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Nuclear distribution protein nudE homolog 1

Required for centrosome duplication and formation and function of the mitotic spindle. Essential for the development of the cerebral cortex. May regulate the production of neurons by controlling the orientation of the mitotic spindle during division of cortical neuronal progenitors of the proliferative ventricular zone of the brain. Orientation of the division plane perpendicular to the layers of the cortex gives rise to two proliferative neuronal progenitors whereas parallel orientation of the division plane yields one proliferative neuronal progenitor and a postmitotic neuron. A premature shift towards a neuronal fate within the progenitor population may result in an overall reduction in the final number of neurons and an increase in the number of neurons in the deeper layers of the cortex. Acts as a RAB9A/B effector that tethers RAB9-associated late endosomes to the dynein motor for their retrograde transport to the trans-Golgi network¹.

AlphaFold DB , UniProt , Accession Q9NXR1, Species HUMAN (Homo sapiens, Human), Gene NDE1, Length 335 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.8	Very low	63.5	Low	225 Å²	225	117 Å²	117	100%	1.108	67%	0.669	S	S	*	*				0	111.9	0	-78.7	163.7	167.4	0	0	106.6
2	E	48.7	Very low	65.3	Low	167 Å²	167	119 Å²	119	78%	0.78	67%	0.668	S	S	*	*			cis	-149.7	118.3	-0.9	-60	177.6	131.6	0	0	109	K6	E2-K6 PolarHBondContact O-NZ 2.74Å
3	D	58.6	Low	66.8	Low	55 Å²	55	116.9 Å²	116.9	29%	0.294	65%	0.65	S	S	.	*			trans	-148.7	-19.8	-172	-140.2	15.2	0	0	0	116.1	G5 K6 Y17 L21	D3-G5 PolarHBondContact O-N 2.67Å; D3-K6 IonicContact OD1-NZ 3.31Å; D3-K6 PolarHBondContact OD1-NZ 2.82Å; D3-Y17 WeakPolarHBondContact OD1-CE1 3.27Å; D3-Y17 PolarHBondContact OD1-OH 3.32Å; D3-L21 WeakPolarHBondContact OD2-CD2 3.46Å
4	S	53.2	Low	68.1	Low	138 Å²	138	114.4 Å²	114.4	97%	0.965	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	37.5	-171.9	-45.1	0	0	0	0	115.1
5	G	61.5	Low	69.4	Low	68 Å²	68	110.7 Å²	110.7	70%	0.701	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.3	20.2	-171.8	0	0	0	0	0	117	D3	D3-G5 PolarHBondContact O-N 2.67Å
6	K	61.3	Low	70.5	Confident	97 Å²	97	108 Å²	108	42%	0.422	61%	0.605	S	S	.	*			trans	-90.9	127.3	172.5	-71.9	174.7	-177.5	111	0	110	E2 D3 F8 Y17	E2-K6 PolarHBondContact O-NZ 2.74Å; D3-K6 IonicContact OD1-NZ 3.31Å; D3-K6 PolarHBondContact OD1-NZ 2.82Å; K6-F8 HydrophobicContact CB-CE1 3.92Å; K6-F8 HydrophobicContact CB-CZ 3.84Å; K6-Y17 HydrophobicContact CD-CD1 4.2Å; K6-Y17 HydrophobicContact CD-CD2 4.01Å; K6-Y17 HydrophobicContact CD-CE1 3.68Å; K6-Y17 HydrophobicContact CD-CE2 3.5Å; K6-Y17 VanDerWaalsContact CD-CE2 3.5Å; K6-Y17 HydrophobicContact CD-CG 4.35Å; K6-Y17 PolarHBondContact NZ-OH 2.89Å
7	T	69.4	Low	71.6	Confident	133 Å²	133	104.4 Å²	104.4	82%	0.816	58%	0.58	S	S	*	*			trans	-111.5	124.1	176.8	52.1	0	0	0	0	108.7
8	F	76.2	Confident	72.7	Confident	58 Å²	58	105.4 Å²	105.4	25%	0.254	57%	0.574	S	S	.	*			trans	-98.5	142.8	-174.2	-48.1	-70.6	0	0	0	111.5	K6 E13 E14 Y17	K6-F8 HydrophobicContact CB-CE1 3.92Å; K6-F8 HydrophobicContact CB-CZ 3.84Å; F8-E13 HydrophobicContact CB-CB 4.36Å; F8-E13 HydrophobicContact CD1-CG 4.37Å; F8-E14 HydrophobicContact CB-CB 3.86Å; F8-E14 HydrophobicContact CD1-CB 4.13Å; F8-E14 HydrophobicContact CD2-CB 3.43Å; F8-E14 VanDerWaalsContact CD2-CB 3.43Å; F8-E14 HydrophobicContact CD2-CG 3.52Å; F8-E14 WeakPolarHBondContact CD2-OE2 3.09Å; F8-E14 HydrophobicContact CE2-CB 3.97Å; F8-E14 VanDerWaalsContact CE2-CD 3.42Å; F8-E14 HydrophobicContact CE2-CG 3.57Å; F8-E14 WeakPolarHBondContact CE2-OE1 3.45Å; F8-E14 HydrophobicContact CG-CB 3.52Å; F8-E14 HydrophobicContact CG-CG 4.1Å; F8-E14 HydrophobicContact CZ-CG 4.2Å; F8-Y17 AromaticContact CE1-CD1 3.6Å; F8-Y17 HydrophobicContact CE1-CD1 3.6Å; F8-Y17 AromaticContact CE1-CG 3.67Å; F8-Y17 HydrophobicContact CE1-CG 3.67Å; F8-Y17 AromaticContact CZ-CD1 3.55Å; F8-Y17 HydrophobicContact CZ-CD1 3.55Å; F8-Y17 HydrophobicContact CZ-CE1 4.34Å; F8-Y17 HydrophobicContact CZ-CG 4.13Å
9	S	74	Confident	73.7	Confident	111 Å²	111	106.7 Å²	106.7	78%	0.776	57%	0.573	S	S	*	*	S	Bend	trans	-83.2	-15.6	-179.3	-39.3	0	0	0	0	112.7	E13	S9-E13 WeakPolarHBondContact CA-OE2 3.45Å; S9-E13 WeakPolarHBondContact CB-OE2 3.43Å; S9-E13 PolarHBondContact N-OE2 3.31Å; S9-E13 PolarHBondContact OG-OE2 3.26Å
10	S	77.6	Confident	74.7	Confident	62 Å²	62	106.4 Å²	106.4	43%	0.434	57%	0.571	S	S	.	*	S	Bend	trans	-157.4	152.3	-177.8	176.6	0	0	0	0	109.3	E12 E13 E14	S10-E12 PolarHBondContact O-N 3.11Å; S10-E12 PolarHBondContact OG-N 2.97Å; S10-E13 PolarHBondContact O-N 3.18Å; S10-E14 PolarHBondContact O-N 2.93Å; S10-E14 VanDerWaalsContact O-N 3.11Å
11	E	80.3	Confident	75.5	Confident	173 Å²	173	102.6 Å²	102.6	81%	0.808	55%	0.551	S	S	*	*	H	α-helix	trans	-55.6	-29	168.1	-62.5	-179.4	168.9	0	0	111.6	A15	E11-A15 VanDerWaalsContact O-CB 3.27Å; E11-A15 WeakPolarHBondContact O-CB 3.48Å; E11-A15 PolarHBondContact O-N 3.49Å
12	E	84.9	Confident	78.2	Confident	141 Å²	141	94.7 Å²	94.7	66%	0.659	52%	0.521	S	S	*	.	H	α-helix	trans	-71.8	-32	175	-174.7	172.5	-157.2	0	0	112.8	S10 N16	S10-E12 PolarHBondContact O-N 3.11Å; S10-E12 PolarHBondContact OG-N 2.97Å; E12-N16 WeakPolarHBondContact O-CB 3.12Å; E12-N16 PolarHBondContact O-N 3.32Å; E12-N16 PolarHBondContact O-ND2 3.13Å
13	E	84.9	Confident	80.4	Confident	92 Å²	92	91.7 Å²	91.7	43%	0.43	51%	0.508	S	S	.	.	H	α-helix	trans	-73.5	-38.8	174.1	-172.2	175.7	-152.5	0	0	110.7	F8 S9 S10 N16 Y17	F8-E13 HydrophobicContact CB-CB 4.36Å; F8-E13 HydrophobicContact CD1-CG 4.37Å; S9-E13 WeakPolarHBondContact CA-OE2 3.45Å; S9-E13 WeakPolarHBondContact CB-OE2 3.43Å; S9-E13 PolarHBondContact N-OE2 3.31Å; S9-E13 PolarHBondContact OG-OE2 3.26Å; S10-E13 PolarHBondContact O-N 3.18Å; E13-N16 PolarHBondContact O-N 3.17Å; E13-Y17 WeakPolarHBondContact O-CB 3.38Å; E13-Y17 PolarHBondContact O-N 2.78Å
14	E	85.5	Confident	82.2	Confident	82 Å²	82	93.2 Å²	93.2	38%	0.383	52%	0.52	S	S	.	.	H	α-helix	trans	-61.7	-48.5	171.8	-178.2	152.3	-160	0	0	111.6	F8 S10 N16 Y17 W18	F8-E14 HydrophobicContact CB-CB 3.86Å; F8-E14 HydrophobicContact CD1-CB 4.13Å; F8-E14 HydrophobicContact CD2-CB 3.43Å; F8-E14 VanDerWaalsContact CD2-CB 3.43Å; F8-E14 HydrophobicContact CD2-CG 3.52Å; F8-E14 WeakPolarHBondContact CD2-OE2 3.09Å; F8-E14 HydrophobicContact CE2-CB 3.97Å; F8-E14 VanDerWaalsContact CE2-CD 3.42Å; F8-E14 HydrophobicContact CE2-CG 3.57Å; F8-E14 WeakPolarHBondContact CE2-OE1 3.45Å; F8-E14 HydrophobicContact CG-CB 3.52Å; F8-E14 HydrophobicContact CG-CG 4.1Å; F8-E14 HydrophobicContact CZ-CG 4.2Å; S10-E14 PolarHBondContact O-N 2.93Å; S10-E14 VanDerWaalsContact O-N 3.11Å; E14-N16 VanDerWaalsContact C-N 3.34Å; E14-N16 PolarHBondContact O-N 2.88Å; E14-Y17 PolarHBondContact O-N 2.89Å; E14-W18 VanDerWaalsContact O-CD1 3.24Å; E14-W18 PolarHBondContact O-N 2.94Å; E14-W18 PolarHBondContact OE1-NE1 2.84Å
15	A	86.7	Confident	84.2	Confident	59 Å²	59	93 Å²	93	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-40.4	179.1	0	0	0	0	0	112.4	E11 K19	E11-A15 VanDerWaalsContact O-CB 3.27Å; E11-A15 WeakPolarHBondContact O-CB 3.48Å; E11-A15 PolarHBondContact O-N 3.49Å; A15-K19 WeakPolarHBondContact O-CB 3.37Å; A15-K19 PolarHBondContact O-N 3.23Å; A15-K19 VanDerWaalsContact O-N 3.13Å
16	N	88.1	Confident	85.9	Confident	67 Å²	67	94.6 Å²	94.6	36%	0.358	49%	0.486	S	S	.	.	H	α-helix	trans	-69.4	-40.3	174.9	-76	-50.8	0	0	0	111.8	E12 E13 E14 K19 D20	E12-N16 WeakPolarHBondContact O-CB 3.12Å; E12-N16 PolarHBondContact O-N 3.32Å; E12-N16 PolarHBondContact O-ND2 3.13Å; E13-N16 PolarHBondContact O-N 3.17Å; E14-N16 VanDerWaalsContact C-N 3.34Å; E14-N16 PolarHBondContact O-N 2.88Å; N16-K19 PolarHBondContact O-N 3.42Å; N16-D20 PolarHBondContact O-N 3.02Å
17	Y	88.7	Confident	87.6	Confident	47 Å²	47	95 Å²	95	18%	0.184	49%	0.49	C	S	.	.	H	α-helix	trans	-61.3	-51	176.2	174.6	-104.3	0	0	0	112.5	D3 K6 F8 E13 E14 K19 D20 L21	D3-Y17 WeakPolarHBondContact OD1-CE1 3.27Å; D3-Y17 PolarHBondContact OD1-OH 3.32Å; K6-Y17 HydrophobicContact CD-CD1 4.2Å; K6-Y17 HydrophobicContact CD-CD2 4.01Å; K6-Y17 HydrophobicContact CD-CE1 3.68Å; K6-Y17 HydrophobicContact CD-CE2 3.5Å; K6-Y17 VanDerWaalsContact CD-CE2 3.5Å; K6-Y17 HydrophobicContact CD-CG 4.35Å; K6-Y17 PolarHBondContact NZ-OH 2.89Å; F8-Y17 AromaticContact CE1-CD1 3.6Å; F8-Y17 HydrophobicContact CE1-CD1 3.6Å; F8-Y17 AromaticContact CE1-CG 3.67Å; F8-Y17 HydrophobicContact CE1-CG 3.67Å; F8-Y17 AromaticContact CZ-CD1 3.55Å; F8-Y17 HydrophobicContact CZ-CD1 3.55Å; F8-Y17 HydrophobicContact CZ-CE1 4.34Å; F8-Y17 HydrophobicContact CZ-CG 4.13Å; E13-Y17 WeakPolarHBondContact O-CB 3.38Å; E13-Y17 PolarHBondContact O-N 2.78Å; E14-Y17 PolarHBondContact O-N 2.89Å; Y17-K19 PolarHBondContact O-N 2.56Å; Y17-D20 PolarHBondContact O-N 3.27Å; Y17-L21 HydrophobicContact CE1-CB 4.46Å; Y17-L21 HydrophobicContact CE1-CD2 4.02Å; Y17-L21 HydrophobicContact CE2-CB 4.5Å; Y17-L21 WeakPolarHBondContact O-CB 3.32Å; Y17-L21 PolarHBondContact O-N 2.86Å
18	W	90.7	Very high	88.8	Confident	122 Å²	122	97.1 Å²	97.1	46%	0.462	48%	0.483	S	S	.	.	H	α-helix	trans	-63.8	-31.5	178.9	-73.9	115.9	0	0	0	112.3	E14 L21 A22	E14-W18 VanDerWaalsContact O-CD1 3.24Å; E14-W18 PolarHBondContact O-N 2.94Å; E14-W18 PolarHBondContact OE1-NE1 2.84Å; W18-L21 HydrophobicContact CE3-CD2 3.76Å; W18-L21 HydrophobicContact CZ3-CD2 3.61Å; W18-A22 WeakPolarHBondContact O-CB 3.31Å; W18-A22 PolarHBondContact O-N 2.87Å
19	K	93.1	Very high	89.8	Confident	130 Å²	130	96.9 Å²	96.9	57%	0.565	49%	0.492	S	S	*	.	H	α-helix	trans	-69	-45.8	174.8	176.9	-176.1	172.4	-166.1	0	112.2	A15 N16 Y17 A22 M23	A15-K19 WeakPolarHBondContact O-CB 3.37Å; A15-K19 PolarHBondContact O-N 3.23Å; A15-K19 VanDerWaalsContact O-N 3.13Å; N16-K19 PolarHBondContact O-N 3.42Å; Y17-K19 PolarHBondContact O-N 2.56Å; K19-A22 PolarHBondContact O-N 3.32Å; K19-M23 WeakPolarHBondContact O-CB 3.32Å; K19-M23 VanDerWaalsContact O-CG 3.31Å; K19-M23 WeakPolarHBondContact O-CG 3.37Å; K19-M23 PolarHBondContact O-N 2.85Å
20	D	92.4	Very high	90.9	Very high	101 Å²	101	95.2 Å²	95.2	54%	0.54	47%	0.472	S	S	.	.	H	α-helix	trans	-67.2	-38.8	176.1	-75.5	-9.2	0	0	0	111.2	N16 Y17 M23 T24	N16-D20 PolarHBondContact O-N 3.02Å; Y17-D20 PolarHBondContact O-N 3.27Å; D20-M23 PolarHBondContact O-N 3.27Å; D20-T24 WeakPolarHBondContact O-CG2 3.28Å; D20-T24 PolarHBondContact O-N 2.92Å; D20-T24 PolarHBondContact O-OG1 3.29Å
21	L	92.4	Very high	91.8	Very high	27 Å²	27	95.7 Å²	95.7	14%	0.141	47%	0.469	C	S	.	.	H	α-helix	trans	-62.9	-44.2	172.7	-172.3	67.7	0	0	0	111.5	D3 Y17 W18 M23 T24 Y25	D3-L21 WeakPolarHBondContact OD2-CD2 3.46Å; Y17-L21 HydrophobicContact CE1-CB 4.46Å; Y17-L21 HydrophobicContact CE1-CD2 4.02Å; Y17-L21 HydrophobicContact CE2-CB 4.5Å; Y17-L21 WeakPolarHBondContact O-CB 3.32Å; Y17-L21 PolarHBondContact O-N 2.86Å; W18-L21 HydrophobicContact CE3-CD2 3.76Å; W18-L21 HydrophobicContact CZ3-CD2 3.61Å; L21-M23 VanDerWaalsContact C-N 3.33Å; L21-M23 PolarHBondContact O-N 3.35Å; L21-T24 PolarHBondContact O-N 3.46Å; L21-T24 PolarHBondContact O-OG1 2.83Å; L21-Y25 HydrophobicContact CD1-CD2 4.08Å; L21-Y25 HydrophobicContact CD1-CE2 3.63Å; L21-Y25 HydrophobicContact CD2-CE2 4.03Å; L21-Y25 HydrophobicContact CG-CD2 3.84Å; L21-Y25 HydrophobicContact CG-CE2 3.62Å; L21-Y25 VanDerWaalsContact O-CD2 3.28Å; L21-Y25 WeakPolarHBondContact O-CD2 3.43Å; L21-Y25 PolarHBondContact O-N 2.9Å
22	A	94.4	Very high	92.6	Very high	58 Å²	58	90.7 Å²	90.7	48%	0.479	45%	0.451	S	S	.	.	H	α-helix	trans	-62.6	-39	174	0	0	0	0	0	112	W18 K19 K26	W18-A22 WeakPolarHBondContact O-CB 3.31Å; W18-A22 PolarHBondContact O-N 2.87Å; K19-A22 PolarHBondContact O-N 3.32Å; A22-K26 VanDerWaalsContact O-CB 3.24Å; A22-K26 WeakPolarHBondContact O-CB 3.43Å; A22-K26 PolarHBondContact O-N 2.86Å
23	M	95.2	Very high	93.2	Very high	105 Å²	105	89.8 Å²	89.8	52%	0.517	45%	0.447	S	S	.	.	H	α-helix	trans	-66	-40.1	174.9	-75.4	-64.1	-62.5	0	0	112.5	K19 D20 L21 K26 Q27	K19-M23 WeakPolarHBondContact O-CB 3.32Å; K19-M23 VanDerWaalsContact O-CG 3.31Å; K19-M23 WeakPolarHBondContact O-CG 3.37Å; K19-M23 PolarHBondContact O-N 2.85Å; D20-M23 PolarHBondContact O-N 3.27Å; L21-M23 VanDerWaalsContact C-N 3.33Å; L21-M23 PolarHBondContact O-N 3.35Å; M23-K26 PolarHBondContact O-N 2.95Å; M23-K26 HydrophobicContact SD-CD 4.44Å; M23-Q27 WeakPolarHBondContact O-CB 3.4Å; M23-Q27 PolarHBondContact O-N 2.94Å
24	T	94.9	Very high	93.8	Very high	87 Å²	87	90.1 Å²	90.1	53%	0.534	45%	0.448	S	S	.	.	H	α-helix	trans	-69.8	-38.9	175.9	56	0	0	0	0	112.5	D20 L21 R28	D20-T24 WeakPolarHBondContact O-CG2 3.28Å; D20-T24 PolarHBondContact O-N 2.92Å; D20-T24 PolarHBondContact O-OG1 3.29Å; L21-T24 PolarHBondContact O-N 3.46Å; L21-T24 PolarHBondContact O-OG1 2.83Å; T24-R28 WeakPolarHBondContact O-CB 3.21Å; T24-R28 PolarHBondContact O-N 2.87Å
