708-V733 HydrophobicContact CB-CG2 3.97Å; A708-V758 HydrophobicContact CB-CB 3.96Å; A708-V758 HydrophobicContact CB-CG2 3.94Å; A708-E759 CarbonylContact C-O 3.57Å; A708-E759 VanDerWaalsContact CA-O 3.24Å; A708-E759 WeakPolarHBondContact CA-O 3.36Å; A708-M760 HydrophobicContact CB-SD 3.82Å
709	K	95.6	Very high	73.5	Confident	87 Å²	87	107.9 Å²	107.9	38%	0.378	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	130.9	-180	-175	-177.8	174.7	-171.5	0	110.8	V711 A728 I729 V758 E759 L761	K709-V711 PolarHBondContact O-N 3.48Å; K709-A728 CarbonylContact C-O 3.52Å; K709-A728 VanDerWaalsContact CA-O 3.28Å; K709-A728 WeakPolarHBondContact CA-O 3.23Å; K709-I729 HydrophobicContact CG-CG1 4.44Å; K709-V758 CarbonylContact O-C 3.52Å; K709-V758 WeakPolarHBondContact O-CA 3.27Å; K709-E759 PolarHBondContact N-O 2.74Å; K709-E759 PolarHBondContact O-N 3.06Å; K709-L761 HydrophobicContact CB-CD1 4.07Å; K709-L761 HydrophobicContact CB-CD2 3.96Å; K709-L761 HydrophobicContact CB-CG 4.03Å; K709-L761 HydrophobicContact CD-CD2 4.49Å
710	A	95.7	Very high	76.3	Confident	1 Å²	1	104.2 Å²	104.2	1%	0.008	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	124	174.5	0	0	0	0	0	111.6	F724 Q725 G727 A728 F730	A710-F724 HydrophobicContact CB-CD2 3.6Å; A710-F724 HydrophobicContact CB-CE2 3.82Å; A710-Q725 WeakPolarHBondContact CB-O 3.48Å; A710-G727 PolarHBondContact O-N 3.25Å; A710-A728 HydrophobicContact CB-CB 4.14Å; A710-A728 PolarHBondContact N-O 3.47Å; A710-F730 HydrophobicContact CB-CE2 4.01Å; A710-F730 HydrophobicContact CB-CZ 4.43Å
711	V	94.6	Very high	79.2	Confident	56 Å²	56	96.5 Å²	96.5	34%	0.339	49%	0.491	S	S	.	.	S	Bend	trans	-101.7	-20.2	170.8	-69.5	0	0	0	0	112.2	K709 Y757 E759	K709-V711 PolarHBondContact O-N 3.48Å; V711-Y757 VanDerWaalsContact CG2-O 3.28Å; V711-Y757 WeakPolarHBondContact CG2-O 3.34Å; V711-Y757 PolarHBondContact N-O 3.13Å; V711-E759 HydrophobicContact CG1-CB 3.92Å
712	Y	88	Confident	82	Confident	139 Å²	139	89.9 Å²	89.9	55%	0.545	46%	0.46	S	S	.	.	S	Bend	trans	-126.3	154	170.1	-59.6	-69.9	0	0	0	110.1	F724 Y757	Y712-F724 WeakPolarHBondContact O-CE2 3.46Å; Y712-Y757 AromaticContact CD2-CD2 4Å; Y712-Y757 HydrophobicContact CD2-CD2 4Å; Y712-Y757 HydrophobicContact CD2-CG 4.49Å; Y712-Y757 HydrophobicContact CG-CD2 4.46Å; Y712-Y757 PolarHBondContact N-O 2.77Å
713	P	93.4	Very high	84.7	Confident	65 Å²	65	88.4 Å²	88.4	42%	0.422	45%	0.45	S	S	.	.			trans	-79.7	155.7	173.5	34.7	-32.1	0	0	0	110.6	F724 V726	P713-F724 WeakPolarHBondContact CA-O 3.44Å; P713-V726 HydrophobicContact CB-CG2 4.26Å; P713-V726 HydrophobicContact CG-CG2 4.24Å
714	C	91.8	Very high	87.1	Confident	17 Å²	17	83.8 Å²	83.8	12%	0.115	42%	0.421	C	S	.	.	B	Isolated β-bridge	trans	-139.7	135.2	177.9	-162.6	0	0	0	0	110.1	S723 F724 Y757	C714-S723 CarbonylContact O-C 3.58Å; C714-S723 VanDerWaalsContact O-CA 3.31Å; C714-S723 WeakPolarHBondContact O-CA 3.39Å; C714-F724 HydrophobicContact CB-CD1 3.98Å; C714-F724 HydrophobicContact CB-CD2 4Å; C714-F724 HydrophobicContact CB-CE1 3.56Å; C714-F724 HydrophobicContact CB-CE2 3.6Å; C714-F724 HydrophobicContact CB-CG 4.19Å; C714-F724 HydrophobicContact CB-CZ 3.37Å; C714-F724 PolarHBondContact N-O 3.4Å; C714-F724 PolarHBondContact O-N 3.23Å; C714-Y757 HydrophobicContact CB-CD1 4.15Å; C714-Y757 HydrophobicContact CB-CE1 4.49Å
715	E	93.2	Very high	89.2	Confident	163 Å²	163	84.8 Å²	84.8	76%	0.762	42%	0.418	S	S	*	.			trans	-109.1	127.5	163.2	-66.7	-172.3	163.3	0	0	106.9
716	A	87.5	Confident	90.7	Very high	35 Å²	35	82.8 Å²	82.8	29%	0.289	41%	0.411	S	S	.	.			trans	-69.4	130.6	-178.3	0	0	0	0	0	111.4	E721 S723	A716-E721 HydrophobicContact CB-CB 3.66Å; A716-S723 WeakPolarHBondContact CB-OG 3.44Å; A716-S723 PolarHBondContact N-OG 2.92Å