25	Y	95.5	Very high	94.4	Very high	133 Å²	133	91.9 Å²	91.9	52%	0.522	46%	0.456	S	S	.	.	H	α-helix	trans	-65.7	-38.8	171.2	-80	-59	0	0	0	112.3	L21 R28 A29	L21-Y25 HydrophobicContact CD1-CD2 4.08Å; L21-Y25 HydrophobicContact CD1-CE2 3.63Å; L21-Y25 HydrophobicContact CD2-CE2 4.03Å; L21-Y25 HydrophobicContact CG-CD2 3.84Å; L21-Y25 HydrophobicContact CG-CE2 3.62Å; L21-Y25 VanDerWaalsContact O-CD2 3.28Å; L21-Y25 WeakPolarHBondContact O-CD2 3.43Å; L21-Y25 PolarHBondContact O-N 2.9Å; Y25-R28 PolarHBondContact O-N 3.11Å; Y25-A29 WeakPolarHBondContact O-CB 3.39Å; Y25-A29 PolarHBondContact O-N 3.43Å
26	K	96.7	Very high	94.9	Very high	101 Å²	101	93.6 Å²	93.6	44%	0.439	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-52.9	173.8	-174.2	-169.1	174.7	-91.7	0	110.9	A22 M23 R28 A29 E30	A22-K26 VanDerWaalsContact O-CB 3.24Å; A22-K26 WeakPolarHBondContact O-CB 3.43Å; A22-K26 PolarHBondContact O-N 2.86Å; M23-K26 PolarHBondContact O-N 2.95Å; M23-K26 HydrophobicContact SD-CD 4.44Å; K26-R28 VanDerWaalsContact C-N 3.29Å; K26-R28 PolarHBondContact O-N 2.85Å; K26-A29 WeakPolarHBondContact O-CB 3.44Å; K26-A29 PolarHBondContact O-N 2.86Å; K26-A29 VanDerWaalsContact O-N 3.1Å; K26-E30 WeakPolarHBondContact CE-OE1 3.24Å; K26-E30 HydrophobicContact CG-CG 4.49Å; K26-E30 IonicContact NZ-OE1 2.74Å; K26-E30 PolarHBondContact NZ-OE1 3.1Å; K26-E30 IonicContact NZ-OE2 2.66Å; K26-E30 PolarHBondContact NZ-OE2 2.74Å; K26-E30 WeakPolarHBondContact O-CG 3.46Å; K26-E30 PolarHBondContact O-N 3.4Å
27	Q	96.9	Very high	95.4	Very high	105 Å²	105	95.6 Å²	95.6	49%	0.491	46%	0.459	S	S	.	.	H	α-helix	trans	-58.8	-41.3	178.1	-172.8	66.7	67.4	0	0	111.2	M23 E30 N31	M23-Q27 WeakPolarHBondContact O-CB 3.4Å; M23-Q27 PolarHBondContact O-N 2.94Å; Q27-E30 PolarHBondContact O-N 2.9Å; Q27-N31 PolarHBondContact NE2-OD1 3.29Å; Q27-N31 WeakPolarHBondContact O-CB 3.4Å; Q27-N31 VanDerWaalsContact O-CG 3.31Å; Q27-N31 PolarHBondContact O-N 2.97Å; Q27-N31 PolarHBondContact O-OD1 3.08Å
28	R	96.4	Very high	95.8	Very high	178 Å²	178	99.6 Å²	99.6	67%	0.672	48%	0.48	S	S	*	.	H	α-helix	trans	-63.2	-42.2	175.5	-174.6	176	-178.9	174	1.8	112.2	T24 Y25 K26 T32	T24-R28 WeakPolarHBondContact O-CB 3.21Å; T24-R28 PolarHBondContact O-N 2.87Å; Y25-R28 PolarHBondContact O-N 3.11Å; K26-R28 VanDerWaalsContact C-N 3.29Å; K26-R28 PolarHBondContact O-N 2.85Å; R28-T32 WeakPolarHBondContact O-CG2 3.47Å; R28-T32 PolarHBondContact O-N 3.37Å; R28-T32 PolarHBondContact O-OG1 3.34Å; R28-T32 VanDerWaalsContact O-OG1 3.11Å
29	A	96.3	Very high	96.1	Very high	54 Å²	54	101 Å²	101	45%	0.446	49%	0.489	S	S	.	.	H	α-helix	trans	-63.3	-45.2	175.8	0	0	0	0	0	111.3	Y25 K26 T32 Q33	Y25-A29 WeakPolarHBondContact O-CB 3.39Å; Y25-A29 PolarHBondContact O-N 3.43Å; K26-A29 WeakPolarHBondContact O-CB 3.44Å; K26-A29 PolarHBondContact O-N 2.86Å; K26-A29 VanDerWaalsContact O-N 3.1Å; A29-T32 WeakPolarHBondContact CA-OG1 3.41Å; A29-T32 PolarHBondContact O-N 2.92Å; A29-T32 PolarHBondContact O-OG1 2.85Å; A29-Q33 WeakPolarHBondContact O-CB 3.37Å; A29-Q33 PolarHBondContact O-N 2.89Å
30	E	97.5	Very high	96.4	Very high	76 Å²	76	98.8 Å²	98.8	36%	0.355	48%	0.481	S	S	.	.	H	α-helix	trans	-60.6	-46.7	176.5	-71.2	174.5	139.3	0	0	111.3	K26 Q27 T32 Q33 E34	K26-E30 WeakPolarHBondContact CE-OE1 3.24Å; K26-E30 HydrophobicContact CG-CG 4.49Å; K26-E30 IonicContact NZ-OE1 2.74Å; K26-E30 PolarHBondContact NZ-OE1 3.1Å; K26-E30 IonicContact NZ-OE2 2.66Å; K26-E30 PolarHBondContact NZ-OE2 2.74Å; K26-E30 WeakPolarHBondContact O-CG 3.46Å; K26-E30 PolarHBondContact O-N 3.4Å; Q27-E30 PolarHBondContact O-N 2.9Å; E30-T32 PolarHBondContact O-N 3.16Å; E30-Q33 WeakPolarHBondContact O-CB 3.32Å; E30-Q33 PolarHBondContact O-N 3.49Å; E30-Q33 VanDerWaalsContact O-N 3.16Å; E30-E34 PolarHBondContact O-N 3.28Å
31	N	97.1	Very high	96.7	Very high	72 Å²	72	98.4 Å²	98.4	39%	0.385	48%	0.476	S	S	.	.	H	α-helix	trans	-57.6	-49	172.9	-74.2	34.9	0	0	0	111.9	Q27 Q33 E34 E35	Q27-N31 PolarHBondContact NE2-OD1 3.29Å; Q27-N31 WeakPolarHBondContact O-CB 3.4Å; Q27-N31 VanDerWaalsContact O-CG 3.31Å; Q27-N31 PolarHBondContact O-N 2.97Å; Q27-N31 PolarHBondContact O-OD1 3.08Å; N31-Q33 PolarHBondContact O-N 2.64Å; N31-E34 WeakPolarHBondContact O-CB 3.46Å; N31-E34 PolarHBondContact O-N 2.85Å; N31-E34 VanDerWaalsContact O-N 3.08Å; N31-E35 WeakPolarHBondContact O-CG 3.48Å; N31-E35 PolarHBondContact O-N 3.12Å
32	T	96.7	Very high	96.9	Very high	68 Å²	68	98.8 Å²	98.8	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-67.2	-23.8	178.6	54.3	0	0	0	0	113.4	R28 A29 E30 L36	R28-T32 WeakPolarHBondContact O-CG2 3.47Å; R28-T32 PolarHBondContact O-N 3.37Å; R28-T32 PolarHBondContact O-OG1 3.34Å; R28-T32 VanDerWaalsContact O-OG1 3.11Å; A29-T32 WeakPolarHBondContact CA-OG1 3.41Å; A29-T32 PolarHBondContact O-N 2.92Å; A29-T32 PolarHBondContact O-OG1 2.85Å; E30-T32 PolarHBondContact O-N 3.16Å; T32-L36 WeakPolarHBondContact O-CB 3.46Å; T32-L36 PolarHBondContact O-N 3.36Å; T32-L36 VanDerWaalsContact O-N 3.12Å
33	Q	97.5	Very high	97.1	Very high	122 Å²	122	98 Å²	98	57%	0.57	48%	0.478	S	S	*	.	H	α-helix	trans	-77	-30.7	172.8	-174.9	179.6	0.4	0	0	111.6	A29 E30 N31 R37	A29-Q33 WeakPolarHBondContact O-CB 3.37Å; A29-Q33 PolarHBondContact O-N 2.89Å; E30-Q33 WeakPolarHBondContact O-CB 3.32Å; E30-Q33 PolarHBondContact O-N 3.49Å; E30-Q33 VanDerWaalsContact O-N 3.16Å; N31-Q33 PolarHBondContact O-N 2.64Å; Q33-R37 WeakPolarHBondContact O-CB 3.42Å; Q33-R37 PolarHBondContact O-N 2.99Å; Q33-R37 VanDerWaalsContact O-N 3.11Å
34	E	97.2	Very high	97.2	Very high	98 Å²	98	99.5 Å²	99.5	46%	0.458	48%	0.477	S	S	.	.	H	α-helix	trans	-73.2	-50.8	172.8	-168.6	148.8	-111.8	0	0	111.1	E30 N31 L36 R37 E38	E30-E34 PolarHBondContact O-N 3.28Å; N31-E34 WeakPolarHBondContact O-CB 3.46Å; N31-E34 PolarHBondContact O-N 2.85Å; N31-E34 VanDerWaalsContact O-N 3.08Å; E34-L36 VanDerWaalsContact C-N 3.27Å; E34-L36 PolarHBondContact O-N 2.89Å; E34-R37 CarbonylContact O-C 3.58Å; E34-R37 WeakPolarHBondContact O-CA 3.42Å; E34-R37 WeakPolarHBondContact O-CB 3.37Å; E34-R37 PolarHBondContact O-N 2.86Å; E34-R37 IonicContact OE1-NH1 3.17Å; E34-E38 PolarHBondContact O-N 2.83Å
35	E	97.4	Very high	97.4	Very high	119 Å²	119	102 Å²	102	56%	0.556	48%	0.483	S	S	*	.	H	α-helix	trans	-52	-43.7	171.8	-70.5	169.4	-168.6	0	0	112	N31 F39	N31-E35 WeakPolarHBondContact O-CG 3.48Å; N31-E35 PolarHBondContact O-N 3.12Å; E35-F39 WeakPolarHBondContact O-CB 3.2Å; E35-F39 PolarHBondContact O-N 3.11Å
36	L	97.7	Very high	97.5	Very high	95 Å²	95	102.2 Å²	102.2	50%	0.497	48%	0.484	S	S	.	.	H	α-helix	trans	-68.9	-31.7	176.4	179.8	60.8	0	0	0	112.7	T32 E34 Q40	T32-L36 WeakPolarHBondContact O-CB 3.46Å; T32-L36 PolarHBondContact O-N 3.36Å; T32-L36 VanDerWaalsContact O-N 3.12Å; E34-L36 VanDerWaalsContact C-N 3.27Å; E34-L36 PolarHBondContact O-N 2.89Å; L36-Q40 HydrophobicContact CD1-CG 4.46Å; L36-Q40 WeakPolarHBondContact O-CB 3.47Å; L36-Q40 VanDerWaalsContact O-CG 3.24Å; L36-Q40 WeakPolarHBondContact O-CG 3.38Å; L36-Q40 PolarHBondContact O-N 2.97Å; L36-Q40 VanDerWaalsContact O-N 3.07Å
37	R	98	Very high	97.6	Very high	109 Å²	109	102.2 Å²	102.2	41%	0.411	49%	0.485	S	S	.	.	H	α-helix	trans	-70.9	-49.4	175.1	-172	-169	-55.4	131.8	7.8	110.4	Q33 E34 F39 Q40 E41	Q33-R37 WeakPolarHBondContact O-CB 3.42Å; Q33-R37 PolarHBondContact O-N 2.99Å; Q33-R37 VanDerWaalsContact O-N 3.11Å; E34-R37 CarbonylContact O-C 3.58Å; E34-R37 WeakPolarHBondContact O-CA 3.42Å; E34-R37 WeakPolarHBondContact O-CB 3.37Å; E34-R37 PolarHBondContact O-N 2.86Å; E34-R37 IonicContact OE1-NH1 3.17Å; R37-F39 VanDerWaalsContact C-N 3.28Å; R37-F39 PolarHBondContact O-N 3.25Å; R37-Q40 PolarHBondContact O-N 3.37Å; R37-Q40 VanDerWaalsContact O-N 3.08Å; R37-E41 WeakPolarHBondContact CD-OE1 3.21Å; R37-E41 HydrophobicContact CG-CG 4.4Å; R37-E41 WeakPolarHBondContact CG-OE1 3.4Å; R37-E41 WeakPolarHBondContact O-CB 3.34Å; R37-E41 WeakPolarHBondContact O-CG 3.24Å; R37-E41 PolarHBondContact O-N 2.85Å
38	E	97.6	Very high	97.6	Very high	131 Å²	131	99.4 Å²	99.4	61%	0.612	48%	0.48	S	S	*	.	H	α-helix	trans	-55.9	-43.9	175.9	-69.3	-176.7	165.6	0	0	111.1	E34 E41 G42	E34-E38 PolarHBondContact O-N 2.83Å; E38-E41 PolarHBondContact O-N 3.08Å; E38-G42 PolarHBondContact O-N 2.91Å
39	F	97.9	Very high	97.7	Very high	151 Å²	151	96.5 Å²	96.5	66%	0.662	47%	0.474	S	S	*	.	H	α-helix	trans	-64.1	-40.9	175.3	-174.6	-93.8	0	0	0	112.9	E35 R37 S43	E35-F39 WeakPolarHBondContact O-CB 3.2Å; E35-F39 PolarHBondContact O-N 3.11Å; R37-F39 VanDerWaalsContact C-N 3.28Å; R37-F39 PolarHBondContact O-N 3.25Å; F39-S43 WeakPolarHBondContact O-CB 3.43Å; F39-S43 PolarHBondContact O-N 3.07Å
40	Q	98.4	Very high	97.8	Very high	85 Å²	85	97.7 Å²	97.7	40%	0.397	47%	0.473	S	S	.	.	H	α-helix	trans	-68.9	-34.1	176.2	-76.9	177.4	26.4	0	0	113.1	L36 R37 R44	L36-Q40 HydrophobicContact CD1-CG 4.46Å; L36-Q40 WeakPolarHBondContact O-CB 3.47Å; L36-Q40 VanDerWaalsContact O-CG 3.24Å; L36-Q40 WeakPolarHBondContact O-CG 3.38Å; L36-Q40 PolarHBondContact O-N 2.97Å; L36-Q40 VanDerWaalsContact O-N 3.07Å; R37-Q40 PolarHBondContact O-N 3.37Å; R37-Q40 VanDerWaalsContact O-N 3.08Å; Q40-R44 VanDerWaalsContact O-CG 3.26Å; Q40-R44 WeakPolarHBondContact O-CG 3.39Å; Q40-R44 PolarHBondContact O-N 2.61Å
41	E	97.7	Very high	97.9	Very high	92 Å²	92	99.9 Å²	99.9	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-74.7	-46.5	178.3	-74.2	168.9	-173.5	0	0	110.2	R37 E38 S43 R44 E45	R37-E41 WeakPolarHBondContact CD-OE1 3.21Å; R37-E41 HydrophobicContact CG-CG 4.4Å; R37-E41 WeakPolarHBondContact CG-OE1 3.4Å; R37-E41 WeakPolarHBondContact O-CB 3.34Å; R37-E41 WeakPolarHBondContact O-CG 3.24Å; R37-E41 PolarHBondContact O-N 2.85Å; E38-E41 PolarHBondContact O-N 3.08Å; E41-S43 VanDerWaalsContact C-N 3.33Å; E41-S43 PolarHBondContact O-N 3.02Å; E41-R44 PolarHBondContact O-N 3.32Å; E41-R44 VanDerWaalsContact O-N 3.14Å; E41-E45 WeakPolarHBondContact O-CG 3.49Å; E41-E45 PolarHBondContact O-N 3.14Å
42	G	97.9	Very high	97.9	Very high	35 Å²	35	99.8 Å²	99.8	36%	0.361	49%	0.485	S	S	.	.	H	α-helix	trans	-61.8	-34.3	173.1	0	0	0	0	0	114.2	E38 Y46	E38-G42 PolarHBondContact O-N 2.91Å; G42-Y46 WeakPolarHBondContact O-CB 3.34Å; G42-Y46 PolarHBondContact O-N 3.39Å
43	S	97.8	Very high	98	Very high	43 Å²	43	101.2 Å²	101.2	30%	0.301	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-46	172.3	-160.8	0	0	0	0	111.2	F39 E41 E45 Y46 E47	F39-S43 WeakPolarHBondContact O-CB 3.43Å; F39-S43 PolarHBondContact O-N 3.07Å; E41-S43 VanDerWaalsContact C-N 3.33Å; E41-S43 PolarHBondContact O-N 3.02Å; S43-E45 PolarHBondContact O-N 2.81Å; S43-Y46 PolarHBondContact O-N 3.49Å; S43-E47 WeakPolarHBondContact CB-OE1 3.18Å; S43-E47 WeakPolarHBondContact O-CB 3.44Å; S43-E47 VanDerWaalsContact O-CD 3.31Å; S43-E47 WeakPolarHBondContact O-CG 3.26Å; S43-E47 PolarHBondContact O-N 2.94Å; S43-E47 PolarHBondContact OG-OE1 3.36Å
44	R	98.3	Very high	98	Very high	135 Å²	135	99.9 Å²	99.9	51%	0.509	48%	0.483	S	S	.	.	H	α-helix	trans	-63.9	-38.7	177.3	-69.8	169.2	-164	144	10.2	112.7	Q40 E41 A48	Q40-R44 VanDerWaalsContact O-CG 3.26Å; Q40-R44 WeakPolarHBondContact O-CG 3.39Å; Q40-R44 PolarHBondContact O-N 2.61Å; E41-R44 PolarHBondContact O-N 3.32Å; E41-R44 VanDerWaalsContact O-N 3.14Å; R44-A48 WeakPolarHBondContact O-CB 3.39Å; R44-A48 PolarHBondContact O-N 2.9Å
45	E	98.1	Very high	98.1	Very high	141 Å²	141	100.7 Å²	100.7	66%	0.659	49%	0.487	S	S	*	.	H	α-helix	trans	-64.2	-46.2	175.8	-71.7	-176	161.1	0	0	110.9	E41 S43 A48 E49	E41-E45 WeakPolarHBondContact O-CG 3.49Å; E41-E45 PolarHBondContact O-N 3.14Å; S43-E45 PolarHBondContact O-N 2.81Å; E45-A48 PolarHBondContact O-N 3.26Å; E45-E49 PolarHBondContact O-N 2.99Å
46	Y	98.1	Very high	98.2	Very high	137 Å²	137	101 Å²	101	54%	0.537	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-38.6	176.1	-177.7	-109.5	0	0	0	113.2	G42 S43 E49 L50	G42-Y46 WeakPolarHBondContact O-CB 3.34Å; G42-Y46 PolarHBondContact O-N 3.39Å; S43-Y46 PolarHBondContact O-N 3.49Å; Y46-E49 PolarHBondContact O-N 3.46Å; Y46-L50 HydrophobicContact CD1-CD1 4.03Å; Y46-L50 HydrophobicContact CE1-CD1 3.51Å; Y46-L50 HydrophobicContact CE1-CG 4.2Å; Y46-L50 HydrophobicContact CE2-CG 4.45Å; Y46-L50 WeakPolarHBondContact O-CG 3.33Å; Y46-L50 PolarHBondContact O-N 2.94Å
47	E	98.1	Very high	98.2	Very high	100 Å²	100	101.6 Å²	101.6	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-60.2	-45.8	171.9	-74.3	157.5	-136.4	0	0	110.8	S43 E49 L50 E51	S43-E47 WeakPolarHBondContact CB-OE1 3.18Å; S43-E47 WeakPolarHBondContact O-CB 3.44Å; S43-E47 VanDerWaalsContact O-CD 3.31Å; S43-E47 WeakPolarHBondContact O-CG 3.26Å; S43-E47 PolarHBondContact O-N 2.94Å; S43-E47 PolarHBondContact OG-OE1 3.36Å; E47-E49 PolarHBondContact O-N 3.22Å; E47-L50 PolarHBondContact O-N 3.49Å; E47-E51 WeakPolarHBondContact O-CG 3.32Å; E47-E51 PolarHBondContact O-N 3.27Å
48	A	98.4	Very high	98.2	Very high	46 Å²	46	101.9 Å²	101.9	38%	0.38	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-34.2	176.7	0	0	0	0	0	113.2	R44 E45 T52	R44-A48 WeakPolarHBondContact O-CB 3.39Å; R44-A48 PolarHBondContact O-N 2.9Å; E45-A48 PolarHBondContact O-N 3.26Å; A48-T52 VanDerWaalsContact O-CB 3.27Å; A48-T52 WeakPolarHBondContact O-CB 3.28Å; A48-T52 PolarHBondContact O-N 3.36Å; A48-T52 PolarHBondContact O-OG1 2.73Å