717	E	78.3	Confident	90.9	Very high	172 Å²	172	77.6 Å²	77.6	80%	0.804	40%	0.401	S	S	*	.	S	Bend	trans	-88.9	-18.7	172.8	-62.6	-169.2	179.3	0	0	111.4	E721	E717-E721 PolarHBondContact N-OE2 2.96Å
718	H	82.8	Confident	90.9	Very high	121 Å²	121	74.1 Å²	74.1	56%	0.56	39%	0.391	S	S	*	.	S	Bend	trans	-132.7	152.2	-177.6	-63.6	-30.7	0	0	0	113.2	T720 E721	H718-T720 PolarHBondContact O-N 3.3Å; H718-E721 HydrophobicContact CB-CG 4.4Å; H718-E721 IonicContact CD2-OE1 2.78Å; H718-E721 PolarHBondContact N-OE2 3.33Å; H718-E721 PolarHBondContact O-N 3.39Å
719	E	81.1	Confident	90.9	Very high	205 Å²	205	78.6 Å²	78.6	96%	0.958	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-17.1	-178	-62.4	-172.4	163.4	0	0	114.2
720	T	87.4	Confident	91	Very high	90 Å²	90	74.5 Å²	74.5	55%	0.552	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.3	176.9	46.4	0	0	0	0	113.9	H718 G751 L752	H718-T720 PolarHBondContact O-N 3.3Å; T720-G751 CarbonylContact O-C 3.59Å; T720-G751 VanDerWaalsContact O-CA 3.27Å; T720-G751 WeakPolarHBondContact O-CA 3.43Å; T720-L752 PolarHBondContact O-N 3.49Å
721	E	92.1	Very high	90.9	Very high	33 Å²	33	76.4 Å²	76.4	15%	0.154	41%	0.409	C	S	.	.	B	Isolated β-bridge	trans	-99.2	156.4	-178.7	-67	166.6	-171.1	0	0	111.6	A716 E717 H718 W741 L752	A716-E721 HydrophobicContact CB-CB 3.66Å; E717-E721 PolarHBondContact N-OE2 2.96Å; H718-E721 HydrophobicContact CB-CG 4.4Å; H718-E721 IonicContact CD2-OE1 2.78Å; H718-E721 PolarHBondContact N-OE2 3.33Å; H718-E721 PolarHBondContact O-N 3.39Å; E721-W741 HydrophobicContact CG-CH2 4.06Å; E721-W741 HydrophobicContact CG-CZ3 4.02Å; E721-L752 HydrophobicContact CG-CB 4.26Å
722	L	91.1	Very high	90.7	Very high	16 Å²	16	81.3 Å²	81.3	8%	0.084	42%	0.422	C	S	.	.	P	Polyproline II helix	trans	-99.9	128	174.5	-63.9	178.4	0	0	0	111.3	F724 F730 L746 K749 L752 I753	L722-F724 HydrophobicContact CB-CD1 4.1Å; L722-F724 WeakPolarHBondContact O-CD1 3.36Å; L722-F724 VanDerWaalsContact O-CE1 3.25Å; L722-F724 WeakPolarHBondContact O-CE1 3.37Å; L722-F730 HydrophobicContact CD1-CD1 4.21Å; L722-F730 HydrophobicContact CD1-CE1 4.18Å; L722-L746 HydrophobicContact CD1-CB 4.03Å; L722-K749 HydrophobicContact CD2-CB 4.04Å; L722-L752 PolarHBondContact N-O 3.17Å; L722-I753 HydrophobicContact CD1-CD1 4.25Å; L722-I753 HydrophobicContact CD1-CG1 4Å
723	S	93.8	Very high	91	Very high	75 Å²	75	74.8 Å²	74.8	52%	0.524	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-81.3	134.6	163.4	-58.3	0	0	0	0	110.3	C714 A716	C714-S723 CarbonylContact O-C 3.58Å; C714-S723 VanDerWaalsContact O-CA 3.31Å; C714-S723 WeakPolarHBondContact O-CA 3.39Å; A716-S723 WeakPolarHBondContact CB-OG 3.44Å; A716-S723 PolarHBondContact N-OG 2.92Å
724	F	94.8	Very high	91	Very high	10 Å²	10	73.7 Å²	73.7	4%	0.044	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-158.5	160.2	-177.7	53.4	-98.7	0	0	0	113.4	A710 Y712 P713 C714 L722 A728 F730 L746 I753	A710-F724 HydrophobicContact CB-CD2 3.6Å; A710-F724 HydrophobicContact CB-CE2 3.82Å; Y712-F724 WeakPolarHBondContact O-CE2 3.46Å; P713-F724 WeakPolarHBondContact CA-O 3.44Å; C714-F724 HydrophobicContact CB-CD1 3.98Å; C714-F724 HydrophobicContact CB-CD2 4Å; C714-F724 HydrophobicContact CB-CE1 3.56Å; C714-F724 HydrophobicContact CB-CE2 3.6Å; C714-F724 HydrophobicContact CB-CG 4.19Å; C714-F724 HydrophobicContact CB-CZ 3.37Å; C714-F724 PolarHBondContact N-O 3.4Å; C714-F724 PolarHBondContact O-N 3.23Å; L722-F724 HydrophobicContact CB-CD1 4.1Å; L722-F724 WeakPolarHBondContact O-CD1 3.36Å; L722-F724 VanDerWaalsContact O-CE1 3.25Å; L722-F724 WeakPolarHBondContact O-CE1 3.37Å; F724-A728 HydrophobicContact CB-CB 4.04Å; F724-F730 HydrophobicContact CB-CE1 4.42Å; F724-F730 HydrophobicContact CB-CZ 4.04Å; F724-F730 AromaticContact CD1-CE1 3.77Å; F724-F730 HydrophobicContact CD1-CE1 