49	E	98.1	Very high	98.3	Very high	117 Å²	117	99.5 Å²	99.5	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-42.8	170.7	-75.7	-168.1	166.7	0	0	111.8	E45 Y46 E47 T52 Q53	E45-E49 PolarHBondContact O-N 2.99Å; Y46-E49 PolarHBondContact O-N 3.46Å; E47-E49 PolarHBondContact O-N 3.22Å; E49-T52 PolarHBondContact O-N 2.97Å; E49-Q53 VanDerWaalsContact O-CG 3.32Å; E49-Q53 WeakPolarHBondContact O-CG 3.49Å; E49-Q53 PolarHBondContact O-N 3.39Å; E49-Q53 PolarHBondContact O-NE2 3.36Å
50	L	98.5	Very high	98.3	Very high	79 Å²	79	100.9 Å²	100.9	41%	0.414	49%	0.492	S	S	.	.	H	α-helix	trans	-67.1	-42.6	176.9	-72.5	178.7	0	0	0	112.1	Y46 E47 T52 Q53 L54	Y46-L50 HydrophobicContact CD1-CD1 4.03Å; Y46-L50 HydrophobicContact CE1-CD1 3.51Å; Y46-L50 HydrophobicContact CE1-CG 4.2Å; Y46-L50 HydrophobicContact CE2-CG 4.45Å; Y46-L50 WeakPolarHBondContact O-CG 3.33Å; Y46-L50 PolarHBondContact O-N 2.94Å; E47-L50 PolarHBondContact O-N 3.49Å; L50-T52 VanDerWaalsContact C-N 3.32Å; L50-T52 PolarHBondContact O-N 2.87Å; L50-Q53 PolarHBondContact O-N 2.91Å; L50-L54 WeakPolarHBondContact O-CB 3.46Å; L50-L54 PolarHBondContact O-N 3.01Å
51	E	98.4	Very high	98.3	Very high	123 Å²	123	101.1 Å²	101.1	58%	0.575	50%	0.496	S	S	*	.	H	α-helix	trans	-60.3	-42.3	172.8	-74.4	-172.6	169.8	0	0	111.5	E47 L54 Q55	E47-E51 WeakPolarHBondContact O-CG 3.32Å; E47-E51 PolarHBondContact O-N 3.27Å; E51-L54 PolarHBondContact O-N 3.31Å; E51-Q55 WeakPolarHBondContact O-CB 3.27Å; E51-Q55 VanDerWaalsContact O-CG 3.28Å; E51-Q55 WeakPolarHBondContact O-CG 3.31Å; E51-Q55 PolarHBondContact O-N 3.47Å
52	T	98.4	Very high	98.3	Very high	70 Å²	70	105.8 Å²	105.8	43%	0.429	51%	0.51	S	S	.	.	H	α-helix	trans	-62.7	-42.8	176.7	-62.4	0	0	0	0	111.5	A48 E49 L50 Q56	A48-T52 VanDerWaalsContact O-CB 3.27Å; A48-T52 WeakPolarHBondContact O-CB 3.28Å; A48-T52 PolarHBondContact O-N 3.36Å; A48-T52 PolarHBondContact O-OG1 2.73Å; E49-T52 PolarHBondContact O-N 2.97Å; L50-T52 VanDerWaalsContact C-N 3.32Å; L50-T52 PolarHBondContact O-N 2.87Å; T52-Q56 VanDerWaalsContact O-CG 3.31Å; T52-Q56 WeakPolarHBondContact O-CG 3.31Å; T52-Q56 PolarHBondContact O-N 2.93Å; T52-Q56 VanDerWaalsContact O-N 3.12Å
53	Q	98.5	Very high	98.4	Very high	98 Å²	98	108.7 Å²	108.7	46%	0.458	52%	0.517	S	S	.	.	H	α-helix	trans	-66	-41.2	175.4	-73.3	174.7	59.3	0	0	112.1	E49 L50 Q56 I57	E49-Q53 VanDerWaalsContact O-CG 3.32Å; E49-Q53 WeakPolarHBondContact O-CG 3.49Å; E49-Q53 PolarHBondContact O-N 3.39Å; E49-Q53 PolarHBondContact O-NE2 3.36Å; L50-Q53 PolarHBondContact O-N 2.91Å; Q53-Q56 PolarHBondContact O-N 3.31Å; Q53-I57 VanDerWaalsContact O-CG1 3.31Å; Q53-I57 WeakPolarHBondContact O-CG1 3.25Å; Q53-I57 PolarHBondContact O-N 2.87Å
54	L	98.4	Very high	98.4	Very high	94 Å²	94	111.7 Å²	111.7	49%	0.492	53%	0.53	S	S	.	.	H	α-helix	trans	-60.7	-50.4	176.1	-179.5	62	0	0	0	111	L50 E51 Q56 I57 E58	L50-L54 WeakPolarHBondContact O-CB 3.46Å; L50-L54 PolarHBondContact O-N 3.01Å; E51-L54 PolarHBondContact O-N 3.31Å; L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 2.99Å; L54-I57 PolarHBondContact O-N 3.39Å; L54-I57 VanDerWaalsContact O-N 3.08Å; L54-E58 HydrophobicContact CD1-CG 4.15Å; L54-E58 HydrophobicContact CG-CG 4.36Å; L54-E58 WeakPolarHBondContact O-CB 3.39Å; L54-E58 WeakPolarHBondContact O-CG 3.4Å; L54-E58 PolarHBondContact O-N 3.12Å
55	Q	98.6	Very high	98.4	Very high	114 Å²	114	110 Å²	110	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-58.7	-38.5	177.8	-71.1	172.8	31.9	0	0	112.5	E51 T59	E51-Q55 WeakPolarHBondContact O-CB 3.27Å; E51-Q55 VanDerWaalsContact O-CG 3.28Å; E51-Q55 WeakPolarHBondContact O-CG 3.31Å; E51-Q55 PolarHBondContact O-N 3.47Å; Q55-T59 VanDerWaalsContact O-CB 3.3Å; Q55-T59 WeakPolarHBondContact O-CB 3.5Å; Q55-T59 PolarHBondContact O-N 2.95Å; Q55-T59 PolarHBondContact O-OG1 2.82Å
56	Q	98.5	Very high	98.4	Very high	127 Å²	127	107 Å²	107	59%	0.593	53%	0.525	S	S	*	.	H	α-helix	trans	-65.1	-42.4	174.4	-73.3	177	32.1	0	0	112.2	T52 Q53 L54 R60	T52-Q56 VanDerWaalsContact O-CG 3.31Å; T52-Q56 WeakPolarHBondContact O-CG 3.31Å; T52-Q56 PolarHBondContact O-N 2.93Å; T52-Q56 VanDerWaalsContact O-N 3.12Å; Q53-Q56 PolarHBondContact O-N 3.31Å; L54-Q56 VanDerWaalsContact C-N 3.3Å; L54-Q56 PolarHBondContact O-N 2.99Å; Q56-R60 WeakPolarHBondContact O-CB 3.35Å; Q56-R60 PolarHBondContact O-N 3.27Å
57	I	98.4	Very high	98.5	Very high	107 Å²	107	104.2 Å²	104.2	55%	0.549	52%	0.517	S	S	.	.	H	α-helix	trans	-68.2	-42.7	178.4	-69.5	166.8	0	0	0	111	Q53 L54 R60 N61	Q53-I57 VanDerWaalsContact O-CG1 3.31Å; Q53-I57 WeakPolarHBondContact O-CG1 3.25Å; Q53-I57 PolarHBondContact O-N 2.87Å; L54-I57 PolarHBondContact O-N 3.39Å; L54-I57 VanDerWaalsContact O-N 3.08Å; I57-R60 PolarHBondContact O-N 2.86Å; I57-N61 VanDerWaalsContact O-CB 3.28Å; I57-N61 WeakPolarHBondContact O-CB 3.41Å; I57-N61 PolarHBondContact O-N 3.02Å
58	E	98.6	Very high	98.5	Very high	115 Å²	115	102.8 Å²	102.8	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-43.9	176.3	-72.6	-176	158.8	0	0	112	L54 N61 R62	L54-E58 HydrophobicContact CD1-CG 4.15Å; L54-E58 HydrophobicContact CG-CG 4.36Å; L54-E58 WeakPolarHBondContact O-CB 3.39Å; L54-E58 WeakPolarHBondContact O-CG 3.4Å; L54-E58 PolarHBondContact O-N 3.12Å; E58-N61 PolarHBondContact O-N 2.93Å; E58-R62 WeakPolarHBondContact O-CB 3.32Å; E58-R62 PolarHBondContact O-N 3.08Å
59	T	98.6	Very high	98.5	Very high	80 Å²	80	104.7 Å²	104.7	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-49.2	174.4	-58	0	0	0	0	110.6	Q55 N61 R62 D63	Q55-T59 VanDerWaalsContact O-CB 3.3Å; Q55-T59 WeakPolarHBondContact O-CB 3.5Å; Q55-T59 PolarHBondContact O-N 2.95Å; Q55-T59 PolarHBondContact O-OG1 2.82Å; T59-N61 VanDerWaalsContact C-N 3.3Å; T59-N61 PolarHBondContact O-N 3.31Å; T59-R62 WeakPolarHBondContact O-CB 3.3Å; T59-R62 PolarHBondContact O-N 2.73Å; T59-D63 PolarHBondContact O-N 2.95Å
60	R	98.6	Very high	98.5	Very high	181 Å²	181	104 Å²	104	68%	0.683	51%	0.509	S	S	*	.	H	α-helix	trans	-61.2	-36.8	177.2	-172	-176.6	-176	109.6	2.8	112.6	Q56 I57 L64	Q56-R60 WeakPolarHBondContact O-CB 3.35Å; Q56-R60 PolarHBondContact O-N 3.27Å; I57-R60 PolarHBondContact O-N 2.86Å; R60-L64 HydrophobicContact CG-CD1 4.23Å; R60-L64 WeakPolarHBondContact O-CB 3.28Å; R60-L64 VanDerWaalsContact O-CG 3.25Å; R60-L64 WeakPolarHBondContact O-CG 3.35Å; R60-L64 PolarHBondContact O-N 2.88Å
61	N	98.4	Very high	98.5	Very high	90 Å²	90	104 Å²	104	48%	0.481	51%	0.508	S	S	.	.	H	α-helix	trans	-67.4	-46.6	176.5	-169	-30.6	0	0	0	110.7	I57 E58 T59 D63 L64 L65	I57-N61 VanDerWaalsContact O-CB 3.28Å; I57-N61 WeakPolarHBondContact O-CB 3.41Å; I57-N61 PolarHBondContact O-N 3.02Å; E58-N61 PolarHBondContact O-N 2.93Å; T59-N61 VanDerWaalsContact C-N 3.3Å; T59-N61 PolarHBondContact O-N 3.31Å; N61-D63 VanDerWaalsContact C-N 3.33Å; N61-D63 PolarHBondContact O-N 3.23Å; N61-L64 PolarHBondContact O-N 3.37Å; N61-L65 WeakPolarHBondContact O-CB 3.42Å; N61-L65 WeakPolarHBondContact O-CG 3.42Å; N61-L65 PolarHBondContact O-N 3.23Å; N61-L65 WeakPolarHBondContact OD1-CD1 3.24Å
62	R	98.6	Very high	98.6	Very high	190 Å²	190	105.5 Å²	105.5	72%	0.717	51%	0.509	S	S	*	.	H	α-helix	trans	-55.2	-45.3	173.3	175.8	-176.8	172.8	80.1	5.4	112.2	E58 T59 L65 S66	E58-R62 WeakPolarHBondContact O-CB 3.32Å; E58-R62 PolarHBondContact O-N 3.08Å; T59-R62 WeakPolarHBondContact O-CB 3.3Å; T59-R62 PolarHBondContact O-N 2.73Å; R62-L65 PolarHBondContact O-N 2.9Å; R62-S66 WeakPolarHBondContact O-CB 3.43Å; R62-S66 PolarHBondContact O-N 3.34Å
63	D	98.6	Very high	98.6	Very high	95 Å²	95	108.6 Å²	108.6	51%	0.508	52%	0.52	S	S	.	.	H	α-helix	trans	-65.2	-44.4	178.4	-68.3	-22	0	0	0	111.6	T59 N61 L65 S66 E67	T59-D63 PolarHBondContact O-N 2.95Å; N61-D63 VanDerWaalsContact C-N 3.33Å; N61-D63 PolarHBondContact O-N 3.23Å; D63-L65 VanDerWaalsContact C-N 3.33Å; D63-L65 PolarHBondContact O-N 3.26Å; D63-S66 WeakPolarHBondContact O-CB 3.46Å; D63-S66 PolarHBondContact O-N 2.88Å; D63-E67 WeakPolarHBondContact O-CB 3.4Å; D63-E67 PolarHBondContact O-N 3.44Å
64	L	98.6	Very high	98.6	Very high	107 Å²	107	107.9 Å²	107.9	56%	0.56	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-36	175.4	-74.1	169.3	0	0	0	112.8	R60 N61 N68	R60-L64 HydrophobicContact CG-CD1 4.23Å; R60-L64 WeakPolarHBondContact O-CB 3.28Å; R60-L64 VanDerWaalsContact O-CG 3.25Å; R60-L64 WeakPolarHBondContact O-CG 3.35Å; R60-L64 PolarHBondContact O-N 2.88Å; N61-L64 PolarHBondContact O-N 3.37Å; L64-N68 VanDerWaalsContact O-CB 3.24Å; L64-N68 WeakPolarHBondContact O-CB 3.33Å; L64-N68 PolarHBondContact O-N 2.86Å
65	L	98.7	Very high	98.6	Very high	98 Å²	98	108 Å²	108	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-69.2	-40.9	174.1	-72.6	172.2	0	0	0	111.8	N61 R62 D63 N68 N69	N61-L65 WeakPolarHBondContact O-CB 3.42Å; N61-L65 WeakPolarHBondContact O-CG 3.42Å; N61-L65 PolarHBondContact O-N 3.23Å; N61-L65 WeakPolarHBondContact OD1-CD1 3.24Å; R62-L65 PolarHBondContact O-N 2.9Å; D63-L65 VanDerWaalsContact C-N 3.33Å; D63-L65 PolarHBondContact O-N 3.26Å; L65-N68 PolarHBondContact O-N 3.06Å; L65-N69 WeakPolarHBondContact O-CB 3.5Å; L65-N69 VanDerWaalsContact O-CG 3.29Å; L65-N69 PolarHBondContact O-N 2.94Å; L65-N69 PolarHBondContact O-ND2 3.38Å; L65-N69 VanDerWaalsContact O-ND2 3.1Å
66	S	98.5	Very high	98.6	Very high	80 Å²	80	107.6 Å²	107.6	56%	0.559	52%	0.515	S	S	*	.	H	α-helix	trans	-59.4	-49.6	174	-169.1	0	0	0	0	111.1	R62 D63 N69 R70	R62-S66 WeakPolarHBondContact O-CB 3.43Å; R62-S66 PolarHBondContact O-N 3.34Å; D63-S66 WeakPolarHBondContact O-CB 3.46Å; D63-S66 PolarHBondContact O-N 2.88Å; S66-N69 PolarHBondContact O-N 2.8Å; S66-R70 PolarHBondContact O-N 2.74Å
67	E	98.7	Very high	98.6	Very high	78 Å²	78	104.2 Å²	104.2	36%	0.364	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-41.5	177.2	175.9	62.7	178.1	0	0	112.2	D63 N69 R70 L71	D63-E67 WeakPolarHBondContact O-CB 3.4Å; D63-E67 PolarHBondContact O-N 3.44Å; E67-N69 VanDerWaalsContact C-N 3.31Å; E67-N69 PolarHBondContact O-N 2.84Å; E67-R70 PolarHBondContact O-N 2.95Å; E67-R70 IonicContact OE1-CZ 3.61Å; E67-R70 IonicContact OE1-NE 3.71Å; E67-R70 IonicContact OE1-NH2 3.91Å; E67-R70 PolarHBondContact OE1-NH2 3.29Å; E67-R70 IonicContact OE2-CZ 2.76Å; E67-R70 VanDerWaalsContact OE2-CZ 3.31Å; E67-R70 IonicContact OE2-NE 2.67Å; E67-R70 PolarHBondContact OE2-NE 3.34Å; E67-R70 IonicContact OE2-NH2 2.64Å; E67-R70 PolarHBondContact OE2-NH2 2.95Å; E67-L71 HydrophobicContact CG-CD1 4.03Å; E67-L71 WeakPolarHBondContact O-CB 3.2Å; E67-L71 WeakPolarHBondContact O-CG 3.47Å; E67-L71 PolarHBondContact O-N 3.42Å
68	N	98.6	Very high	98.6	Very high	70 Å²	70	104.5 Å²	104.5	37%	0.374	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-36.1	176.9	-161.9	-105	0	0	0	112	L64 L65 R72	L64-N68 VanDerWaalsContact O-CB 3.24Å; L64-N68 WeakPolarHBondContact O-CB 3.33Å; L64-N68 PolarHBondContact O-N 2.86Å; L65-N68 PolarHBondContact O-N 3.06Å; N68-R72 VanDerWaalsContact O-CG 3.23Å; N68-R72 WeakPolarHBondContact O-CG 3.23Å; N68-R72 PolarHBondContact O-N 3.1Å; N68-R72 VanDerWaalsContact OD1-CZ 3.24Å; N68-R72 PolarHBondContact OD1-NE 2.72Å; N68-R72 PolarHBondContact OD1-NH2 3.48Å
69	N	98.6	Very high	98.6	Very high	86 Å²	86	103.2 Å²	103.2	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-69.2	-42.4	174.1	-72.1	-34.2	0	0	0	112	L65 S66 E67 L71 R72 M73	L65-N69 WeakPolarHBondContact O-CB 3.5Å; L65-N69 VanDerWaalsContact O-CG 3.29Å; L65-N69 PolarHBondContact O-N 2.94Å; L65-N69 PolarHBondContact O-ND2 3.38Å; L65-N69 VanDerWaalsContact O-ND2 3.1Å; S66-N69 PolarHBondContact O-N 2.8Å; E67-N69 VanDerWaalsContact C-N 3.31Å; E67-N69 PolarHBondContact O-N 2.84Å; N69-L71 PolarHBondContact O-N 3.41Å; N69-R72 PolarHBondContact O-N 2.99Å; N69-M73 WeakPolarHBondContact O-CG 3.47Å; N69-M73 PolarHBondContact O-N 3.27Å
70	R	98.7	Very high	98.6	Very high	103 Å²	103	105.6 Å²	105.6	39%	0.389	50%	0.503	S	S	.	.	H	α-helix	trans	-56.3	-50.9	173.2	-173.7	-172.9	69.4	79.8	4.1	111.3	S66 E67 R72 M73 E74	S66-R70 PolarHBondContact O-N 2.74Å; E67-R70 PolarHBondContact O-N 2.95Å; E67-R70 IonicContact OE1-CZ 3.61Å; E67-R70 IonicContact OE1-NE 3.71Å; E67-R70 IonicContact OE1-NH2 3.91Å; E67-R70 PolarHBondContact OE1-NH2 3.29Å; E67-R70 IonicContact OE2-CZ 2.76Å; E67-R70 VanDerWaalsContact OE2-CZ 3.31Å; E67-R70 IonicContact OE2-NE 2.67Å; E67-R70 PolarHBondContact OE2-NE 3.34Å; E67-R70 IonicContact OE2-NH2 2.64Å; E67-R70 PolarHBondContact OE2-NH2 2.95Å; R70-R72 VanDerWaalsContact C-N 3.33Å; R70-R72 PolarHBondContact O-N 2.92Å; R70-M73 PolarHBondContact O-N 3.49Å; R70-M73 VanDerWaalsContact O-N 3.16Å; R70-E74 WeakPolarHBondContact CG-OE1 3.23Å; R70-E74 IonicContact CZ-OE1 3.13Å; R70-E74 IonicContact CZ-OE2 2.69Å; R70-E74 IonicContact NH1-OE1 2.8Å; R70-E74 PolarHBondContact NH1-OE1 3.35Å; R70-E74 IonicContact NH1-OE2 3.17Å; R70-E74 PolarHBondContact NH1-OE2 3.41Å; R70-E74 PolarHBondContact O-N 2.76Å