3.77Å; F724-F730 AromaticContact CD1-CZ 3.49Å; F724-F730 HydrophobicContact CD1-CZ 3.49Å; F724-F730 VanDerWaalsContact CD1-CZ 3.49Å; F724-F730 AromaticContact CD2-CZ 3.8Å; F724-F730 HydrophobicContact CD2-CZ 3.8Å; F724-F730 HydrophobicContact CE1-CE1 4.15Å; F724-F730 AromaticContact CE1-CZ 3.75Å; F724-F730 HydrophobicContact CE1-CZ 3.75Å; F724-F730 HydrophobicContact CE2-CZ 4.02Å; F724-F730 HydrophobicContact CG-CE1 4.12Å; F724-F730 AromaticContact CG-CZ 3.52Å; F724-F730 HydrophobicContact CG-CZ 3.52Å; F724-F730 AromaticContact CZ-CZ 3.99Å; F724-F730 HydrophobicContact CZ-CZ 3.99Å; F724-L746 HydrophobicContact CB-CD2 3.71Å; F724-I753 HydrophobicContact CE1-CG2 3.97Å; F724-I753 HydrophobicContact CZ-CG2 3.91Å
725	Q	94.9	Very high	91	Very high	126 Å²	126	77.2 Å²	77.2	59%	0.589	41%	0.411	S	S	*	.			trans	-106.2	160.1	177	-66.1	-62.2	-29.2	0	0	111.6	A710 G727 A728	A710-Q725 WeakPolarHBondContact CB-O 3.48Å; Q725-G727 PolarHBondContact O-N 2.8Å; Q725-A728 VanDerWaalsContact O-CB 3.28Å; Q725-A728 WeakPolarHBondContact O-CB 3.41Å; Q725-A728 PolarHBondContact O-N 3.14Å; Q725-A728 VanDerWaalsContact O-N 3.08Å
726	V	94.3	Very high	90.9	Very high	89 Å²	89	71 Å²	71	54%	0.539	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	129.1	175.7	-176.8	0	0	0	0	110.1	P713	P713-V726 HydrophobicContact CB-CG2 4.26Å; P713-V726 HydrophobicContact CG-CG2 4.24Å
727	G	89.6	Confident	90.7	Very high	33 Å²	33	81.1 Å²	81.1	34%	0.34	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-7.6	-178.2	0	0	0	0	0	115.8	A710 Q725	A710-G727 PolarHBondContact O-N 3.25Å; Q725-G727 PolarHBondContact O-N 2.8Å
728	A	94.5	Very high	91	Very high	24 Å²	24	78 Å²	78	20%	0.198	40%	0.402	C	S	.	.			trans	-56.5	141.6	171.5	0	0	0	0	0	111.5	K709 A710 F724 Q725 F730 L746	K709-A728 CarbonylContact C-O 3.52Å; K709-A728 VanDerWaalsContact CA-O 3.28Å; K709-A728 WeakPolarHBondContact CA-O 3.23Å; A710-A728 HydrophobicContact CB-CB 4.14Å; A710-A728 PolarHBondContact N-O 3.47Å; F724-A728 HydrophobicContact CB-CB 4.04Å; Q725-A728 VanDerWaalsContact O-CB 3.28Å; Q725-A728 WeakPolarHBondContact O-CB 3.41Å; Q725-A728 PolarHBondContact O-N 3.14Å; Q725-A728 VanDerWaalsContact O-N 3.08Å; A728-F730 HydrophobicContact CB-CZ 4.48Å; A728-L746 HydrophobicContact CB-CD1 4.14Å; A728-L746 HydrophobicContact CB-CD2 4.26Å
729	I	95.6	Very high	91	Very high	94 Å²	94	78.4 Å²	78.4	48%	0.482	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.7	-178.2	-61.6	175.6	0	0	0	109.9	A708 K709 L746 L761	A708-I729 CarbonylContact O-C 3.49Å; A708-I729 WeakPolarHBondContact O-CA 3.34Å; K709-I729 HydrophobicContact CG-CG1 4.44Å; I729-L746 WeakPolarHBondContact O-CD1 3.48Å; I729-L761 HydrophobicContact CG1-CD1 4.41Å; I729-L761 HydrophobicContact CG2-CD1 4.01Å
730	F	95.9	Very high	91.3	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	145.4	176.5	-51.4	-87.4	0	0	0	110.5	K707 A708 A710 L722 F724 A728 V733 L746 I753 V758	K707-F730 VanDerWaalsContact CA-O 3.24Å; K707-F730 WeakPolarHBondContact CA-O 3.45Å; K707-F730 WeakPolarHBondContact CB-O 3.42Å; A708-F730 HydrophobicContact CB-CD2 4.35Å; A708-F730 PolarHBondContact N-O 3.33Å; A708-F730 VanDerWaalsContact N-O 3.16Å; A708-F730 PolarHBondContact O-N 3.24Å; A710-F730 HydrophobicContact CB-CE2 4.01Å; A710-F730 HydrophobicContact CB-CZ 4.43Å; L722-F730 HydrophobicContact CD1-CD1 4.21Å; L722-F730 HydrophobicContact CD1-CE1 4.18Å; F724-F730 HydrophobicContact CB-CE1 4.42Å; F724-F730 HydrophobicContact CB-CZ 4.04Å; F724-F730 AromaticContact CD1-CE1 3.77Å; F724-F730 HydrophobicContact CD1-CE1 3.77Å; F724-F730 AromaticContact CD1-CZ 3.49Å; F724-F730 HydrophobicContact CD1-CZ 3.49Å; F724-F730 VanDerWaalsContact CD1-CZ 3.49Å; F724-F730 AromaticContact CD2-CZ 3.8Å; F724-F730 HydrophobicContact