71	L	98.6	Very high	98.6	Very high	78 Å²	78	103.3 Å²	103.3	41%	0.408	50%	0.498	S	S	.	.	H	α-helix	trans	-63.5	-34.5	179.4	-70.1	171.1	0	0	0	112.8	E67 N69 L75	E67-L71 HydrophobicContact CG-CD1 4.03Å; E67-L71 WeakPolarHBondContact O-CB 3.2Å; E67-L71 WeakPolarHBondContact O-CG 3.47Å; E67-L71 PolarHBondContact O-N 3.42Å; N69-L71 PolarHBondContact O-N 3.41Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 PolarHBondContact O-N 3.26Å
72	R	98.8	Very high	98.6	Very high	155 Å²	155	105.7 Å²	105.7	59%	0.585	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-44.7	171.7	-74.4	171.1	-163.1	-144.5	7.2	112.1	N68 N69 R70 L75 E76	N68-R72 VanDerWaalsContact O-CG 3.23Å; N68-R72 WeakPolarHBondContact O-CG 3.23Å; N68-R72 PolarHBondContact O-N 3.1Å; N68-R72 VanDerWaalsContact OD1-CZ 3.24Å; N68-R72 PolarHBondContact OD1-NE 2.72Å; N68-R72 PolarHBondContact OD1-NH2 3.48Å; N69-R72 PolarHBondContact O-N 2.99Å; R70-R72 VanDerWaalsContact C-N 3.33Å; R70-R72 PolarHBondContact O-N 2.92Å; R72-L75 PolarHBondContact O-N 2.96Å; R72-E76 PolarHBondContact O-N 3.39Å
73	M	98.6	Very high	98.6	Very high	134 Å²	134	102.7 Å²	102.7	66%	0.66	50%	0.498	S	S	*	.	H	α-helix	trans	-64.5	-40.5	178.5	-69.3	176.3	67.5	0	0	111.8	N69 R70 E76 T77	N69-M73 WeakPolarHBondContact O-CG 3.47Å; N69-M73 PolarHBondContact O-N 3.27Å; R70-M73 PolarHBondContact O-N 3.49Å; R70-M73 VanDerWaalsContact O-N 3.16Å; M73-E76 PolarHBondContact O-N 2.99Å; M73-T77 WeakPolarHBondContact O-CB 3.48Å; M73-T77 PolarHBondContact O-N 3.04Å; M73-T77 PolarHBondContact O-OG1 3.4Å
74	E	98.7	Very high	98.6	Very high	83 Å²	83	101.9 Å²	101.9	39%	0.388	50%	0.497	S	S	.	.	H	α-helix	trans	-66.5	-42.5	175.9	-75.1	171.3	-168.6	0	0	112.1	R70 E76 T77 I78	R70-E74 WeakPolarHBondContact CG-OE1 3.23Å; R70-E74 IonicContact CZ-OE1 3.13Å; R70-E74 IonicContact CZ-OE2 2.69Å; R70-E74 IonicContact NH1-OE1 2.8Å; R70-E74 PolarHBondContact NH1-OE1 3.35Å; R70-E74 IonicContact NH1-OE2 3.17Å; R70-E74 PolarHBondContact NH1-OE2 3.41Å; R70-E74 PolarHBondContact O-N 2.76Å; E74-E76 PolarHBondContact O-N 2.66Å; E74-T77 PolarHBondContact O-N 2.91Å; E74-I78 WeakPolarHBondContact O-CB 3.47Å; E74-I78 WeakPolarHBondContact O-CD1 3.42Å; E74-I78 VanDerWaalsContact O-CG1 3.23Å; E74-I78 WeakPolarHBondContact O-CG1 3.34Å; E74-I78 PolarHBondContact O-N 3.5Å
75	L	98.6	Very high	98.6	Very high	96 Å²	96	102.5 Å²	102.5	50%	0.503	50%	0.497	S	S	.	.	H	α-helix	trans	-59.1	-45.8	174.3	-177.2	158.9	0	0	0	111.6	L71 R72 I78 K79	L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 PolarHBondContact O-N 3.26Å; R72-L75 PolarHBondContact O-N 2.96Å; L75-I78 PolarHBondContact O-N 3.16Å; L75-K79 HydrophobicContact CD2-CD 4.23Å; L75-K79 HydrophobicContact CD2-CG 4.39Å; L75-K79 PolarHBondContact O-N 3.47Å
76	E	98.6	Very high	98.6	Very high	106 Å²	106	103.3 Å²	103.3	50%	0.495	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-41.4	178.3	-150.1	64.7	-161.1	0	0	111.8	R72 M73 E74 I78 K79 E80	R72-E76 PolarHBondContact O-N 3.39Å; M73-E76 PolarHBondContact O-N 2.99Å; E74-E76 PolarHBondContact O-N 2.66Å; E76-I78 PolarHBondContact O-N 3.18Å; E76-K79 VanDerWaalsContact CD-NZ 3.35Å; E76-K79 WeakPolarHBondContact O-CB 3.37Å; E76-K79 PolarHBondContact O-N 2.98Å; E76-K79 IonicContact OE1-NZ 2.72Å; E76-K79 PolarHBondContact OE1-NZ 2.72Å; E76-K79 IonicContact OE2-NZ 3.06Å; E76-K79 PolarHBondContact OE2-NZ 2.94Å; E76-E80 PolarHBondContact O-N 3.02Å
77	T	98.6	Very high	98.6	Very high	57 Å²	57	102.2 Å²	102.2	35%	0.35	49%	0.49	S	S	.	.	H	α-helix	trans	-60.1	-34.2	173.8	-57.8	0	0	0	0	112.1	M73 E74 K81	M73-T77 WeakPolarHBondContact O-CB 3.48Å; M73-T77 PolarHBondContact O-N 3.04Å; M73-T77 PolarHBondContact O-OG1 3.4Å; E74-T77 PolarHBondContact O-N 2.91Å; T77-K81 HydrophobicContact CG2-CD 4.24Å; T77-K81 WeakPolarHBondContact O-CB 3.38Å; T77-K81 WeakPolarHBondContact O-CD 3.45Å; T77-K81 VanDerWaalsContact O-CG 3.24Å; T77-K81 WeakPolarHBondContact O-CG 3.46Å; T77-K81 PolarHBondContact O-N 3.24Å
78	I	98.6	Very high	98.6	Very high	113 Å²	113	102.2 Å²	102.2	58%	0.579	49%	0.49	S	S	*	.	H	α-helix	trans	-74.5	-39.7	176.7	-71.6	164.6	0	0	0	111	E74 L75 E76 F82	E74-I78 WeakPolarHBondContact O-CB 3.47Å; E74-I78 WeakPolarHBondContact O-CD1 3.42Å; E74-I78 VanDerWaalsContact O-CG1 3.23Å; E74-I78 WeakPolarHBondContact O-CG1 3.34Å; E74-I78 PolarHBondContact O-N 3.5Å; L75-I78 PolarHBondContact O-N 3.16Å; E76-I78 PolarHBondContact O-N 3.18Å; I78-F82 WeakPolarHBondContact O-CB 3.27Å; I78-F82 PolarHBondContact O-N 3.42Å
79	K	98.7	Very high	98.6	Very high	88 Å²	88	100 Å²	100	38%	0.383	48%	0.484	S	S	.	.	H	α-helix	trans	-59.6	-51.7	172.1	-71.9	177.6	-175	158.4	0	111.7	L75 E76 K81 F82 E83	L75-K79 HydrophobicContact CD2-CD 4.23Å; L75-K79 HydrophobicContact CD2-CG 4.39Å; L75-K79 PolarHBondContact O-N 3.47Å; E76-K79 VanDerWaalsContact CD-NZ 3.35Å; E76-K79 WeakPolarHBondContact O-CB 3.37Å; E76-K79 PolarHBondContact O-N 2.98Å; E76-K79 IonicContact OE1-NZ 2.72Å; E76-K79 PolarHBondContact OE1-NZ 2.72Å; E76-K79 IonicContact OE2-NZ 3.06Å; E76-K79 PolarHBondContact OE2-NZ 2.94Å; K79-K81 VanDerWaalsContact C-N 3.29Å; K79-K81 PolarHBondContact O-N 3.27Å; K79-F82 CarbonylContact O-C 3.58Å; K79-F82 WeakPolarHBondContact O-CA 3.42Å; K79-F82 WeakPolarHBondContact O-CB 3.48Å; K79-F82 PolarHBondContact O-N 2.95Å; K79-E83 WeakPolarHBondContact O-CG 3.14Å; K79-E83 PolarHBondContact O-N 2.79Å
80	E	98.6	Very high	98.6	Very high	130 Å²	130	103.6 Å²	103.6	61%	0.607	49%	0.492	S	S	*	.	H	α-helix	trans	-55.6	-46.7	-178.6	-177.4	-175.6	-155.3	0	0	110.6	E76 F82 E83 V84	E76-E80 PolarHBondContact O-N 3.02Å; E80-F82 PolarHBondContact O-N 2.79Å; E80-E83 PolarHBondContact O-N 3.46Å; E80-V84 WeakPolarHBondContact O-CB 3.19Å; E80-V84 VanDerWaalsContact O-CG2 3.27Å; E80-V84 WeakPolarHBondContact O-CG2 3.43Å; E80-V84 PolarHBondContact O-N 2.67Å
81	K	98.7	Very high	98.6	Very high	132 Å²	132	107 Å²	107	57%	0.574	51%	0.505	S	S	*	.	H	α-helix	trans	-61.6	-41.2	175	-72.4	169.8	-175.2	173.2	0	112.7	T77 K79 Q85	T77-K81 HydrophobicContact CG2-CD 4.24Å; T77-K81 WeakPolarHBondContact O-CB 3.38Å; T77-K81 WeakPolarHBondContact O-CD 3.45Å; T77-K81 VanDerWaalsContact O-CG 3.24Å; T77-K81 WeakPolarHBondContact O-CG 3.46Å; T77-K81 PolarHBondContact O-N 3.24Å; K79-K81 VanDerWaalsContact C-N 3.29Å; K79-K81 PolarHBondContact O-N 3.27Å; K81-Q85 WeakPolarHBondContact O-CB 3.24Å; K81-Q85 VanDerWaalsContact O-CG 3.28Å; K81-Q85 WeakPolarHBondContact O-CG 3.45Å; K81-Q85 PolarHBondContact O-N 3.32Å
82	F	98.6	Very high	98.6	Very high	140 Å²	140	108.4 Å²	108.4	61%	0.614	51%	0.51	S	S	*	.	H	α-helix	trans	-65.4	-45.2	176.5	175.9	-94.4	0	0	0	111.9	I78 K79 E80 Q85 H86	I78-F82 WeakPolarHBondContact O-CB 3.27Å; I78-F82 PolarHBondContact O-N 3.42Å; K79-F82 CarbonylContact O-C 3.58Å; K79-F82 WeakPolarHBondContact O-CA 3.42Å; K79-F82 WeakPolarHBondContact O-CB 3.48Å; K79-F82 PolarHBondContact O-N 2.95Å; E80-F82 PolarHBondContact O-N 2.79Å; F82-Q85 PolarHBondContact O-N 3.4Å; F82-H86 WeakPolarHBondContact O-CB 3.43Å; F82-H86 PolarHBondContact O-N 3.37Å
83	E	98.7	Very high	98.6	Very high	127 Å²	127	105.7 Å²	105.7	59%	0.593	51%	0.506	S	S	*	.	H	α-helix	trans	-65.5	-42.8	179.1	-72	178.1	-165.5	0	0	111.6	K79 E80 H86 S87	K79-E83 WeakPolarHBondContact O-CG 3.14Å; K79-E83 PolarHBondContact O-N 2.79Å; E80-E83 PolarHBondContact O-N 3.46Å; E83-H86 PolarHBondContact O-N 3.3Å; E83-S87 WeakPolarHBondContact O-CB 3.37Å; E83-S87 PolarHBondContact O-N 3.17Å; E83-S87 PolarHBondContact O-OG 3.16Å
84	V	98.5	Very high	98.6	Very high	79 Å²	79	101.5 Å²	101.5	48%	0.479	49%	0.49	S	S	.	.	H	α-helix	trans	-59	-52.7	172.9	169.6	0	0	0	0	110.5	E80 H86 S87 E88	E80-V84 WeakPolarHBondContact O-CB 3.19Å; E80-V84 VanDerWaalsContact O-CG2 3.27Å; E80-V84 WeakPolarHBondContact O-CG2 3.43Å; E80-V84 PolarHBondContact O-N 2.67Å; V84-H86 PolarHBondContact O-N 3.03Å; V84-S87 PolarHBondContact O-N 3Å; V84-S87 PolarHBondContact O-OG 2.95Å; V84-E88 WeakPolarHBondContact O-CB 3.49Å; V84-E88 PolarHBondContact O-N 2.91Å
85	Q	98.3	Very high	98.6	Very high	119 Å²	119	99.9 Å²	99.9	56%	0.556	49%	0.49	S	S	*	.	H	α-helix	trans	-65.5	-35.3	-179.7	-71.8	-66.2	-85.2	0	0	113.3	K81 F82 E88 G89	K81-Q85 WeakPolarHBondContact O-CB 3.24Å; K81-Q85 VanDerWaalsContact O-CG 3.28Å; K81-Q85 WeakPolarHBondContact O-CG 3.45Å; K81-Q85 PolarHBondContact O-N 3.32Å; F82-Q85 PolarHBondContact O-N 3.4Å; Q85-E88 PolarHBondContact NE2-OE2 2.93Å; Q85-E88 PolarHBondContact O-N 3.27Å; Q85-G89 PolarHBondContact O-N 3.28Å
86	H	98.7	Very high	98.6	Very high	116 Å²	116	100.9 Å²	100.9	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-66.4	-41.9	173.4	-175.7	-81.5	0	0	0	111.3	F82 E83 V84 E88 Y90	F82-H86 WeakPolarHBondContact O-CB 3.43Å; F82-H86 PolarHBondContact O-N 3.37Å; E83-H86 PolarHBondContact O-N 3.3Å; V84-H86 PolarHBondContact O-N 3.03Å; H86-E88 VanDerWaalsContact C-N 3.34Å; H86-Y90 VanDerWaalsContact O-CB 3.29Å; H86-Y90 WeakPolarHBondContact O-CB 3.35Å; H86-Y90 PolarHBondContact O-N 3.44Å
87	S	98.5	Very high	98.6	Very high	57 Å²	57	101.7 Å²	101.7	40%	0.399	50%	0.5	S	S	.	.	H	α-helix	trans	-67	-34.4	176.5	80.4	0	0	0	0	112.8	E83 V84 R91	E83-S87 WeakPolarHBondContact O-CB 3.37Å; E83-S87 PolarHBondContact O-N 3.17Å; E83-S87 PolarHBondContact O-OG 3.16Å; V84-S87 PolarHBondContact O-N 3Å; V84-S87 PolarHBondContact O-OG 2.95Å; S87-R91 WeakPolarHBondContact O-CB 3.36Å; S87-R91 PolarHBondContact O-N 3.42Å
88	E	98.7	Very high	98.6	Very high	78 Å²	78	104.1 Å²	104.1	36%	0.364	51%	0.51	S	S	.	.	H	α-helix	trans	-70	-50.4	174.8	-173.3	-179.9	-175.7	0	0	110.8	V84 Q85 H86 Y90 R91 Q92	V84-E88 WeakPolarHBondContact O-CB 3.49Å; V84-E88 PolarHBondContact O-N 2.91Å; Q85-E88 PolarHBondContact NE2-OE2 2.93Å; Q85-E88 PolarHBondContact O-N 3.27Å; H86-E88 VanDerWaalsContact C-N 3.34Å; E88-Y90 VanDerWaalsContact C-N 3.34Å; E88-Y90 PolarHBondContact O-N 3.44Å; E88-R91 WeakPolarHBondContact O-CB 3.28Å; E88-R91 PolarHBondContact O-N 3.23Å; E88-R91 VanDerWaalsContact O-N 3.11Å; E88-Q92 WeakPolarHBondContact O-CG 3.47Å; E88-Q92 PolarHBondContact O-N 2.88Å; E88-Q92 PolarHBondContact OE1-NE2 2.79Å
89	G	98.7	Very high	98.6	Very high	24 Å²	24	103 Å²	103	25%	0.247	51%	0.505	C	S	.	.	H	α-helix	trans	-59	-42.5	177.1	0	0	0	0	0	112.7	Q85 R91 Q92 I93	Q85-G89 PolarHBondContact O-N 3.28Å; G89-R91 VanDerWaalsContact C-N 3.34Å; G89-R91 PolarHBondContact O-N 3.44Å; G89-Q92 PolarHBondContact O-N 2.89Å; G89-I93 VanDerWaalsContact O-CG1 3.28Å; G89-I93 WeakPolarHBondContact O-CG1 3.29Å; G89-I93 PolarHBondContact O-N 2.87Å
90	Y	98.6	Very high	98.6	Very high	161 Å²	161	103.2 Å²	103.2	63%	0.631	51%	0.51	S	S	*	.	H	α-helix	trans	-60.6	-41.9	174.4	-172.7	-84.9	0	0	0	112	H86 E88 I93 S94	H86-Y90 VanDerWaalsContact O-CB 3.29Å; H86-Y90 WeakPolarHBondContact O-CB 3.35Å; H86-Y90 PolarHBondContact O-N 3.44Å; E88-Y90 VanDerWaalsContact C-N 3.34Å; E88-Y90 PolarHBondContact O-N 3.44Å; Y90-I93 PolarHBondContact O-N 3.22Å; Y90-S94 WeakPolarHBondContact O-CB 3.48Å; Y90-S94 PolarHBondContact O-N 3.45Å
91	R	98.6	Very high	98.6	Very high	173 Å²	173	99.6 Å²	99.6	65%	0.653	50%	0.503	S	S	*	.	H	α-helix	trans	-66	-40.5	176.5	-168.8	-173.3	-57	150.1	7.6	112.1	S87 E88 G89 A95	S87-R91 WeakPolarHBondContact O-CB 3.36Å; S87-R91 PolarHBondContact O-N 3.42Å; E88-R91 WeakPolarHBondContact O-CB 3.28Å; E88-R91 PolarHBondContact O-N 3.23Å; E88-R91 VanDerWaalsContact O-N 3.11Å; G89-R91 VanDerWaalsContact C-N 3.34Å; G89-R91 PolarHBondContact O-N 3.44Å; R91-A95 WeakPolarHBondContact O-CB 3.28Å; R91-A95 PolarHBondContact O-N 2.8Å; R91-A95 VanDerWaalsContact O-N 3.1Å
92	Q	98.7	Very high	98.6	Very high	109 Å²	109	99.1 Å²	99.1	51%	0.509	50%	0.502	S	S	.	.	H	α-helix	trans	-64.6	-42.9	175.8	-69.4	177.3	12.9	0	0	111.5	E88 G89 A95 L96	E88-Q92 WeakPolarHBondContact O-CG 3.47Å; E88-Q92 PolarHBondContact O-N 2.88Å; E88-Q92 PolarHBondContact OE1-NE2 2.79Å; G89-Q92 PolarHBondContact O-N 2.89Å; Q92-A95 PolarHBondContact O-N 3.46Å; Q92-L96 VanDerWaalsContact O-CG 3.32Å; Q92-L96 WeakPolarHBondContact O-CG 3.46Å; Q92-L96 PolarHBondContact O-N 2.92Å; Q92-L96 VanDerWaalsContact O-N 3.08Å
93	I	98.6	Very high	98.6	Very high	98 Å²	98	96.6 Å²	96.6	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-50.9	176	-69.6	164.3	0	0	0	110.5	G89 Y90 A95 L96 E97	G89-I93 VanDerWaalsContact O-CG1 3.28Å; G89-I93 WeakPolarHBondContact O-CG1 3.29Å; G89-I93 PolarHBondContact O-N 2.87Å; Y90-I93 PolarHBondContact O-N 3.22Å; I93-A95 VanDerWaalsContact C-N 3.3Å; I93-A95 PolarHBondContact O-N 3Å; I93-L96 PolarHBondContact O-N 2.96Å; I93-L96 VanDerWaalsContact O-N 3.08Å; I93-E97 HydrophobicContact CG2-CG 4.31Å; I93-E97 WeakPolarHBondContact O-CG 3.34Å; I93-E97 PolarHBondContact O-N 3.44Å
94	S	98.6	Very high	98.6	Very high	46 Å²	46	95.8 Å²	95.8	32%	0.322	49%	0.493	S	S	.	.	H	α-helix	trans	-56.3	-43.1	179.1	-171.6	0	0	0	0	112.3	Y90 E97 D98	Y90-S94 WeakPolarHBondContact O-CB 3.48Å; Y90-S94 PolarHBondContact O-N 3.45Å; S94-E97 PolarHBondContact O-N 3.19Å; S94-D98 PolarHBondContact O-N 2.9Å
95	A	98.7	Very high	98.6	Very high	48 Å²	48	94.8 Å²	94.8	40%	0.397	49%	0.494	S	S	.	.	H	α-helix	trans	-64.9	-39.7	177.3	0	0	0	0	0	112.5	R91 Q92 I93 E97 D98 D99	R91-A95 WeakPolarHBondContact O-CB 3.28Å; R91-A95 PolarHBondContact O-N 2.8Å; R91-A95 VanDerWaalsContact O-N 3.1Å; Q92-A95 PolarHBondContact O-N 3.46Å; I93-A95 VanDerWaalsContact C-N 3.3Å; I93-A95 PolarHBondContact O-N 3Å; A95-E97 VanDerWaalsContact C-N 3.34Å; A95-D98 PolarHBondContact O-N 3.43Å; A95-D99 WeakPolarHBondContact O-CB 3.43Å; A95-D99 PolarHBondContact O-N 3.44Å
96	L	98.7	Very high	98.7	Very high	117 Å²	117	93.2 Å²	93.2	61%	0.613	49%	0.488	S	S	*	.	H	α-helix	trans	-69.8	-30.2	176	-70.2	170.5	0	0	0	112.7	Q92 I93 L100	Q92-L96 VanDerWaalsContact O-CG 3.32Å; Q92-L96 WeakPolarHBondContact O-CG 3.46Å; Q92-L96 PolarHBondContact O-N 2.92Å; Q92-L96 VanDerWaalsContact O-N 3.08Å; I93-L96 PolarHBondContact O-N 2.96Å; I93-L96 VanDerWaalsContact O-N 3.08Å; L96-L100 WeakPolarHBondContact O-CB 3.32Å; L96-L100 PolarHBondContact O-N 2.91Å
97	E	98.7	Very high	98.7	Very high	124 Å²	124	92.6 Å²	92.6	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-70	-41.5	172.9	-71.4	-178.4	140.2	0	0	111.6	I93 S94 A95 L100 A101	I93-E97 HydrophobicContact CG2-CG 4.31Å; I93-E97 WeakPolarHBondContact O-CG 3.34Å; I93-E97 PolarHBondContact O-N 3.44Å; S94-E97 PolarHBondContact O-N 3.19Å; A95-E97 VanDerWaalsContact C-N 3.34Å; E97-L100 PolarHBondContact O-N 2.87Å; E97-A101 WeakPolarHBondContact O-CB 3.33Å; E97-A101 PolarHBondContact O-N 3.22Å
98	D	98.7	Very high	98.7	Very high	107 Å²	107	93.7 Å²	93.7	57%	0.572	49%	0.485	S	S	*	.	H	α-helix	trans	-64.2	-47.6	173.3	-74.9	-35.8	0	0	0	112	S94 A95 L100 A101 Q102	S94-D98 PolarHBondContact O-N 2.9Å; A95-D98 PolarHBondContact O-N 3.43Å; D98-L100 VanDerWaalsContact C-N 3.3Å; D98-L100 PolarHBondContact O-N 2.96Å; D98-A101 WeakPolarHBondContact O-CB 3.4Å; D98-A101 PolarHBondContact O-N 3.23Å; D98-A101 VanDerWaalsContact O-N 3.15Å; D98-Q102 WeakPolarHBondContact O-CB 3.33Å; D98-Q102 PolarHBondContact O-N 3.47Å
99	D	98.7	Very high	98.7	Very high	90 Å²	90	96.9 Å²	96.9	48%	0.481	50%	0.5	S	S	.	.	H	α-helix	trans	-60.4	-39	175.6	-81.3	-15	0	0	0	111.7	A95 Q102 T103	A95-D99 WeakPolarHBondContact O-CB 3.43Å; A95-D99 PolarHBondContact O-N 3.44Å; D99-Q102 PolarHBondContact O-N 2.97Å; D99-T103 VanDerWaalsContact O-CB 3.27Å; D99-T103 WeakPolarHBondContact O-CB 3.4Å; D99-T103 PolarHBondContact O-N 3.3Å; D99-T103 PolarHBondContact O-OG1 2.85Å
100	L	98.7	Very high	98.7	Very high	92 Å²	92	100.3 Å²	100.3	48%	0.482	51%	0.512	S	S	.	.	H	α-helix	trans	-67.6	-37.6	175.7	179.6	63.8	0	0	0	111.8	L96 E97 D98 K104	L96-L100 WeakPolarHBondContact O-CB 3.32Å; L96-L100 PolarHBondContact O-N 2.91Å; E97-L100 PolarHBondContact O-N 2.87Å; D98-L100 VanDerWaalsContact C-N 3.3Å; D98-L100 PolarHBondContact O-N 2.96Å; L100-K104 HydrophobicContact CG-CD 4.4Å; L100-K104 WeakPolarHBondContact O-CD 3.13Å; L100-K104 VanDerWaalsContact O-CG 3.23Å; L100-K104 WeakPolarHBondContact O-CG 3.39Å; L100-K104 PolarHBondContact O-N 3.48Å; L100-K104 VanDerWaalsContact O-N 3.11Å
101	A	98.7	Very high	98.7	Very high	55 Å²	55	96.5 Å²	96.5	46%	0.455	50%	0.5	S	S	.	.	H	α-helix	trans	-67.4	-45.5	174.3	0	0	0	0	0	111.5	E97 D98 T103 K104 A105	E97-A101 WeakPolarHBondContact O-CB 3.33Å; E97-A101 PolarHBondContact O-N 3.22Å; D98-A101 WeakPolarHBondContact O-CB 3.4Å; D98-A101 PolarHBondContact O-N 3.23Å; D98-A101 VanDerWaalsContact O-N 3.15Å; A101-T103 PolarHBondContact O-N 2.94Å; A101-K104 PolarHBondContact O-N 3.24Å; A101-A105 PolarHBondContact O-N 2.95Å
102	Q	98.8	Very high	98.7	Very high	121 Å²	121	93.8 Å²	93.8	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-60.1	-46.3	175.3	-171.2	-172	100.7	0	0	111.3	D98 D99 K104 A105 I106	D98-Q102 WeakPolarHBondContact O-CB 3.33Å; D98-Q102 PolarHBondContact O-N 3.47Å; D99-Q102 PolarHBondContact O-N 2.97Å; Q102-K104 VanDerWaalsContact C-N 3.32Å; Q102-K104 PolarHBondContact O-N 3.27Å; Q102-A105 PolarHBondContact O-N 3.43Å; Q102-I106 HydrophobicContact CG-CD1 3.93Å; Q102-I106 WeakPolarHBondContact O-CG1 3.49Å; Q102-I106 PolarHBondContact O-N 3.08Å
103	T	98.6	Very high	98.7	Very high	87 Å²	87	94.9 Å²	94.9	53%	0.534	49%	0.493	S	S	.	.	H	α-helix	trans	-61.1	-39.6	178.8	-60.3	0	0	0	0	111.9	D99 A101 K107	D99-T103 VanDerWaalsContact O-CB 3.27Å; D99-T103 WeakPolarHBondContact O-CB 3.4Å; D99-T103 PolarHBondContact O-N 3.3Å; D99-T103 PolarHBondContact O-OG1 2.85Å; A101-T103 PolarHBondContact O-N 2.94Å; T103-K107 WeakPolarHBondContact O-CB 3.37Å; T103-K107 PolarHBondContact O-N 3.26Å
104	K	98.8	Very high	98.7	Very high	110 Å²	110	94.5 Å²	94.5	48%	0.478	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-46.4	173.6	-73.5	164.3	-176.5	167.3	0	111.6	L100 A101 Q102 I106 K107 D108	L100-K104 HydrophobicContact CG-CD 4.4Å; L100-K104 WeakPolarHBondContact O-CD 3.13Å; L100-K104 VanDerWaalsContact O-CG 3.23Å; L100-K104 WeakPolarHBondContact O-CG 3.39Å; L100-K104 PolarHBondContact O-N 3.48Å; L100-K104 VanDerWaalsContact O-N 3.11Å; A101-K104 PolarHBondContact O-N 3.24Å; Q102-K104 VanDerWaalsContact C-N 3.32Å; Q102-K104 PolarHBondContact O-N 3.27Å; K104-I106 PolarHBondContact O-N 2.69Å; K104-K107 WeakPolarHBondContact O-CB 3.45Å; K104-K107 PolarHBondContact O-N 2.77Å; K104-D108 VanDerWaalsContact O-CG 3.3Å; K104-D108 PolarHBondContact O-N 3.31Å
105	A	98.8	Very high	98.7	Very high	59 Å²	59	99.2 Å²	99.2	49%	0.488	50%	0.502	S	S	.	.	H	α-helix	trans	-60.7	-44.6	178.3	0	0	0	0	0	112.4	A101 Q102 D108 Q109	A101-A105 PolarHBondContact O-N 2.95Å; Q102-A105 PolarHBondContact O-N 3.43Å; A105-D108 PolarHBondContact O-N 2.9Å; A105-Q109 WeakPolarHBondContact O-CB 3.35Å; A105-Q109 PolarHBondContact O-N 3.41Å
106	I	98.8	Very high	98.7	Very high	85 Å²	85	101.1 Å²	101.1	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-46.2	175.7	-67.9	168.3	0	0	0	110.8	Q102 K104 D108 Q109 L110	Q102-I106 HydrophobicContact CG-CD1 3.93Å; Q102-I106 WeakPolarHBondContact O-CG1 3.49Å; Q102-I106 PolarHBondContact O-N 3.08Å; K104-I106 PolarHBondContact O-N 2.69Å; I106-D108 VanDerWaalsContact C-N 3.34Å; I106-D108 PolarHBondContact O-N 3.11Å; I106-Q109 PolarHBondContact O-N 3.47Å; I106-L110 HydrophobicContact CG2-CD1 4Å; I106-L110 HydrophobicContact CG2-CG 4.46Å; I106-L110 WeakPolarHBondContact O-CB 3.44Å; I106-L110 WeakPolarHBondContact O-CG 3.45Å; I106-L110 PolarHBondContact O-N 3.41Å
107	K	98.8	Very high	98.7	Very high	103 Å²	103	99.8 Å²	99.8	45%	0.448	50%	0.496	S	S	.	.	H	α-helix	trans	-56	-47.9	175.5	167.2	-172.5	157.3	-80.5	0	111.4	T103 K104 L110 Q111	T103-K107 WeakPolarHBondContact O-CB 3.37Å; T103-K107 PolarHBondContact O-N 3.26Å; K104-K107 WeakPolarHBondContact O-CB 3.45Å; K104-K107 PolarHBondContact O-N 2.77Å; K107-L110 PolarHBondContact O-N 3Å; K107-Q111 WeakPolarHBondContact O-CG 3.45Å; K107-Q111 PolarHBondContact O-N 3.3Å
108	D	98.7	Very high	98.7	Very high	80 Å²	80	99.3 Å²	99.3	43%	0.428	49%	0.494	S	S	.	.	H	α-helix	trans	-72.8	-31.9	-174.9	-65.2	-13.9	0	0	0	111.5	K104 A105 I106 Q111 K112	K104-D108 VanDerWaalsContact O-CG 3.3Å; K104-D108 PolarHBondContact O-N 3.31Å; A105-D108 PolarHBondContact O-N 2.9Å; I106-D108 VanDerWaalsContact C-N 3.34Å; I106-D108 PolarHBondContact O-N 3.11Å; D108-Q111 PolarHBondContact O-N 2.89Å; D108-K112 PolarHBondContact O-N 3Å
109	Q	98.8	Very high	98.7	Very high	145 Å²	145	100 Å²	100	68%	0.678	49%	0.493	S	S	*	.	H	α-helix	trans	-66.7	-41.2	169.2	-175.6	168.4	-7.4	0	0	112.4	A105 I106 Q111 K112 Y113	A105-Q109 WeakPolarHBondContact O-CB 3.35Å; A105-Q109 PolarHBondContact O-N 3.41Å; I106-Q109 PolarHBondContact O-N 3.47Å; Q109-Q111 VanDerWaalsContact C-N 3.35Å; Q109-K112 WeakPolarHBondContact O-CB 3.47Å; Q109-K112 PolarHBondContact O-N 3.08Å; Q109-Y113 PolarHBondContact O-N 3.3Å
110	L	98.7	Very high	98.7	Very high	96 Å²	96	98.3 Å²	98.3	50%	0.503	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-39	172.8	-72.2	171.1	0	0	0	111.7	I106 K107 K112 Y113 I114	I106-L110 HydrophobicContact CG2-CD1 4Å; I106-L110 HydrophobicContact CG2-CG 4.46Å; I106-L110 WeakPolarHBondContact O-CB 3.44Å; I106-L110 WeakPolarHBondContact O-CG 3.45Å; I106-L110 PolarHBondContact O-N 3.41Å; K107-L110 PolarHBondContact O-N 3Å; L110-K112 VanDerWaalsContact C-N 3.3Å; L110-K112 PolarHBondContact O-N 3.43Å; L110-Y113 PolarHBondContact O-N 2.93Å; L110-I114 VanDerWaalsContact O-CG1 3.29Å; L110-I114 WeakPolarHBondContact O-CG1 3.47Å; L110-I114 PolarHBondContact O-N 3.23Å
111	Q	98.8	Very high	98.7	Very high	81 Å²	81	98 Å²	98	38%	0.379	49%	0.491	S	S	.	.	H	α-helix	trans	-65.2	-30.6	173	-73.5	-169	-2.4	0	0	113.2	K107 D108 Q109 R115	K107-Q111 WeakPolarHBondContact O-CG 3.45Å; K107-Q111 PolarHBondContact O-N 3.3Å; D108-Q111 PolarHBondContact O-N 2.89Å; Q109-Q111 VanDerWaalsContact C-N 3.35Å; Q111-R115 WeakPolarHBondContact O-CG 3.46Å; Q111-R115 PolarHBondContact O-NH1 2.81Å
112	K	98.8	Very high	98.7	Very high	117 Å²	117	100.2 Å²	100.2	51%	0.509	50%	0.495	S	S	.	.	H	α-helix	trans	-69	-47.8	170.8	-176.9	174	179.6	-75.5	0	110.9	D108 Q109 L110 I114 R115 E116	D108-K112 PolarHBondContact O-N 3Å; Q109-K112 WeakPolarHBondContact O-CB 3.47Å; Q109-K112 PolarHBondContact O-N 3.08Å; L110-K112 VanDerWaalsContact C-N 3.3Å; L110-K112 PolarHBondContact O-N 3.43Å; K112-I114 VanDerWaalsContact C-N 3.34Å; K112-I114 PolarHBondContact O-N 2.82Å; K112-R115 PolarHBondContact O-N 2.99Å; K112-R115 VanDerWaalsContact O-N 3.14Å; K112-E116 IonicContact NZ-OE1 2.76Å; K112-E116 PolarHBondContact NZ-OE1 3.22Å; K112-E116 WeakPolarHBondContact O-CG 3.23Å; K112-E116 PolarHBondContact O-N 2.98Å; K112-E116 VanDerWaalsContact O-N 3.11Å
113	Y	98.8	Very high	98.7	Very high	131 Å²	131	97.3 Å²	97.3	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-35.8	-179.3	-174.9	-120.2	0	0	0	113.3	Q109 L110 R115 E116 L117	Q109-Y113 PolarHBondContact O-N 3.3Å; L110-Y113 PolarHBondContact O-N 2.93Å; Y113-R115 PolarHBondContact O-N 2.83Å; Y113-E116 PolarHBondContact O-N 3.1Å; Y113-L117 HydrophobicContact CD1-CD1 4Å; Y113-L117 HydrophobicContact CE1-CD1 3.6Å; Y113-L117 HydrophobicContact CE1-CG 4.26Å; Y113-L117 HydrophobicContact CE2-CD2 4.47Å; Y113-L117 HydrophobicContact CE2-CG 4.32Å; Y113-L117 WeakPolarHBondContact O-CG 3.43Å; Y113-L117 PolarHBondContact O-N 2.92Å
114	I	98.7	Very high	98.7	Very high	90 Å²	90	98.6 Å²	98.6	46%	0.462	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-45.6	172.5	-72.2	163.4	0	0	0	110.9	L110 K112 E116 L117 E118	L110-I114 VanDerWaalsContact O-CG1 3.29Å; L110-I114 WeakPolarHBondContact O-CG1 3.47Å; L110-I114 PolarHBondContact O-N 3.23Å; K112-I114 VanDerWaalsContact C-N 3.34Å; K112-I114 PolarHBondContact O-N 2.82Å; I114-E116 VanDerWaalsContact C-N 3.31Å; I114-E116 PolarHBondContact O-N 3.23Å; I114-L117 PolarHBondContact O-N 3.15Å; I114-E118 HydrophobicContact CG2-CG 4.32Å; I114-E118 VanDerWaalsContact O-CG 3.3Å; I114-E118 WeakPolarHBondContact O-CG 3.47Å; I114-E118 PolarHBondContact O-N 3.48Å
115	R	98.6	Very high	98.7	Very high	146 Å²	146	97.3 Å²	97.3	55%	0.551	48%	0.482	S	S	*	.	H	α-helix	trans	-65.2	-34	177.7	-63.7	174.8	-166.3	115.9	2.9	112.9	Q111 K112 Y113 E118 Q119	Q111-R115 WeakPolarHBondContact O-CG 3.46Å; Q111-R115 PolarHBondContact O-NH1 2.81Å; K112-R115 PolarHBondContact O-N 2.99Å; K112-R115 VanDerWaalsContact O-N 3.14Å; Y113-R115 PolarHBondContact O-N 2.83Å; R115-E118 WeakPolarHBondContact CA-OE2 3.27Å; R115-E118 PolarHBondContact O-N 3.18Å; R115-Q119 WeakPolarHBondContact O-CB 3.44Å; R115-Q119 PolarHBondContact O-N 2.99Å
116	E	98.8	Very high	98.7	Very high	88 Å²	88	101.5 Å²	101.5	41%	0.411	49%	0.485	S	S	.	.	H	α-helix	trans	-67.4	-38.5	175.1	-69.3	168.3	167.9	0	0	111.4	K112 Y113 I114 A120	K112-E116 IonicContact NZ-OE1 2.76Å; K112-E116 PolarHBondContact NZ-OE1 3.22Å; K112-E116 WeakPolarHBondContact O-CG 3.23Å; K112-E116 PolarHBondContact O-N 2.98Å; K112-E116 VanDerWaalsContact O-N 3.11Å; Y113-E116 PolarHBondContact O-N 3.1Å; I114-E116 VanDerWaalsContact C-N 3.31Å; I114-E116 PolarHBondContact O-N 3.23Å; E116-A120 WeakPolarHBondContact O-CB 3.49Å; E116-A120 PolarHBondContact O-N 3.28Å
117	L	98.7	Very high	98.7	Very high	88 Å²	88	99.9 Å²	99.9	46%	0.461	49%	0.485	S	S	.	.	H	α-helix	trans	-70.5	-39.5	172.7	-69.9	173.8	0	0	0	112.8	Y113 I114 A120 N121	Y113-L117 HydrophobicContact CD1-CD1 4Å; Y113-L117 HydrophobicContact CE1-CD1 3.6Å; Y113-L117 HydrophobicContact CE1-CG 4.26Å; Y113-L117 HydrophobicContact CE2-CD2 4.47Å; Y113-L117 HydrophobicContact CE2-CG 4.32Å; Y113-L117 WeakPolarHBondContact O-CG 3.43Å; Y113-L117 PolarHBondContact O-N 2.92Å; I114-L117 PolarHBondContact O-N 3.15Å; L117-A120 PolarHBondContact O-N 2.76Å; L117-N121 WeakPolarHBondContact O-CB 3.49Å; L117-N121 PolarHBondContact O-N 3.48Å
118	E	98.7	Very high	98.7	Very high	114 Å²	114	101.6 Å²	101.6	53%	0.533	49%	0.492	S	S	.	.	H	α-helix	trans	-58.7	-49.5	173.7	-73.3	168.1	158	0	0	110.5	I114 R115 N121 D122	I114-E118 HydrophobicContact CG2-CG 4.32Å; I114-E118 VanDerWaalsContact O-CG 3.3Å; I114-E118 WeakPolarHBondContact O-CG 3.47Å; I114-E118 PolarHBondContact O-N 3.48Å; R115-E118 WeakPolarHBondContact CA-OE2 3.27Å; R115-E118 PolarHBondContact O-N 3.18Å; E118-N121 PolarHBondContact O-N 2.93Å; E118-D122 PolarHBondContact O-N 3.5Å