CD2-CZ 3.8Å; F724-F730 HydrophobicContact CE1-CE1 4.15Å; F724-F730 AromaticContact CE1-CZ 3.75Å; F724-F730 HydrophobicContact CE1-CZ 3.75Å; F724-F730 HydrophobicContact CE2-CZ 4.02Å; F724-F730 HydrophobicContact CG-CE1 4.12Å; F724-F730 AromaticContact CG-CZ 3.52Å; F724-F730 HydrophobicContact CG-CZ 3.52Å; F724-F730 AromaticContact CZ-CZ 3.99Å; F724-F730 HydrophobicContact CZ-CZ 3.99Å; A728-F730 HydrophobicContact CB-CZ 4.48Å; F730-V733 HydrophobicContact CB-CG2 3.64Å; F730-L746 HydrophobicContact CD1-CB 3.84Å; F730-L746 HydrophobicContact CD1-CD1 4.45Å; F730-L746 HydrophobicContact CD1-CD2 4.44Å; F730-L746 HydrophobicContact CD1-CG 4.47Å; F730-L746 HydrophobicContact CE1-CB 4.02Å; F730-L746 HydrophobicContact CE1-CD2 3.85Å; F730-L746 HydrophobicContact CE1-CG 4.36Å; F730-L746 HydrophobicContact CZ-CD2 4.46Å; F730-I753 HydrophobicContact CB-CD1 4.04Å; F730-I753 HydrophobicContact CD1-CD1 3.29Å; F730-I753 HydrophobicContact CD1-CG1 3.95Å; F730-I753 HydrophobicContact CD2-CD1 4.33Å; F730-I753 HydrophobicContact CE1-CD1 3.76Å; F730-I753 HydrophobicContact CE1-CG1 3.88Å; F730-I753 HydrophobicContact CE1-CG2 4.41Å; F730-I753 HydrophobicContact CE2-CG2 4.33Å; F730-I753 HydrophobicContact CG-CD1 3.62Å; F730-I753 HydrophobicContact CZ-CD1 4.45Å; F730-I753 HydrophobicContact CZ-CG1 4.45Å; F730-I753 HydrophobicContact CZ-CG2 4.16Å; F730-V758 HydrophobicContact CD2-CG1 3.89Å; F730-V758 HydrophobicContact CE2-CG1 3.45Å; F730-V758 VanDerWaalsContact CE2-CG1 3.45Å; F730-V758 HydrophobicContact CZ-CG1 4.26Å
731	S	94.9	Very high	91.6	Very high	42 Å²	42	69.3 Å²	69.3	29%	0.294	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	162.2	175	66.9	0	0	0	0	111.3	V733 E745	S731-V733 PolarHBondContact O-N 3.03Å; S731-E745 PolarHBondContact N-O 3.12Å; S731-E745 PolarHBondContact O-N 3.08Å; S731-E745 PolarHBondContact OG-O 2.78Å
732	R	90.3	Very high	91.7	Very high	158 Å²	158	68.3 Å²	68.3	60%	0.596	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.5	37.2	-179.8	-59.5	177.4	174.5	147.9	-4.6	113.5	R706 T734 E745	R706-R732 PolarHBondContact O-N 3.42Å; R706-R732 VanDerWaalsContact O-N 3.15Å; R732-T734 PolarHBondContact O-N 3.41Å; R732-E745 WeakPolarHBondContact CD-OE2 3.41Å; R732-E745 IonicContact CZ-OE2 2.73Å; R732-E745 IonicContact NE-OE2 2.73Å; R732-E745 IonicContact NH1-OE1 2.73Å; R732-E745 PolarHBondContact NH1-OE1 2.94Å; R732-E745 IonicContact NH1-OE2 2.83Å; R732-E745 PolarHBondContact NH1-OE2 2.95Å
733	V	94.1	Very high	91.9	Very high	3 Å²	3	70.4 Å²	70.4	2%	0.018	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	121	-172.4	-174.7	0	0	0	0	111.1	R706 A708 F730 S731 L742 E743 M760	R706-V733 HydrophobicContact CB-CB 4.39Å; R706-V733 VanDerWaalsContact CB-O 3.27Å; R706-V733 WeakPolarHBondContact CB-O 3.07Å; R706-V733 PolarHBondContact O-N 3.45Å; A708-V733 HydrophobicContact CB-CG1 4.37Å; A708-V733 HydrophobicContact CB-CG2 3.97Å; F730-V733 HydrophobicContact CB-CG2 3.64Å; S731-V733 PolarHBondContact O-N 3.03Å; V733-L742 HydrophobicContact CG1-CB 4.03Å; V733-L742 HydrophobicContact CG1-CD1 3.84Å; V733-L742 HydrophobicContact CG1-CG 4.43Å; V733-E743 WeakPolarHBondContact CA-O 3.39Å; V733-M760 HydrophobicContact CB-CE 4.37Å; V733-M760 HydrophobicContact CG1-CE 4.26Å; V733-M760 HydrophobicContact CG1-SD 4.17Å
734	T	93.3	Very high	91.9	Very high	42 Å²	42	66.8 Å²	66.8	26%	0.258	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.4	179.6	49.1	0	0	0	0	111.3	R732 S736 E743	R732-T734 PolarHBondContact O-N 3.41Å; T734-S736 PolarHBondContact O-N 3.47Å; T734-E743 PolarHBondContact N-O 2.88Å; T734-E743 PolarHBondContact O-N 2.2Å
735	P	90.6	Very high	91.9	Very high	90 Å²	90	68.4 Å²	68.4	58%	0.584	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.2	136.9	171.9	-21.7	33.6	0	0	0	111.4
736	S	91.3	Very high	91.8	Very high	32 Å²	32	63.7 Å²	63.7	22%	0.224	34%	0.34	C	S	.	.			trans	-75.4	168.6	171.8	-171.3	0	0	0	0	111.3	T734 E738 W741 L752	T734-S736 PolarHBondContact O-N 3.47Å; S736-E738 PolarHBondContact OG-N 2.94Å; S736-W741 WeakPolarHBondContact CB-O 3.45Å; S736-W741 PolarHBondContact N-O 3.32Å; S736-L752 WeakPolarHBondContact OG-CD2 3.08Å
737	R	84.1	Confident	91.5	Very high	249 Å²	249	68.8 Å²	68.8	94%	0.94	36%	0.358	S	S	*	.	S	Bend	trans	-74.4	-18.2	163.6	-65.8	-177.1	178	-172.8	-0.4	112.2
738	E	84.1	Confident	91.3	Very high	107 Å²	107	70 Å²	70	50%	0.5	37%	0.371	S	S	.	.	S	Bend	trans	-91.6	121.2	178.3	-68.1	-180	-141.2	0	0	110.2	S736 G740 W741	S736-E738 PolarHBondContact OG-N 2.94Å; E738-G740 PolarHBondContact O-N 2.91Å; E738-W741 HydrophobicContact CB-CB 4.34Å; E738-W741 HydrophobicContact CB-CG 4.43Å; E738-W741 PolarHBondContact O-N 3.25Å
739	P	83.3	Confident	91.1	Very high	129 Å²	129	76.3 Å²	76.3	84%	0.838	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	133.2	-179	-24.8	34.6	0	0	0	112.6	W741	P739-W741 VanDerWaalsContact C-N 3.34Å
740	G	86.4	Confident	91	Very high	39 Å²	39	78.9 Å²	78.9	40%	0.402	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	5.2	-177.3	0	0	0	0	0	114.7	E738 E755	E738-G740 PolarHBondContact O-N 2.91Å; G740-E755 VanDerWaalsContact O-CB 3.27Å; G740-E755 WeakPolarHBondContact O-CB 3.35Å; G740-E755 PolarHBondContact O-N 2.8Å
741	W	93.8	Very high	90.9	Very high	65 Å²	65	79.1 Å²	79.1	25%	0.246	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	145.7	175.2	-65.6	88.2	0	0	0	112	E721 S736 E738 P739 L752 I753 P754	E721-W741 HydrophobicContact CG-CH2 4.06Å; E721-W741 HydrophobicContact CG-CZ3 4.02Å; S736-W741 WeakPolarHBondContact CB-O 3.45Å; S736-W741 PolarHBondContact N-O 3.32Å; E738-W741 HydrophobicContact CB-CB 4.34Å; E738-W741 HydrophobicContact CB-CG 4.43Å; E738-W741 PolarHBondContact O-N 3.25Å; P739-W741 VanDerWaalsContact C-N 3.34Å; W741-L752 HydrophobicContact CB-CD2 4.49Å; W741-L752 HydrophobicContact CD2-CB 4.49Å; W741-L752 HydrophobicContact CE3-CB 3.72Å; W741-L752 HydrophobicContact CZ3-CB 4.09Å; W741-I753 VanDerWaalsContact CE3-C 3.43Å; W741-P754 HydrophobicContact CE3-CB 4.45Å; W741-P754 HydrophobicContact CE3-CG 4.06Å; W741-P754 HydrophobicContact CH2-CG 3.93Å; W741-P754 HydrophobicContact CZ3-CB 4.41Å; W741-P754 HydrophobicContact CZ3-CG 3.58Å
742	L	94.2	Very high	90.9	Very high	12 Å²	12	78.1 Å²	78.1	6%	0.063	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	156.3	167.1	-58.1	177.2	0	0	0	108.8	V733 L752 I753 E755 V758 M760	V733-L742 HydrophobicContact CG1-CB 4.03Å; V733-L742 HydrophobicContact CG1-CD1 3.84Å; V733-L742 HydrophobicContact CG1-CG 4.43Å; L742-L752 CarbonylContact O-C 3.6Å; L742-L752 WeakPolarHBondContact O-CA 3.4Å; L742-I753 HydrophobicContact CB-CB 4.5Å; L742-I753 PolarHBondContact N-O 3.14Å; L742-I753 PolarHBondContact O-N 3.44Å; L742-E755 HydrophobicContact CD1-CB 4.42Å; L742-E755 HydrophobicContact CD1-CG 4.18Å; L742-E755 HydrophobicContact CD2-CB 4.5Å; L742-E755 HydrophobicContact CD2-CG 4.18Å; L742-E755 HydrophobicContact CG-CB 4Å; L742-E755 HydrophobicContact CG-CG 4.04Å; L742-V758 HydrophobicContact CD1-CG2 3.72Å; L742-M760 HydrophobicContact CD1-SD 4.13Å
743	E	95.3	Very high	91.1	Very high	59 Å²	59	70.6 Å²	70.6	28%	0.276	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	131.7	168.4	-166.2	-170.7	-175.8	0	0	108.3	V733 T734 R750 G751 L752	V733-E743 WeakPolarHBondContact CA-O 3.39Å; T734-E743 PolarHBondContact N-O 2.88Å; T734-E743 PolarHBondContact O-N 2.2Å; E743-R750 HydrophobicContact CG-CG 4.13Å; E743-R750 WeakPolarHBondContact OE1-CD 3.44Å; E743-R750 IonicContact OE1-CZ 2.77Å; E743-R750 IonicContact OE1-NE 2.65Å; E743-R750 PolarHBondContact OE1-NE 3.03Å; E743-R750 IonicContact OE1-NH1 2.66Å; E743-R750 IonicContact OE1-NH2 2.63Å; E743-R750 PolarHBondContact OE1-NH2 3.21Å; E743-R750 IonicContact OE2-CZ 2.77Å; E743-R750 VanDerWaalsContact OE2-CZ 3.31Å; E743-R750 IonicContact OE2-NE 3.58Å; E743-R750 IonicContact OE2-NH2 2.69Å; E743-R750 PolarHBondContact OE2-NH2 3.35Å; E743-G751 WeakPolarHBondContact CA-O 3.33Å; E743-L752 HydrophobicContact CB-CD2 4.44Å