119	Q	98.7	Very high	98.7	Very high	122 Å²	122	105.3 Å²	105.3	57%	0.57	50%	0.5	S	S	*	.	H	α-helix	trans	-62.1	-44.8	176.4	-170.6	-167.8	-41.5	0	0	112.2	R115 N121 D122 D123	R115-Q119 WeakPolarHBondContact O-CB 3.44Å; R115-Q119 PolarHBondContact O-N 2.99Å; Q119-N121 PolarHBondContact O-N 3.31Å; Q119-D122 PolarHBondContact O-N 2.87Å; Q119-D123 WeakPolarHBondContact O-CB 3.49Å; Q119-D123 PolarHBondContact O-N 2.85Å
120	A	98.7	Very high	98.7	Very high	55 Å²	55	101.2 Å²	101.2	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-62.4	-31.4	178.3	0	0	0	0	0	112.4	E116 L117 L124	E116-A120 WeakPolarHBondContact O-CB 3.49Å; E116-A120 PolarHBondContact O-N 3.28Å; L117-A120 PolarHBondContact O-N 2.76Å; A120-L124 VanDerWaalsContact O-CB 3.32Å; A120-L124 WeakPolarHBondContact O-CB 3.38Å; A120-L124 PolarHBondContact O-N 3.15Å
121	N	98.7	Very high	98.7	Very high	85 Å²	85	100.6 Å²	100.6	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-73.1	-41.6	173.9	-172.9	68.2	0	0	0	112.5	L117 E118 Q119 D123 L124 E125	L117-N121 WeakPolarHBondContact O-CB 3.49Å; L117-N121 PolarHBondContact O-N 3.48Å; E118-N121 PolarHBondContact O-N 2.93Å; Q119-N121 PolarHBondContact O-N 3.31Å; N121-D123 VanDerWaalsContact C-N 3.3Å; N121-D123 PolarHBondContact O-N 3.11Å; N121-L124 PolarHBondContact O-N 3.38Å; N121-E125 PolarHBondContact O-N 2.74Å
122	D	98.8	Very high	98.7	Very high	101 Å²	101	100.2 Å²	100.2	54%	0.54	49%	0.491	S	S	.	.	H	α-helix	trans	-60.4	-39.7	172.3	-83.8	-3.7	0	0	0	112	E118 Q119 E125 R126	E118-D122 PolarHBondContact O-N 3.5Å; Q119-D122 PolarHBondContact O-N 2.87Å; D122-E125 PolarHBondContact O-N 2.91Å; D122-R126 WeakPolarHBondContact O-CB 3.34Å; D122-R126 PolarHBondContact O-N 3.5Å
123	D	98.8	Very high	98.7	Very high	61 Å²	61	100.8 Å²	100.8	33%	0.326	50%	0.497	S	S	.	.	H	α-helix	trans	-68	-40	176.2	-70.6	-20.3	0	0	0	111.5	Q119 N121 R126 A127	Q119-D123 WeakPolarHBondContact O-CB 3.49Å; Q119-D123 PolarHBondContact O-N 2.85Å; N121-D123 VanDerWaalsContact C-N 3.3Å; N121-D123 PolarHBondContact O-N 3.11Å; D123-R126 PolarHBondContact O-N 3.19Å; D123-R126 IonicContact OD1-CZ 2.66Å; D123-R126 IonicContact OD1-NH1 3.24Å; D123-R126 PolarHBondContact OD1-NH1 2.93Å; D123-R126 IonicContact OD1-NH2 2.67Å; D123-R126 PolarHBondContact OD1-NH2 2.98Å; D123-A127 PolarHBondContact O-N 3.26Å
124	L	98.7	Very high	98.7	Very high	114 Å²	114	98.2 Å²	98.2	60%	0.597	50%	0.499	S	S	*	.	H	α-helix	trans	-64.9	-41.5	173.4	179.7	63.3	0	0	0	112.3	A120 N121 R126 A127 K128	A120-L124 VanDerWaalsContact O-CB 3.32Å; A120-L124 WeakPolarHBondContact O-CB 3.38Å; A120-L124 PolarHBondContact O-N 3.15Å; N121-L124 PolarHBondContact O-N 3.38Å; L124-R126 VanDerWaalsContact C-N 3.34Å; L124-A127 PolarHBondContact O-N 3.33Å; L124-K128 WeakPolarHBondContact O-CB 3.44Å; L124-K128 PolarHBondContact O-N 3.39Å
125	E	98.7	Very high	98.7	Very high	82 Å²	82	98.5 Å²	98.5	38%	0.383	50%	0.501	S	S	.	.	H	α-helix	trans	-62.8	-40.1	173.4	-85.1	-149.6	-155.4	0	0	112	N121 D122 K128 R129	N121-E125 PolarHBondContact O-N 2.74Å; D122-E125 PolarHBondContact O-N 2.91Å; E125-K128 PolarHBondContact O-N 3.13Å; E125-R129 VanDerWaalsContact O-CG 3.27Å; E125-R129 WeakPolarHBondContact O-CG 3.43Å; E125-R129 PolarHBondContact O-N 2.89Å; E125-R129 IonicContact OE2-CZ 3.12Å; E125-R129 IonicContact OE2-NE 2.66Å; E125-R129 IonicContact OE2-NH2 2.75Å; E125-R129 PolarHBondContact OE2-NH2 3.43Å
126	R	98.7	Very high	98.7	Very high	147 Å²	147	96.7 Å²	96.7	56%	0.555	50%	0.499	S	S	*	.	H	α-helix	trans	-64.8	-43.4	176.5	-158.9	-177.9	-46.3	106.1	13.6	111.4	D122 D123 L124 R129 A130	D122-R126 WeakPolarHBondContact O-CB 3.34Å; D122-R126 PolarHBondContact O-N 3.5Å; D123-R126 PolarHBondContact O-N 3.19Å; D123-R126 IonicContact OD1-CZ 2.66Å; D123-R126 IonicContact OD1-NH1 3.24Å; D123-R126 PolarHBondContact OD1-NH1 2.93Å; D123-R126 IonicContact OD1-NH2 2.67Å; D123-R126 PolarHBondContact OD1-NH2 2.98Å; L124-R126 VanDerWaalsContact C-N 3.34Å; R126-R129 PolarHBondContact O-N 2.95Å; R126-A130 PolarHBondContact O-N 2.84Å
127	A	98.8	Very high	98.7	Very high	52 Å²	52	95.5 Å²	95.5	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-61.2	-45.5	173.9	0	0	0	0	0	111.6	D123 L124 R129 A130 T131	D123-A127 PolarHBondContact O-N 3.26Å; L124-A127 PolarHBondContact O-N 3.33Å; A127-R129 PolarHBondContact O-N 3.4Å; A127-A130 PolarHBondContact O-N 2.93Å; A127-T131 PolarHBondContact O-N 3.32Å; A127-T131 PolarHBondContact O-OG1 2.9Å; A127-T131 VanDerWaalsContact O-OG1 3.11Å
128	K	98.8	Very high	98.6	Very high	139 Å²	139	97.3 Å²	97.3	60%	0.604	50%	0.499	S	S	*	.	H	α-helix	trans	-56	-46.5	175.2	177.4	-176.9	174.7	-175.2	0	112.1	L124 E125 T131 I132	L124-K128 WeakPolarHBondContact O-CB 3.44Å; L124-K128 PolarHBondContact O-N 3.39Å; E125-K128 PolarHBondContact O-N 3.13Å; K128-T131 PolarHBondContact O-N 3.2Å; K128-I132 HydrophobicContact CG-CD1 3.99Å; K128-I132 WeakPolarHBondContact O-CG1 3.36Å; K128-I132 PolarHBondContact O-N 3.49Å
129	R	98.7	Very high	98.6	Very high	157 Å²	157	97.3 Å²	97.3	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-43	178.3	-67.3	169.1	-159.9	-158	8.4	111.6	E125 R126 A127 I132 M133	E125-R129 VanDerWaalsContact O-CG 3.27Å; E125-R129 WeakPolarHBondContact O-CG 3.43Å; E125-R129 PolarHBondContact O-N 2.89Å; E125-R129 IonicContact OE2-CZ 3.12Å; E125-R129 IonicContact OE2-NE 2.66Å; E125-R129 IonicContact OE2-NH2 2.75Å; E125-R129 PolarHBondContact OE2-NH2 3.43Å; R126-R129 PolarHBondContact O-N 2.95Å; A127-R129 PolarHBondContact O-N 3.4Å; R129-I132 PolarHBondContact O-N 3.41Å; R129-M133 WeakPolarHBondContact O-CG 3.23Å; R129-M133 PolarHBondContact O-N 3.42Å
130	A	98.7	Very high	98.6	Very high	60 Å²	60	97.2 Å²	97.2	50%	0.496	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-41.4	176	0	0	0	0	0	112.7	R126 A127 M133 S134	R126-A130 PolarHBondContact O-N 2.84Å; A127-A130 PolarHBondContact O-N 2.93Å; A130-M133 PolarHBondContact O-N 3Å; A130-S134 WeakPolarHBondContact O-CB 3.31Å; A130-S134 PolarHBondContact O-N 3.37Å
131	T	98.7	Very high	98.6	Very high	83 Å²	83	101.7 Å²	101.7	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-42.3	175	-60.3	0	0	0	0	111.9	A127 K128 S134 L135	A127-T131 PolarHBondContact O-N 3.32Å; A127-T131 PolarHBondContact O-OG1 2.9Å; A127-T131 VanDerWaalsContact O-OG1 3.11Å; K128-T131 PolarHBondContact O-N 3.2Å; T131-S134 WeakPolarHBondContact O-CB 3.44Å; T131-S134 PolarHBondContact O-N 2.91Å; T131-L135 HydrophobicContact CG2-CD1 4.24Å; T131-L135 WeakPolarHBondContact O-CG 3.43Å; T131-L135 PolarHBondContact O-N 3Å
132	I	98.6	Very high	98.6	Very high	72 Å²	72	101.5 Å²	101.5	37%	0.369	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-50.8	176.5	-70.5	165.3	0	0	0	110.4	K128 R129 S134 L135 E136	K128-I132 HydrophobicContact CG-CD1 3.99Å; K128-I132 WeakPolarHBondContact O-CG1 3.36Å; K128-I132 PolarHBondContact O-N 3.49Å; R129-I132 PolarHBondContact O-N 3.41Å; I132-S134 PolarHBondContact O-N 3.3Å; I132-L135 WeakPolarHBondContact O-CB 3.48Å; I132-L135 PolarHBondContact O-N 2.89Å; I132-E136 HydrophobicContact CG2-CG 4.28Å; I132-E136 WeakPolarHBondContact CG2-OE1 3.35Å; I132-E136 WeakPolarHBondContact O-CG 3.34Å; I132-E136 PolarHBondContact O-N 3.33Å
133	M	98.6	Very high	98.6	Very high	129 Å²	129	101 Å²	101	64%	0.635	50%	0.5	S	S	*	.	H	α-helix	trans	-59.3	-34.6	177.1	-68.5	175.9	64.6	0	0	113.2	R129 A130 D137	R129-M133 WeakPolarHBondContact O-CG 3.23Å; R129-M133 PolarHBondContact O-N 3.42Å; A130-M133 PolarHBondContact O-N 3Å; M133-D137 WeakPolarHBondContact O-CB 3.49Å; M133-D137 PolarHBondContact O-N 3.32Å
134	S	98.3	Very high	98.5	Very high	78 Å²	78	101.2 Å²	101.2	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-70.1	-31.4	176.2	-173.4	0	0	0	0	112.9	A130 T131 I132 F138	A130-S134 WeakPolarHBondContact O-CB 3.31Å; A130-S134 PolarHBondContact O-N 3.37Å; T131-S134 WeakPolarHBondContact O-CB 3.44Å; T131-S134 PolarHBondContact O-N 2.91Å; I132-S134 PolarHBondContact O-N 3.3Å; S134-F138 PolarHBondContact O-N 3.39Å
135	L	98.5	Very high	98.5	Very high	96 Å²	96	97.6 Å²	97.6	50%	0.503	49%	0.486	S	S	.	.	H	α-helix	trans	-74.9	-43.8	172.6	-69	168.8	0	0	0	110.7	T131 I132 D137 F138 E139	T131-L135 HydrophobicContact CG2-CD1 4.24Å; T131-L135 WeakPolarHBondContact O-CG 3.43Å; T131-L135 PolarHBondContact O-N 3Å; I132-L135 WeakPolarHBondContact O-CB 3.48Å; I132-L135 PolarHBondContact O-N 2.89Å; L135-D137 PolarHBondContact O-N 2.98Å; L135-F138 CarbonylContact O-C 3.58Å; L135-F138 WeakPolarHBondContact O-CB 3.44Å; L135-F138 PolarHBondContact O-N 2.95Å; L135-F138 VanDerWaalsContact O-N 3.08Å; L135-E139 WeakPolarHBondContact O-CG 3.34Å; L135-E139 PolarHBondContact O-N 3.19Å
136	E	98.5	Very high	98.5	Very high	107 Å²	107	98.9 Å²	98.9	50%	0.5	49%	0.494	S	S	.	.	H	α-helix	trans	-59.7	-42.1	177.6	-69.4	167.5	163.1	0	0	112.3	I132 E139 Q140	I132-E136 HydrophobicContact CG2-CG 4.28Å; I132-E136 WeakPolarHBondContact CG2-OE1 3.35Å; I132-E136 WeakPolarHBondContact O-CG 3.34Å; I132-E136 PolarHBondContact O-N 3.33Å; E136-E139 PolarHBondContact O-N 2.94Å; E136-Q140 WeakPolarHBondContact O-CB 3.36Å; E136-Q140 PolarHBondContact O-N 3.19Å
137	D	98.5	Very high	98.4	Very high	64 Å²	64	98 Å²	98	34%	0.342	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-37.7	172.9	173	46.5	0	0	0	112.2	M133 L135 R141	M133-D137 WeakPolarHBondContact O-CB 3.49Å; M133-D137 PolarHBondContact O-N 3.32Å; L135-D137 PolarHBondContact O-N 2.98Å; D137-R141 VanDerWaalsContact CG-NE 3.32Å; D137-R141 WeakPolarHBondContact O-CD 3.45Å; D137-R141 WeakPolarHBondContact O-CG 3.37Å; D137-R141 PolarHBondContact O-N 3.43Å; D137-R141 IonicContact OD1-CZ 3.27Å; D137-R141 IonicContact OD1-NE 2.76Å; D137-R141 PolarHBondContact OD1-NE 3.44Å; D137-R141 IonicContact OD1-NH2 3.09Å; D137-R141 PolarHBondContact OD1-NH2 3.26Å; D137-R141 IonicContact OD2-CZ 2.69Å; D137-R141 IonicContact OD2-NE 3.72Å; D137-R141 PolarHBondContact OD2-NE 2.9Å; D137-R141 IonicContact OD2-NH1 3.01Å; D137-R141 IonicContact OD2-NH2 2.77Å; D137-R141 PolarHBondContact OD2-NH2 2.9Å
138	F	98.2	Very high	98.4	Very high	125 Å²	125	102.2 Å²	102.2	55%	0.548	50%	0.501	S	S	.	.	H	α-helix	trans	-70.5	-42.8	175.9	-172.1	-109.1	0	0	0	112.3	S134 L135 R141 L142	S134-F138 PolarHBondContact O-N 3.39Å; L135-F138 CarbonylContact O-C 3.58Å; L135-F138 WeakPolarHBondContact O-CB 3.44Å; L135-F138 PolarHBondContact O-N 2.95Å; L135-F138 VanDerWaalsContact O-N 3.08Å; F138-R141 PolarHBondContact O-N 3.46Å; F138-L142 HydrophobicContact CD1-CD1 3.89Å; F138-L142 HydrophobicContact CD1-CG 4.33Å; F138-L142 HydrophobicContact CE1-CD1 3.53Å; F138-L142 HydrophobicContact CE1-CG 4.05Å; F138-L142 HydrophobicContact CZ-CD1 4.13Å; F138-L142 HydrophobicContact CZ-CD2 4.3Å; F138-L142 HydrophobicContact CZ-CG 4.24Å; F138-L142 WeakPolarHBondContact O-CG 3.43Å; F138-L142 PolarHBondContact O-N 2.95Å
139	E	98.3	Very high	98.3	Very high	115 Å²	115	99.9 Å²	99.9	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-60.7	-44	173.3	-73.6	177.2	175.7	0	0	111.3	L135 E136 R141 L142 N143	L135-E139 WeakPolarHBondContact O-CG 3.34Å; L135-E139 PolarHBondContact O-N 3.19Å; E136-E139 PolarHBondContact O-N 2.94Å; E139-R141 VanDerWaalsContact C-N 3.33Å; E139-R141 PolarHBondContact O-N 3.02Å; E139-L142 PolarHBondContact O-N 3.47Å; E139-N143 WeakPolarHBondContact O-CB 3.3Å; E139-N143 VanDerWaalsContact O-CG 3.25Å; E139-N143 PolarHBondContact O-N 2.87Å; E139-N143 PolarHBondContact O-ND2 3.14Å
140	Q	98.6	Very high	98.3	Very high	120 Å²	120	94.9 Å²	94.9	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-61.8	-40.7	175.7	-166.7	-178.5	24.7	0	0	111.9	E136 N143 Q144	E136-Q140 WeakPolarHBondContact O-CB 3.36Å; E136-Q140 PolarHBondContact O-N 3.19Å; Q140-N143 PolarHBondContact O-N 3.24Å; Q140-Q144 WeakPolarHBondContact O-CG 3.29Å; Q140-Q144 PolarHBondContact O-N 3.47Å
141	R	98.4	Very high	98.2	Very high	148 Å²	148	97.8 Å²	97.8	56%	0.558	49%	0.489	S	S	*	.	H	α-helix	trans	-66.9	-39.3	176.1	-71.4	167.9	-163.2	-153.5	5.7	112.6	D137 F138 E139 A145	D137-R141 VanDerWaalsContact CG-NE 3.32Å; D137-R141 WeakPolarHBondContact O-CD 3.45Å; D137-R141 WeakPolarHBondContact O-CG 3.37Å; D137-R141 PolarHBondContact O-N 3.43Å; D137-R141 IonicContact OD1-CZ 3.27Å; D137-R141 IonicContact OD1-NE 2.76Å; D137-R141 PolarHBondContact OD1-NE 3.44Å; D137-R141 IonicContact OD1-NH2 3.09Å; D137-R141 PolarHBondContact OD1-NH2 3.26Å; D137-R141 IonicContact OD2-CZ 2.69Å; D137-R141 IonicContact OD2-NE 3.72Å; D137-R141 PolarHBondContact OD2-NE 2.9Å; D137-R141 IonicContact OD2-NH1 3.01Å; D137-R141 IonicContact OD2-NH2 2.77Å; D137-R141 PolarHBondContact OD2-NH2 2.9Å; F138-R141 PolarHBondContact O-N 3.46Å; E139-R141 VanDerWaalsContact C-N 3.33Å; E139-R141 PolarHBondContact O-N 3.02Å; R141-A145 WeakPolarHBondContact O-CB 3.47Å; R141-A145 PolarHBondContact O-N 3.41Å
142	L	98.4	Very high	98.2	Very high	82 Å²	82	98 Å²	98	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-63.7	-44.6	174	-75.1	179.6	0	0	0	111.3	F138 E139 Q144 A145 I146	F138-L142 HydrophobicContact CD1-CD1 3.89Å; F138-L142 HydrophobicContact CD1-CG 4.33Å; F138-L142 HydrophobicContact CE1-CD1 3.53Å; F138-L142 HydrophobicContact CE1-CG 4.05Å; F138-L142 HydrophobicContact CZ-CD1 4.13Å; F138-L142 HydrophobicContact CZ-CD2 4.3Å; F138-L142 HydrophobicContact CZ-CG 4.24Å; F138-L142 WeakPolarHBondContact O-CG 3.43Å; F138-L142 PolarHBondContact O-N 2.95Å; E139-L142 PolarHBondContact O-N 3.47Å; L142-Q144 PolarHBondContact O-N 3.2Å; L142-A145 CarbonylContact O-C 3.54Å; L142-A145 WeakPolarHBondContact O-CA 3.45Å; L142-A145 WeakPolarHBondContact O-CB 3.3Å; L142-A145 PolarHBondContact O-N 2.85Å; L142-I146 WeakPolarHBondContact O-CG1 3.42Å; L142-I146 PolarHBondContact O-N 2.98Å
143	N	98.3	Very high	98.1	Very high	90 Å²	90	100.2 Å²	100.2	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-47.1	176.9	-69.2	-24.8	0	0	0	111.4	E139 Q140 A145 I146 E147	E139-N143 WeakPolarHBondContact O-CB 3.3Å; E139-N143 VanDerWaalsContact O-CG 3.25Å; E139-N143 PolarHBondContact O-N 2.87Å; E139-N143 PolarHBondContact O-ND2 3.14Å; Q140-N143 PolarHBondContact O-N 3.24Å; N143-A145 PolarHBondContact O-N 3.41Å; N143-I146 PolarHBondContact O-N 3.26Å; N143-I146 VanDerWaalsContact O-N 3.15Å; N143-E147 WeakPolarHBondContact O-CG 3.46Å; N143-E147 PolarHBondContact O-N 3.43Å
144	Q	98.4	Very high	98	Very high	65 Å²	65	96.5 Å²	96.5	30%	0.304	48%	0.482	S	S	.	.	H	α-helix	trans	-64.5	-23	173.3	-64.9	179.7	30.5	0	0	113.9	Q140 L142 R148	Q140-Q144 WeakPolarHBondContact O-CG 3.29Å; Q140-Q144 PolarHBondContact O-N 3.47Å; L142-Q144 PolarHBondContact O-N 3.2Å; Q144-R148 VanDerWaalsContact CB-NH1 3.32Å; Q144-R148 VanDerWaalsContact O-CG 3.29Å; Q144-R148 WeakPolarHBondContact O-CG 3.45Å; Q144-R148 PolarHBondContact O-N 3.29Å; Q144-R148 PolarHBondContact O-NH1 3.4Å
145	A	98.4	Very high	98	Very high	39 Å²	39	97.3 Å²	97.3	32%	0.322	48%	0.477	S	S	.	.	H	α-helix	trans	-77.1	-40.9	173.5	0	0	0	0	0	110.6	R141 L142 N143 R148 N149	R141-A145 WeakPolarHBondContact O-CB 3.47Å; R141-A145 PolarHBondContact O-N 3.41Å; L142-A145 CarbonylContact O-C 3.54Å; L142-A145 WeakPolarHBondContact O-CA 3.45Å; L142-A145 WeakPolarHBondContact O-CB 3.3Å; L142-A145 PolarHBondContact O-N 2.85Å; N143-A145 PolarHBondContact O-N 3.41Å; A145-R148 PolarHBondContact O-N 2.96Å; A145-N149 PolarHBondContact O-N 2.93Å; A145-N149 PolarHBondContact O-ND2 2.91Å
146	I	98	Very high	97.9	Very high	109 Å²	109	97.7 Å²	97.7	56%	0.559	48%	0.479	S	S	*	.	H	α-helix	trans	-61.6	-48.2	174	-67.1	161.5	0	0	0	110.2	L142 N143 R148 N149 A150	L142-I146 WeakPolarHBondContact O-CG1 3.42Å; L142-I146 PolarHBondContact O-N 2.98Å; N143-I146 PolarHBondContact O-N 3.26Å; N143-I146 VanDerWaalsContact O-N 3.15Å; I146-R148 VanDerWaalsContact C-N 3.31Å; I146-R148 PolarHBondContact O-N 3.11Å; I146-N149 PolarHBondContact O-N 2.6Å; I146-N149 VanDerWaalsContact O-N 3.15Å; I146-A150 WeakPolarHBondContact O-CB 3.33Å; I146-A150 PolarHBondContact O-N 3.29Å
147	E	97.9	Very high	97.8	Very high	128 Å²	128	97.1 Å²	97.1	60%	0.598	48%	0.48	S	S	*	.	H	α-helix	trans	-54.2	-44.1	175.3	-72.5	165.7	-175.3	0	0	112.4	N143 F151	N143-E147 WeakPolarHBondContact O-CG 3.46Å; N143-E147 PolarHBondContact O-N 3.43Å; E147-F151 WeakPolarHBondContact O-CB 3.4Å; E147-F151 PolarHBondContact O-N 2.93Å
148	R	98.1	Very high	97.8	Very high	141 Å²	141	101 Å²	101	53%	0.532	50%	0.496	S	S	.	.	H	α-helix	trans	-71.2	-35	177.8	-71.9	-179.6	-163.7	99.6	0.1	113.3	Q144 A145 I146 L152	Q144-R148 VanDerWaalsContact CB-NH1 3.32Å; Q144-R148 VanDerWaalsContact O-CG 3.29Å; Q144-R148 WeakPolarHBondContact O-CG 3.45Å; Q144-R148 PolarHBondContact O-N 3.29Å; Q144-R148 PolarHBondContact O-NH1 3.4Å; A145-R148 PolarHBondContact O-N 2.96Å; I146-R148 VanDerWaalsContact C-N 3.31Å; I146-R148 PolarHBondContact O-N 3.11Å; R148-L152 WeakPolarHBondContact O-CB 3.48Å; R148-L152 VanDerWaalsContact O-CG 3.28Å; R148-L152 WeakPolarHBondContact O-CG 3.29Å; R148-L152 PolarHBondContact O-N 2.93Å
149	N	97.2	Very high	97.7	Very high	90 Å²	90	101.1 Å²	101.1	48%	0.481	50%	0.496	S	S	.	.	H	α-helix	trans	-68.8	-45.7	174.9	-77.5	-80.9	0	0	0	110.8	A145 I146 F151 L152 E153	A145-N149 PolarHBondContact O-N 2.93Å; A145-N149 PolarHBondContact O-ND2 2.91Å; I146-N149 PolarHBondContact O-N 2.6Å; I146-N149 VanDerWaalsContact O-N 3.15Å; N149-F151 VanDerWaalsContact C-N 3.27Å; N149-F151 PolarHBondContact O-N 3.38Å; N149-L152 CarbonylContact O-C 3.55Å; N149-L152 PolarHBondContact O-N 3.4Å; N149-L152 VanDerWaalsContact O-N 3.1Å; N149-E153 WeakPolarHBondContact O-CB 3.5Å; N149-E153 WeakPolarHBondContact O-CG 3.36Å; N149-E153 PolarHBondContact O-N 3.4Å
150	A	97.9	Very high	97.6	Very high	51 Å²	51	102 Å²	102	42%	0.421	50%	0.5	S	S	.	.	H	α-helix	trans	-60.2	-36.2	176.2	0	0	0	0	0	112.6	I146 S154	I146-A150 WeakPolarHBondContact O-CB 3.33Å; I146-A150 PolarHBondContact O-N 3.29Å; A150-S154 PolarHBondContact O-N 3.26Å; A150-S154 VanDerWaalsContact O-N 3.09Å; A150-S154 PolarHBondContact O-OG 2.94Å
151	F	97.1	Very high	97.6	Very high	122 Å²	122	101.1 Å²	101.1	54%	0.535	50%	0.499	S	S	.	.	H	α-helix	trans	-65.2	-47.5	172.2	-176.6	-98.7	0	0	0	112	E147 N149 E153 S154 E155	E147-F151 WeakPolarHBondContact O-CB 3.4Å; E147-F151 PolarHBondContact O-N 2.93Å; N149-F151 VanDerWaalsContact C-N 3.27Å; N149-F151 PolarHBondContact O-N 3.38Å; F151-E153 VanDerWaalsContact C-N 3.32Å; F151-E153 PolarHBondContact O-N 3.43Å; F151-S154 PolarHBondContact O-N 3.19Å; F151-S154 VanDerWaalsContact O-N 3.14Å; F151-S154 PolarHBondContact O-OG 3.07Å; F151-E155 HydrophobicContact CD1-CG 4.27Å; F151-E155 HydrophobicContact CE1-CG 3.82Å; F151-E155 VanDerWaalsContact CE1-OE1 3.31Å; F151-E155 WeakPolarHBondContact CE1-OE1 3.48Å; F151-E155 HydrophobicContact CZ-CG 4.1Å; F151-E155 PolarHBondContact O-N 2.91Å
152	L	97.6	Very high	97.5	Very high	88 Å²	88	99.4 Å²	99.4	46%	0.461	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-34.2	176.8	-72.4	167.8	0	0	0	112.9	R148 N149 E155 L156	R148-L152 WeakPolarHBondContact O-CB 3.48Å; R148-L152 VanDerWaalsContact O-CG 3.28Å; R148-L152 WeakPolarHBondContact O-CG 3.29Å; R148-L152 PolarHBondContact O-N 2.93Å; N149-L152 CarbonylContact O-C 3.55Å; N149-L152 PolarHBondContact O-N 3.4Å; N149-L152 VanDerWaalsContact O-N 3.1Å; L152-E155 PolarHBondContact O-N 2.91Å; L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 VanDerWaalsContact O-CG 3.26Å; L152-L156 WeakPolarHBondContact O-CG 3.32Å; L152-L156 PolarHBondContact O-N 3.01Å
153	E	97.2	Very high	97.4	Very high	118 Å²	118	100.7 Å²	100.7	55%	0.551	51%	0.507	S	S	*	.	H	α-helix	trans	-60.6	-47.4	170.8	-74.2	166.4	178.7	0	0	109.8	N149 F151 E155 L156 D157	N149-E153 WeakPolarHBondContact O-CB 3.5Å; N149-E153 WeakPolarHBondContact O-CG 3.36Å; N149-E153 PolarHBondContact O-N 3.4Å; F151-E153 VanDerWaalsContact C-N 3.32Å; F151-E153 PolarHBondContact O-N 3.43Å; E153-E155 PolarHBondContact O-N 2.66Å; E153-L156 WeakPolarHBondContact O-CB 3.47Å; E153-L156 PolarHBondContact O-N 3.24Å; E153-L156 VanDerWaalsContact O-N 3.12Å; E153-D157 PolarHBondContact O-N 3.47Å
154	S	96.8	Very high	97.4	Very high	50 Å²	50	101 Å²	101	35%	0.35	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-35.7	175.6	66.3	0	0	0	0	114.4	A150 F151 L156 D157 E158	A150-S154 PolarHBondContact O-N 3.26Å; A150-S154 VanDerWaalsContact O-N 3.09Å; A150-S154 PolarHBondContact O-OG 2.94Å; F151-S154 PolarHBondContact O-N 3.19Å; F151-S154 VanDerWaalsContact O-N 3.14Å; F151-S154 PolarHBondContact O-OG 3.07Å; S154-L156 VanDerWaalsContact C-N 3.3Å; S154-L156 PolarHBondContact O-N 2.96Å; S154-D157 PolarHBondContact O-N 3.18Å; S154-E158 WeakPolarHBondContact O-CG 3.27Å; S154-E158 PolarHBondContact O-N 3.26Å
155	E	96.9	Very high	97.3	Very high	96 Å²	96	100.6 Å²	100.6	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-66.9	-30.3	172.6	-71.7	-168.8	139.4	0	0	112.4	F151 L152 E153 K159	F151-E155 HydrophobicContact CD1-CG 4.27Å; F151-E155 HydrophobicContact CE1-CG 3.82Å; F151-E155 VanDerWaalsContact CE1-OE1 3.31Å; F151-E155 WeakPolarHBondContact CE1-OE1 3.48Å; F151-E155 HydrophobicContact CZ-CG 4.1Å; F151-E155 PolarHBondContact O-N 2.91Å; L152-E155 PolarHBondContact O-N 2.91Å; E153-E155 PolarHBondContact O-N 2.66Å; E155-K159 VanDerWaalsContact O-CB 3.23Å; E155-K159 WeakPolarHBondContact O-CB 3.25Å; E155-K159 PolarHBondContact O-N 3.21Å
156	L	97.3	Very high	97.1	Very high	104 Å²	104	101.6 Å²	101.6	55%	0.545	51%	0.512	S	S	.	.	H	α-helix	trans	-74.6	-41.2	174	-72.3	170.9	0	0	0	111.6	L152 E153 S154 K159 E160	L152-L156 WeakPolarHBondContact O-CB 3.46Å; L152-L156 VanDerWaalsContact O-CG 3.26Å; L152-L156 WeakPolarHBondContact O-CG 3.32Å; L152-L156 PolarHBondContact O-N 3.01Å; E153-L156 WeakPolarHBondContact O-CB 3.47Å; E153-L156 PolarHBondContact O-N 3.24Å; E153-L156 VanDerWaalsContact O-N 3.12Å; S154-L156 VanDerWaalsContact C-N 3.3Å; S154-L156 PolarHBondContact O-N 2.96Å; L156-K159 WeakPolarHBondContact O-CB 3.49Å; L156-K159 PolarHBondContact O-N 3.39Å; L156-E160 PolarHBondContact O-N 2.92Å
157	D	97.3	Very high	97	Very high	95 Å²	95	100.4 Å²	100.4	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-48.1	174.5	-72.5	-9.8	0	0	0	111.1	E153 S154 K159 E160 N161	E153-D157 PolarHBondContact O-N 3.47Å; S154-D157 PolarHBondContact O-N 3.18Å; D157-K159 PolarHBondContact O-N 2.76Å; D157-E160 PolarHBondContact O-N 3Å; D157-N161 PolarHBondContact O-N 3.31Å; D157-N161 PolarHBondContact O-ND2 2.69Å
158	E	97	Very high	96.9	Very high	146 Å²	146	101.5 Å²	101.5	68%	0.682	50%	0.503	S	S	*	.	H	α-helix	trans	-58.1	-39.2	175.3	-77.2	-169.8	-175.2	0	0	111.8	S154 L162	S154-E158 WeakPolarHBondContact O-CG 3.27Å; S154-E158 PolarHBondContact O-N 3.26Å; E158-L162 WeakPolarHBondContact O-CB 3.38Å; E158-L162 PolarHBondContact O-N 3.48Å
159	K	97.1	Very high	96.7	Very high	126 Å²	126	99.7 Å²	99.7	55%	0.548	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-37	176.9	179.7	179.9	177.2	-178.3	0	112.8	E155 L156 D157 L162 L163	E155-K159 VanDerWaalsContact O-CB 3.23Å; E155-K159 WeakPolarHBondContact O-CB 3.25Å; E155-K159 PolarHBondContact O-N 3.21Å; L156-K159 WeakPolarHBondContact O-CB 3.49Å; L156-K159 PolarHBondContact O-N 3.39Å; D157-K159 PolarHBondContact O-N 2.76Å; K159-L162 PolarHBondContact O-N 2.99Å; K159-L163 HydrophobicContact CG-CD1 4.37Å; K159-L163 WeakPolarHBondContact O-CB 3.32Å; K159-L163 VanDerWaalsContact O-CG 3.27Å; K159-L163 WeakPolarHBondContact O-CG 3.34Å; K159-L163 PolarHBondContact O-N 2.67Å
160	E	97	Very high	96.7	Very high	135 Å²	135	101 Å²	101	63%	0.631	51%	0.505	S	S	*	.	H	α-helix	trans	-66.8	-46.9	173.8	-177.6	159.7	-148.4	0	0	111.1	L156 D157 L162 L163 E164	L156-E160 PolarHBondContact O-N 2.92Å; D157-E160 PolarHBondContact O-N 3Å; E160-L162 VanDerWaalsContact C-N 3.28Å; E160-L162 PolarHBondContact O-N 3.37Å; E160-L163 WeakPolarHBondContact O-CB 3.32Å; E160-L163 PolarHBondContact O-N 3Å; E160-E164 PolarHBondContact O-N 2.84Å
161	N	97.3	Very high	96.6	Very high	100 Å²	100	101.6 Å²	101.6	54%	0.535	50%	0.501	S	S	.	.	H	α-helix	trans	-56.4	-40.5	173.9	-77.4	-76.5	0	0	0	112.3	D157 S165	D157-N161 PolarHBondContact O-N 3.31Å; D157-N161 PolarHBondContact O-ND2 2.69Å; N161-S165 WeakPolarHBondContact O-CB 3.37Å; N161-S165 PolarHBondContact O-N 3.26Å; N161-S165 PolarHBondContact O-OG 2.95Å
162	L	96.8	Very high	96.4	Very high	113 Å²	113	101.1 Å²	101.1	59%	0.592	50%	0.5	S	S	*	.	H	α-helix	trans	-69.4	-38.2	175.4	-176.8	61.1	0	0	0	112.3	E158 K159 E160 S165 V166	E158-L162 WeakPolarHBondContact O-CB 3.38Å; E158-L162 PolarHBondContact O-N 3.48Å; K159-L162 PolarHBondContact O-N 2.99Å; E160-L162 VanDerWaalsContact C-N 3.28Å; E160-L162 PolarHBondContact O-N 3.37Å; L162-S165 PolarHBondContact O-N 3.44Å; L162-V166 HydrophobicContact CD1-CG2 4.33Å; L162-V166 WeakPolarHBondContact O-CB 3.44Å; L162-V166 VanDerWaalsContact O-CG2 3.28Å; L162-V166 WeakPolarHBondContact O-CG2 3.39Å; L162-V166 PolarHBondContact O-N 3.05Å
163	L	97	Very high	96.2	Very high	109 Å²	109	98.8 Å²	98.8	57%	0.571	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-41	175.1	-76.6	169.2	0	0	0	111.9	K159 E160 V166 Q167	K159-L163 HydrophobicContact CG-CD1 4.37Å; K159-L163 WeakPolarHBondContact O-CB 3.32Å; K159-L163 VanDerWaalsContact O-CG 3.27Å; K159-L163 WeakPolarHBondContact O-CG 3.34Å; K159-L163 PolarHBondContact O-N 2.67Å; E160-L163 WeakPolarHBondContact O-CB 3.32Å; E160-L163 PolarHBondContact O-N 3Å; L163-V166 PolarHBondContact O-N 3.33Å; L163-Q167 WeakPolarHBondContact O-CB 3.48Å; L163-Q167 PolarHBondContact O-N 2.99Å
164	E	96.7	Very high	96	Very high	95 Å²	95	100.4 Å²	100.4	44%	0.444	50%	0.495	S	S	.	.	H	α-helix	trans	-63.4	-45.3	174	-160.9	-161.4	146.1	0	0	111	E160 V166 Q167 R168	E160-E164 PolarHBondContact O-N 2.84Å; E164-V166 PolarHBondContact O-N 2.87Å; E164-Q167 PolarHBondContact O-N 3.5Å; E164-Q167 VanDerWaalsContact O-N 3.1Å; E164-R168 WeakPolarHBondContact O-CG 3.4Å; E164-R168 PolarHBondContact O-N 3.4Å; E164-R168 IonicContact OE1-CZ 2.6Å; E164-R168 IonicContact OE1-NE 3.3Å; E164-R168 PolarHBondContact OE1-NE 2.99Å; E164-R168 IonicContact OE1-NH2 3.18Å; E164-R168 PolarHBondContact OE1-NH2 3.28Å