744	G	94	Very high	91.2	Very high	0 Å²	0	71 Å²	71	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	174	-178.4	0	0	0	0	0	112.7	R750 G751	G744-R750 WeakPolarHBondContact O-CA 3.4Å; G744-G751 PolarHBondContact N-O 2.83Å; G744-G751 PolarHBondContact O-N 3.46Å
745	E	94.8	Very high	91.2	Very high	43 Å²	43	74 Å²	74	20%	0.201	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121	-176.2	-171	-179.3	148.1	0	0	111.2	S731 R732 K749	S731-E745 PolarHBondContact N-O 3.12Å; S731-E745 PolarHBondContact O-N 3.08Å; S731-E745 PolarHBondContact OG-O 2.78Å; R732-E745 WeakPolarHBondContact CD-OE2 3.41Å; R732-E745 IonicContact CZ-OE2 2.73Å; R732-E745 IonicContact NE-OE2 2.73Å; R732-E745 IonicContact NH1-OE1 2.73Å; R732-E745 PolarHBondContact NH1-OE1 2.94Å; R732-E745 IonicContact NH1-OE2 2.83Å; R732-E745 PolarHBondContact NH1-OE2 2.95Å; E745-K749 CarbonylContact C-O 3.58Å; E745-K749 VanDerWaalsContact CA-O 3.3Å; E745-K749 WeakPolarHBondContact CA-O 3.48Å
746	L	93.8	Very high	91.4	Very high	27 Å²	27	75.2 Å²	75.2	14%	0.141	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.9	175.3	-176.1	66.3	0	0	0	108.8	L722 F724 A728 I729 F730 G748 K749	L722-L746 HydrophobicContact CD1-CB 4.03Å; F724-L746 HydrophobicContact CB-CD2 3.71Å; A728-L746 HydrophobicContact CB-CD1 4.14Å; A728-L746 HydrophobicContact CB-CD2 4.26Å; I729-L746 WeakPolarHBondContact O-CD1 3.48Å; F730-L746 HydrophobicContact CD1-CB 3.84Å; F730-L746 HydrophobicContact CD1-CD1 4.45Å; F730-L746 HydrophobicContact CD1-CD2 4.44Å; F730-L746 HydrophobicContact CD1-CG 4.47Å; F730-L746 HydrophobicContact CE1-CB 4.02Å; F730-L746 HydrophobicContact CE1-CD2 3.85Å; F730-L746 HydrophobicContact CE1-CG 4.36Å; F730-L746 HydrophobicContact CZ-CD2 4.46Å; L746-G748 PolarHBondContact O-N 3.44Å; L746-K749 PolarHBondContact N-O 2.95Å; L746-K749 PolarHBondContact O-N 2.67Å
747	E	88.4	Confident	91.5	Very high	196 Å²	196	77.8 Å²	77.8	92%	0.916	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	32.7	179.2	-60.9	-175.8	172.2	0	0	114.4	K749	E747-K749 VanDerWaalsContact C-N 3.3Å; E747-K749 PolarHBondContact O-N 3.14Å
748	G	85.2	Confident	92	Very high	59 Å²	59	66.7 Å²	66.7	61%	0.608	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	1	-179.1	0	0	0	0	0	115.2	L746	L746-G748 PolarHBondContact O-N 3.44Å
749	K	89.3	Confident	92.5	Very high	156 Å²	156	67.3 Å²	67.3	68%	0.678	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	131.4	169.3	-68.5	-174.7	178	-177.5	0	110.2	L722 E745 L746 E747	L722-K749 HydrophobicContact CD2-CB 4.04Å; E745-K749 CarbonylContact C-O 3.58Å; E745-K749 VanDerWaalsContact CA-O 3.3Å; E745-K749 WeakPolarHBondContact CA-O 3.48Å; L746-K749 PolarHBondContact N-O 2.95Å; L746-K749 PolarHBondContact O-N 2.67Å; E747-K749 VanDerWaalsContact C-N 3.3Å; E747-K749 PolarHBondContact O-N 3.14Å
750	R	93.3	Very high	92.9	Very high	148 Å²	148	65.5 Å²	65.5	56%	0.558	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	136.2	173.5	-170.1	176.5	-174.1	-163.7	-7	109.8	E743 G744	E743-R750 HydrophobicContact CG-CG 4.13Å; E743-R750 WeakPolarHBondContact OE1-CD 3.44Å; E743-R750 IonicContact OE1-CZ 2.77Å; E743-R750 IonicContact OE1-NE 2.65Å; E743-R750 PolarHBondContact OE1-NE 3.03Å; E743-R750 IonicContact OE1-NH1 2.66Å; E743-R750 IonicContact OE1-NH2 2.63Å; E743-R750 PolarHBondContact OE1-NH2 3.21Å; E743-R750 IonicContact OE2-CZ 2.77Å; E743-R750 VanDerWaalsContact OE2-CZ 3.31Å; E743-R750 IonicContact OE2-NE 3.58Å; E743-R750 IonicContact OE2-NH2 2.69Å; E743-R750 PolarHBondContact OE2-NH2 3.35Å; G744-R750 WeakPolarHBondContact O-CA 3.4Å
751	G	93.8	Very high	92.8	Very high	6 Å²	6	70.3 Å²	70.3	6%	0.062	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	-176.8	177.6	0	0	0	0	0	112.7	T720 E743 G744	T720-G751 CarbonylContact O-C 3.59Å; T720-G751 VanDerWaalsContact O-CA 3.27Å; T720-G751 WeakPolarHBondContact O-CA 3.43Å; E743-G751 WeakPolarHBondContact CA-O 3.33Å; G744-G751 PolarHBondContact N-O 2.83Å; G744-G751 PolarHBondContact O-N 3.46Å
752	L	95.4	Very high	92.8	Very high	20 Å²	20	70.6 Å²	70.6	11%	0.105	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	143.6	-179.1	-64	177.5	0	0	0	111.9	T720 E721 L722 S736 W741 L742 E743	T720-L752 PolarHBondContact O-N 3.49Å; E721-L752 HydrophobicContact CG-CB 4.26Å; L722-L752 PolarHBondContact N-O 3.17Å; S736-L752 WeakPolarHBondContact OG-CD2 3.08Å; W741-L752 HydrophobicContact CB-CD2 4.49Å; W741-L752 HydrophobicContact CD2-CB 4.49Å; W741-L752 HydrophobicContact CE3-CB 3.72Å; W741-L752 HydrophobicContact CZ3-CB 4.09Å; L742-L752 CarbonylContact O-C 3.6Å; L742-L752 WeakPolarHBondContact O-CA 3.4Å; E743-L752 HydrophobicContact CB-CD2 4.44Å
753	I	95.4	Very high	92.7	Very high	0 Å²	0	73.6 Å²	73.6	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	126.3	-175.9	-56	159.2	0	0	0	107.2	L722 F724 F730 W741 L742 E755 V758	L722-I753 HydrophobicContact CD1-CD1 4.25Å; L722-I753 HydrophobicContact CD1-CG1 4Å; F724-I753 HydrophobicContact CE1-CG2 3.97Å; F724-I753 HydrophobicContact CZ-CG2 3.91Å; F730-I753 HydrophobicContact CB-CD1 4.04Å; F730-I753 HydrophobicContact CD1-CD1 3.29Å; F730-I753 HydrophobicContact CD1-CG1 3.95Å; F730-I753 HydrophobicContact CD2-CD1 4.33Å; F730-I753 HydrophobicContact CE1-CD1 3.76Å; F730-I753 HydrophobicContact CE1-CG1 3.88Å; F730-I753 HydrophobicContact CE1-CG2 4.41Å; F730-I753 HydrophobicContact CE2-CG2 4.33Å; F730-I753 HydrophobicContact CG-CD1 3.62Å; F730-I753 HydrophobicContact CZ-CD1 4.45Å; F730-I753 HydrophobicContact CZ-CG1 4.45Å; F730-I753 HydrophobicContact CZ-CG2 4.16Å; W741-I753 VanDerWaalsContact CE3-C 3.43Å; L742-I753 HydrophobicContact CB-CB 4.5Å; L742-I753 PolarHBondContact N-O 3.14Å; L742-I753 PolarHBondContact O-N 3.44Å; I753-E755 PolarHBondContact O-N 2.66Å; I753-V758 HydrophobicContact CG2-CG1 3.45Å; I753-V758 VanDerWaalsContact CG2-CG1 3.45Å; I753-V758 HydrophobicContact CG2-CG2 4.26Å
754	P	95.1	Very high	92.6	Very high	12 Å²	12	74.4 Å²	74.4	8%	0.078	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	127.1	176	-20.1	30.8	0	0	0	110.8	W741 N756 Y757	W741-P754 HydrophobicContact CE3-CB 4.45Å; W741-P754 HydrophobicContact CE3-CG 4.06Å; W741-P754 HydrophobicContact CH2-CG 3.93Å; W741-P754 HydrophobicContact CZ3-CB 4.41Å; W741-P754 HydrophobicContact CZ3-CG 3.58Å; P754-N756 WeakPolarHBondContact CB-OD1 3.37Å; P754-N756 PolarHBondContact O-N 3.07Å; P754-Y757 HydrophobicContact CB-CD1 4.13Å; P754-Y757 HydrophobicContact CB-CD2 4.34Å; P754-Y757 HydrophobicContact CB-CG 3.9Å; P754-Y757 HydrophobicContact CG-CD1 3.91Å; P754-Y757 HydrophobicContact CG-CE1 4.42Å; P754-Y757 HydrophobicContact CG-CG 4.19Å; P754-Y757 PolarHBondContact O-N 3.34Å
755	E	94.3	Very high	92.5	Very high	106 Å²	106	78.8 Å²	78.8	50%	0.495	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-61.8	-34.4	-174.5	-176.7	173.1	-154	0	0	111.9	G740 L742 I753 Y757	G740-E755 VanDerWaalsContact O-CB 3.27Å; G740-E755 WeakPolarHBondContact O-CB 3.35Å; G740-E755 PolarHBondContact O-N 2.8Å; L742-E755 HydrophobicContact CD1-CB 4.42Å; L742-E755 HydrophobicContact CD1-CG 4.18Å; L742-E755 HydrophobicContact CD2-CB 4.5Å; L742-E755 HydrophobicContact CD2-CG 4.18Å; L742-E755 HydrophobicContact CG-CB 4Å; L742-E755 HydrophobicContact CG-CG 4.04Å; I753-E755 PolarHBondContact O-N 2.66Å; E755-Y757 VanDerWaalsContact C-N 3.26Å; E755-Y757 PolarHBondContact O-N 3.16Å
756	N	94.1	Very high	92.3	Very high	115 Å²	115	81.1 Å²	81.1	62%	0.615	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-75.5	-7.4	176.1	65.7	-28.1	0	0	0	114.4	P754	P754-N756 WeakPolarHBondContact CB-OD1 3.37Å; P754-N756 PolarHBondContact O-N 3.07Å
757	Y	94.1	Very high	92.2	Very high	85 Å²	85	84.7 Å²	84.7	33%	0.333	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-98.4	-3.7	-179.3	-77.2	-163.8	0	0	0	113.5	V711 Y712 C714 P754 E755	V711-Y757 VanDerWaalsContact CG2-O 3.28Å; V711-Y757 WeakPolarHBondContact CG2-O 3.34Å; V711-Y757 PolarHBondContact N-O 3.13Å; Y712-Y757 AromaticContact CD2-CD2 4Å; Y712-Y757 HydrophobicContact CD2-CD2 4Å; Y712-Y757 HydrophobicContact CD2-CG 4.49Å; Y712-Y757 HydrophobicContact CG-CD2 4.46Å; Y712-Y757 PolarHBondContact N-O 2.77Å; C714-Y757 HydrophobicContact CB-CD1 4.15Å; C714-Y757 HydrophobicContact CB-CE1 4.49Å; P754-Y757 HydrophobicContact CB-CD1 4.13Å; P754-Y757 HydrophobicContact CB-CD2 4.34Å; P754-Y757 HydrophobicContact CB-CG 3.9Å; P754-Y757 HydrophobicContact CG-CD1 3.91Å; P754-Y757 HydrophobicContact CG-CE1 4.42Å; P754-Y757 HydrophobicContact CG-CG 4.19Å; P754-Y757 PolarHBondContact O-N 3.34Å; E755-Y757 VanDerWaalsContact C-N 3.26Å; E755-Y757 PolarHBondContact O-N 3.16Å
758	V	93.1	Very high	92.5	Very high	16 Å²	16	76.7 Å²	76.7	10%	0.097	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149	-179.5	-59.6	0	0	0	0	113	A708 K709 F730 L742 I753	A708-V758 HydrophobicContact CB-CB 3.96Å; A708-V758 HydrophobicContact CB-CG2 3.94Å; K709-V758 CarbonylContact O-C 3.52Å; K709-V758 WeakPolarHBondContact O-CA 3.27Å; F730-V758 HydrophobicContact CD2-CG1 3.89Å; F730-V758 HydrophobicContact CE2-CG1 3.45Å; F730-V758 VanDerWaalsContact CE2-CG1 3.45Å; F730-V758 HydrophobicContact CZ-CG1 4.26Å; L742-V758 HydrophobicContact CD1-CG2 3.72Å; I753-V758 HydrophobicContact CG2-CG1 3.45Å; I753-V758 VanDerWaalsContact CG2-CG1 3.45Å; I753-V758 HydrophobicContact CG2-CG2 4.26Å
759	E	94.9	Very high	93.1	Very high	120 Å²	120	78.1 Å²	78.1	56%	0.561	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	128.7	170	-174.8	175	-157.8	0	0	108.5	A708 K709 V711	A708-E759 CarbonylContact C-O 3.57Å; A708-E759 VanDerWaalsContact CA-O 3.24Å; A708-E759 WeakPolarHBondContact CA-O 3.36Å; K709-E759 PolarHBondContact N-O 2.74Å; K709-E759 PolarHBondContact O-N 3.06Å; V711-E759 HydrophobicContact CG1-CB 3.92Å
760	M	92.9	Very high	93.4	Very high	92 Å²	92	71.6 Å²	71.6	45%	0.453	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	137	177.6	-63.2	-62.9	-65	0	0	110.3	R706 A708 V733 L742	R706-M760 HydrophobicContact CB-CE 4.01Å; R706-M760 HydrophobicContact CG-CE 4.33Å; A708-M760 HydrophobicContact CB-SD 3.82Å; V733-M760 HydrophobicContact CB-CE 4.37Å; V733-M760 HydrophobicContact CG1-CE 4.26Å; V733-M760 HydrophobicContact CG1-SD 4.17Å; L742-M760 HydrophobicContact CD1-SD 4.13Å
761	L	84.2	Confident	93.4	Very high	139 Å²	139	64.6 Å²	64.6	73%	0.728	32%	0.321	S	S	*	.			trans	-102.6	0	-178.3	-64	-179.9	0	0	0	112.7	K707 K709 I729	K707-L761 HydrophobicContact CB-CB 4.03Å; K707-L761 HydrophobicContact CB-CD1 4.24Å; K707-L761 PolarHBondContact O-N 3.24Å; K709-L761 HydrophobicContact CB-CD1 4.07Å; K709-L761 HydrophobicContact CB-CD2 3.96Å; K709-L761 HydrophobicContact CB-CG 4.03Å; K709-L761 HydrophobicContact CD-CD2 4.49Å; I729-L761 HydrophobicContact CG1-CD1 4.41Å; I729-L761 HydrophobicContact CG2-CD1 4.01Å

Retrieved 761 of 761 residues in 2106.5 ms (Link to these results)

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