165	S	95.8	Very high	95.8	Very high	58 Å²	58	102.2 Å²	102.2	41%	0.406	50%	0.501	S	S	.	.	H	α-helix	trans	-60.5	-43.3	176.7	-60.3	0	0	0	0	112.1	N161 L162 Q167 R168 L169	N161-S165 WeakPolarHBondContact O-CB 3.37Å; N161-S165 PolarHBondContact O-N 3.26Å; N161-S165 PolarHBondContact O-OG 2.95Å; L162-S165 PolarHBondContact O-N 3.44Å; S165-Q167 VanDerWaalsContact C-N 3.31Å; S165-Q167 PolarHBondContact O-N 3.39Å; S165-R168 PolarHBondContact O-N 3.37Å; S165-L169 WeakPolarHBondContact O-CB 3.44Å; S165-L169 WeakPolarHBondContact O-CG 3.42Å; S165-L169 PolarHBondContact O-N 3.45Å
166	V	95.8	Very high	95.5	Very high	59 Å²	59	102.4 Å²	102.4	36%	0.358	50%	0.504	S	S	.	.	H	α-helix	trans	-66.9	-31.7	174.6	165.9	0	0	0	0	111.8	L162 L163 E164 K170	L162-V166 HydrophobicContact CD1-CG2 4.33Å; L162-V166 WeakPolarHBondContact O-CB 3.44Å; L162-V166 VanDerWaalsContact O-CG2 3.28Å; L162-V166 WeakPolarHBondContact O-CG2 3.39Å; L162-V166 PolarHBondContact O-N 3.05Å; L163-V166 PolarHBondContact O-N 3.33Å; E164-V166 PolarHBondContact O-N 2.87Å; V166-K170 HydrophobicContact CG1-CD 4.3Å; V166-K170 WeakPolarHBondContact O-CD 3.49Å; V166-K170 VanDerWaalsContact O-CG 3.22Å; V166-K170 WeakPolarHBondContact O-CG 3.49Å; V166-K170 PolarHBondContact O-N 2.91Å
167	Q	95.8	Very high	95.2	Very high	85 Å²	85	106.2 Å²	106.2	40%	0.397	51%	0.511	S	S	.	.	H	α-helix	trans	-71.3	-46.2	175	-175.3	53.6	37.3	0	0	111.6	L163 E164 S165 L169 K170 D171	L163-Q167 WeakPolarHBondContact O-CB 3.48Å; L163-Q167 PolarHBondContact O-N 2.99Å; E164-Q167 PolarHBondContact O-N 3.5Å; E164-Q167 VanDerWaalsContact O-N 3.1Å; S165-Q167 VanDerWaalsContact C-N 3.31Å; S165-Q167 PolarHBondContact O-N 3.39Å; Q167-L169 VanDerWaalsContact C-N 3.34Å; Q167-L169 PolarHBondContact O-N 3.07Å; Q167-K170 WeakPolarHBondContact O-CB 3.5Å; Q167-K170 PolarHBondContact O-N 3.24Å; Q167-K170 VanDerWaalsContact O-N 3.07Å; Q167-D171 PolarHBondContact NE2-OD1 3.23Å; Q167-D171 VanDerWaalsContact NE2-OD1 3.17Å; Q167-D171 PolarHBondContact NE2-OD2 2.9Å; Q167-D171 PolarHBondContact O-N 3.11Å
168	R	95.3	Very high	94.8	Very high	150 Å²	150	106.2 Å²	106.2	57%	0.566	51%	0.508	S	S	*	.	H	α-helix	trans	-53.5	-49.9	172.8	-70.4	165.7	174.3	-96.7	4.9	111.4	E164 S165 K170 D171 E172	E164-R168 WeakPolarHBondContact O-CG 3.4Å; E164-R168 PolarHBondContact O-N 3.4Å; E164-R168 IonicContact OE1-CZ 2.6Å; E164-R168 IonicContact OE1-NE 3.3Å; E164-R168 PolarHBondContact OE1-NE 2.99Å; E164-R168 IonicContact OE1-NH2 3.18Å; E164-R168 PolarHBondContact OE1-NH2 3.28Å; S165-R168 PolarHBondContact O-N 3.37Å; R168-K170 VanDerWaalsContact C-N 3.32Å; R168-K170 PolarHBondContact O-N 3.01Å; R168-D171 PolarHBondContact O-N 3.39Å; R168-D171 VanDerWaalsContact O-N 3.15Å; R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 3.07Å
169	L	94.9	Very high	94.2	Very high	104 Å²	104	104.5 Å²	104.5	55%	0.545	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-30.5	177.2	-71.4	169.2	0	0	0	113.8	S165 Q167 A173	S165-L169 WeakPolarHBondContact O-CB 3.44Å; S165-L169 WeakPolarHBondContact O-CG 3.42Å; S165-L169 PolarHBondContact O-N 3.45Å; Q167-L169 VanDerWaalsContact C-N 3.34Å; Q167-L169 PolarHBondContact O-N 3.07Å; L169-A173 WeakPolarHBondContact O-CB 3.2Å; L169-A173 PolarHBondContact O-N 3.36Å
170	K	96.1	Very high	93.4	Very high	117 Å²	117	103 Å²	103	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-69.2	-40.3	172.4	-78.6	165.4	-175.3	165.5	0	111.9	V166 Q167 R168 R174	V166-K170 HydrophobicContact CG1-CD 4.3Å; V166-K170 WeakPolarHBondContact O-CD 3.49Å; V166-K170 VanDerWaalsContact O-CG 3.22Å; V166-K170 WeakPolarHBondContact O-CG 3.49Å; V166-K170 PolarHBondContact O-N 2.91Å; Q167-K170 WeakPolarHBondContact O-CB 3.5Å; Q167-K170 PolarHBondContact O-N 3.24Å; Q167-K170 VanDerWaalsContact O-N 3.07Å; R168-K170 VanDerWaalsContact C-N 3.32Å; R168-K170 PolarHBondContact O-N 3.01Å; K170-R174 WeakPolarHBondContact O-CB 3.38Å; K170-R174 PolarHBondContact O-N 2.91Å
171	D	96.2	Very high	92.7	Very high	63 Å²	63	98.5 Å²	98.5	34%	0.337	48%	0.484	S	S	.	.	H	α-helix	trans	-72.7	-42.6	179.9	-67.6	-35.7	0	0	0	110.5	Q167 R168 A173 R174 D175	Q167-D171 PolarHBondContact NE2-OD1 3.23Å; Q167-D171 VanDerWaalsContact NE2-OD1 3.17Å; Q167-D171 PolarHBondContact NE2-OD2 2.9Å; Q167-D171 PolarHBondContact O-N 3.11Å; R168-D171 PolarHBondContact O-N 3.39Å; R168-D171 VanDerWaalsContact O-N 3.15Å; D171-A173 PolarHBondContact O-N 3.04Å; D171-R174 CarbonylContact O-C 3.56Å; D171-R174 WeakPolarHBondContact O-CA 3.41Å; D171-R174 WeakPolarHBondContact O-CB 3.38Å; D171-R174 PolarHBondContact O-N 2.8Å; D171-D175 PolarHBondContact O-N 3.02Å
172	E	93.2	Very high	91.7	Very high	113 Å²	113	97.5 Å²	97.5	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-55.7	-49	168.3	-72.3	170.8	-149.9	0	0	112	R168 R174 D175 L176	R168-E172 WeakPolarHBondContact O-CG 3.43Å; R168-E172 PolarHBondContact O-N 3.07Å; E172-R174 PolarHBondContact O-N 3.08Å; E172-D175 PolarHBondContact O-N 3.36Å; E172-L176 WeakPolarHBondContact O-CB 3.5Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.42Å
173	A	92.5	Very high	90.6	Very high	38 Å²	38	97.5 Å²	97.5	31%	0.314	48%	0.478	S	S	.	.	H	α-helix	trans	-66.9	-22.9	177.3	0	0	0	0	0	113.2	L169 D171 R177	L169-A173 WeakPolarHBondContact O-CB 3.2Å; L169-A173 PolarHBondContact O-N 3.36Å; D171-A173 PolarHBondContact O-N 3.04Å; A173-R177 WeakPolarHBondContact O-CB 3.44Å; A173-R177 WeakPolarHBondContact O-CD 3.29Å; A173-R177 WeakPolarHBondContact O-CG 3.32Å; A173-R177 PolarHBondContact O-N 3.5Å
174	R	93.4	Very high	89.2	Confident	152 Å²	152	99.4 Å²	99.4	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-79.4	-39.1	173.9	178.7	-168.6	171.4	165.8	-0.7	111	K170 D171 E172 R177 Q178	K170-R174 WeakPolarHBondContact O-CB 3.38Å; K170-R174 PolarHBondContact O-N 2.91Å; D171-R174 CarbonylContact O-C 3.56Å; D171-R174 WeakPolarHBondContact O-CA 3.41Å; D171-R174 WeakPolarHBondContact O-CB 3.38Å; D171-R174 PolarHBondContact O-N 2.8Å; E172-R174 PolarHBondContact O-N 3.08Å; R174-R177 PolarHBondContact O-N 2.64Å; R174-Q178 WeakPolarHBondContact O-CG 3.45Å; R174-Q178 PolarHBondContact O-N 3.28Å; R174-Q178 VanDerWaalsContact O-N 3.07Å; R174-Q178 PolarHBondContact O-NE2 2.9Å
175	D	92.8	Very high	87.5	Confident	89 Å²	89	102.9 Å²	102.9	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-73.2	-43.4	178.7	-71.4	-14	0	0	0	111	D171 E172 R177 Q178 E179	D171-D175 PolarHBondContact O-N 3.02Å; E172-D175 PolarHBondContact O-N 3.36Å; D175-R177 VanDerWaalsContact C-N 3.26Å; D175-R177 PolarHBondContact O-N 2.76Å; D175-Q178 CarbonylContact O-C 3.59Å; D175-Q178 WeakPolarHBondContact O-CA 3.36Å; D175-Q178 WeakPolarHBondContact O-CB 3.38Å; D175-Q178 PolarHBondContact O-N 3.27Å; D175-Q178 PolarHBondContact OD1-NE2 2.98Å; D175-E179 PolarHBondContact O-N 3.01Å
176	L	91	Very high	85.8	Confident	100 Å²	100	108 Å²	108	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-57.8	-35.7	170.1	-70.2	169.8	0	0	0	112.7	E172 E179 L180	E172-L176 WeakPolarHBondContact O-CB 3.5Å; E172-L176 WeakPolarHBondContact O-CG 3.31Å; E172-L176 PolarHBondContact O-N 3.42Å; L176-E179 PolarHBondContact O-N 2.8Å; L176-L180 WeakPolarHBondContact O-CB 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.23Å; L176-L180 PolarHBondContact O-N 3.44Å
177	R	90.2	Very high	83.4	Confident	183 Å²	183	113.4 Å²	113.4	69%	0.691	54%	0.536	S	S	*	.	H	α-helix	trans	-68.2	-33.2	172.3	-78.7	169.6	-175.1	171.2	2.4	112.7	A173 R174 D175 A181	A173-R177 WeakPolarHBondContact O-CB 3.44Å; A173-R177 WeakPolarHBondContact O-CD 3.29Å; A173-R177 WeakPolarHBondContact O-CG 3.32Å; A173-R177 PolarHBondContact O-N 3.5Å; R174-R177 PolarHBondContact O-N 2.64Å; D175-R177 VanDerWaalsContact C-N 3.26Å; D175-R177 PolarHBondContact O-N 2.76Å; R177-A181 VanDerWaalsContact O-CB 3.26Å; R177-A181 WeakPolarHBondContact O-CB 3.46Å; R177-A181 PolarHBondContact O-N 3.35Å; R177-A181 VanDerWaalsContact O-N 3.07Å
178	Q	89.1	Confident	80.6	Confident	95 Å²	95	117.6 Å²	117.6	44%	0.444	55%	0.553	S	S	.	*	H	α-helix	trans	-72	-41.8	174.1	-72.7	166.1	103.5	0	0	111	R174 D175 A181 V182	R174-Q178 WeakPolarHBondContact O-CG 3.45Å; R174-Q178 PolarHBondContact O-N 3.28Å; R174-Q178 VanDerWaalsContact O-N 3.07Å; R174-Q178 PolarHBondContact O-NE2 2.9Å; D175-Q178 CarbonylContact O-C 3.59Å; D175-Q178 WeakPolarHBondContact O-CA 3.36Å; D175-Q178 WeakPolarHBondContact O-CB 3.38Å; D175-Q178 PolarHBondContact O-N 3.27Å; D175-Q178 PolarHBondContact OD1-NE2 2.98Å; Q178-A181 CarbonylContact O-C 3.56Å; Q178-A181 PolarHBondContact O-N 2.89Å; Q178-V182 WeakPolarHBondContact O-CG2 3.47Å; Q178-V182 PolarHBondContact O-N 3.33Å
179	E	84.9	Confident	78.2	Confident	111 Å²	111	114.8 Å²	114.8	52%	0.519	56%	0.555	S	S	.	*	H	α-helix	trans	-58.6	-50.2	173.7	-70	-174.7	170.9	0	0	111.8	D175 L176 A181 V182 Q183	D175-E179 PolarHBondContact O-N 3.01Å; L176-E179 PolarHBondContact O-N 2.8Å; E179-A181 VanDerWaalsContact C-N 3.3Å; E179-A181 PolarHBondContact O-N 3.42Å; E179-V182 WeakPolarHBondContact O-CB 3.33Å; E179-V182 PolarHBondContact O-N 3.26Å; E179-Q183 WeakPolarHBondContact O-CG 3.39Å; E179-Q183 PolarHBondContact O-N 3.32Å
180	L	80.1	Confident	75.7	Confident	94 Å²	94	122 Å²	122	49%	0.492	57%	0.574	S	S	.	*	H	α-helix	trans	-59.2	-40.1	175	-73.1	170.2	0	0	0	112.1	L176 V182 Q183 Q184	L176-L180 WeakPolarHBondContact O-CB 3.28Å; L176-L180 WeakPolarHBondContact O-CG 3.23Å; L176-L180 PolarHBondContact O-N 3.44Å; L180-V182 VanDerWaalsContact C-N 3.28Å; L180-V182 PolarHBondContact O-N 3.03Å; L180-Q183 PolarHBondContact O-N 3.35Å; L180-Q184 WeakPolarHBondContact O-CB 3.49Å; L180-Q184 VanDerWaalsContact O-CG 3.29Å; L180-Q184 WeakPolarHBondContact O-CG 3.49Å; L180-Q184 PolarHBondContact O-N 2.88Å
181	A	80.8	Confident	73.3	Confident	41 Å²	41	122.2 Å²	122.2	34%	0.339	59%	0.586	S	S	.	*	H	α-helix	trans	-70.9	-20.1	176.3	0	0	0	0	0	113.8	R177 Q178 E179 K185	R177-A181 VanDerWaalsContact O-CB 3.26Å; R177-A181 WeakPolarHBondContact O-CB 3.46Å; R177-A181 PolarHBondContact O-N 3.35Å; R177-A181 VanDerWaalsContact O-N 3.07Å; Q178-A181 CarbonylContact O-C 3.56Å; Q178-A181 PolarHBondContact O-N 2.89Å; E179-A181 VanDerWaalsContact C-N 3.3Å; E179-A181 PolarHBondContact O-N 3.42Å; A181-K185 WeakPolarHBondContact O-CD 3.49Å; A181-K185 WeakPolarHBondContact O-CG 3.48Å
182	V	77.7	Confident	71	Confident	78 Å²	78	124.5 Å²	124.5	47%	0.473	60%	0.604	S	S	.	*	H	α-helix	trans	-81.6	-44.7	170.1	169.1	0	0	0	0	110.5	Q178 E179 L180 Q184 K185 Q186	Q178-V182 WeakPolarHBondContact O-CG2 3.47Å; Q178-V182 PolarHBondContact O-N 3.33Å; E179-V182 WeakPolarHBondContact O-CB 3.33Å; E179-V182 PolarHBondContact O-N 3.26Å; L180-V182 VanDerWaalsContact C-N 3.28Å; L180-V182 PolarHBondContact O-N 3.03Å; V182-Q184 PolarHBondContact O-N 3.15Å; V182-K185 WeakPolarHBondContact O-CA 3.45Å; V182-K185 WeakPolarHBondContact O-CB 3.26Å; V182-K185 PolarHBondContact O-N 2.86Å; V182-Q186 PolarHBondContact O-N 3.01Å; V182-Q186 VanDerWaalsContact O-N 3.08Å
183	Q	73.6	Confident	68.9	Low	113 Å²	113	127.5 Å²	127.5	53%	0.528	62%	0.62	S	S	.	*	H	α-helix	trans	-57.9	-48.1	175.3	-69.5	173.5	7.5	0	0	111.1	E179 L180 K185 Q186 E187	E179-Q183 WeakPolarHBondContact O-CG 3.39Å; E179-Q183 PolarHBondContact O-N 3.32Å; L180-Q183 PolarHBondContact O-N 3.35Å; Q183-K185 PolarHBondContact O-N 3.24Å; Q183-K185 VanDerWaalsContact O-N 3.08Å; Q183-Q186 PolarHBondContact O-N 2.91Å; Q183-E187 PolarHBondContact O-N 3.48Å
184	Q	67.5	Low	66.6	Low	150 Å²	150	131.6 Å²	131.6	70%	0.701	64%	0.643	S	S	*	*	H	α-helix	trans	-62.4	-13.5	173.9	-71.8	178.6	6	0	0	114.8	L180 V182	L180-Q184 WeakPolarHBondContact O-CB 3.49Å; L180-Q184 VanDerWaalsContact O-CG 3.29Å; L180-Q184 WeakPolarHBondContact O-CG 3.49Å; L180-Q184 PolarHBondContact O-N 2.88Å; V182-Q184 PolarHBondContact O-N 3.15Å
185	K	61.9	Low	63.7	Low	168 Å²	168	129.9 Å²	129.9	73%	0.73	66%	0.655	S	S	*	*	H	α-helix	trans	-95.3	-21.2	172.8	-78.6	175.7	-179	173.3	0	113.2	A181 V182 Q183	A181-K185 WeakPolarHBondContact O-CD 3.49Å; A181-K185 WeakPolarHBondContact O-CG 3.48Å; V182-K185 WeakPolarHBondContact O-CA 3.45Å; V182-K185 WeakPolarHBondContact O-CB 3.26Å; V182-K185 PolarHBondContact O-N 2.86Å; Q183-K185 PolarHBondContact O-N 3.24Å; Q183-K185 VanDerWaalsContact O-N 3.08Å
186	Q	58.6	Low	61.1	Low	164 Å²	164	130.5 Å²	130.5	77%	0.766	67%	0.666	S	S	*	*	H	α-helix	trans	-85.6	-34.9	173.6	-65.3	-173.3	10.7	0	0	111.3	V182 Q183	V182-Q186 PolarHBondContact O-N 3.01Å; V182-Q186 VanDerWaalsContact O-N 3.08Å; Q183-Q186 PolarHBondContact O-N 2.91Å
187	E	45.9	Very low	58.9	Low	173 Å²	173	131.4 Å²	131.4	81%	0.808	68%	0.676	S	S	*	*	S	Bend	trans	-92.1	97.9	171.3	-65.8	-158	133	0	0	112.3	Q183	Q183-E187 PolarHBondContact O-N 3.48Å
188	K	37	Very low	56.4	Low	173 Å²	173	131.6 Å²	131.6	75%	0.752	68%	0.684	S	S	*	*			trans	-148	140.2	-178.4	-170.6	-173.1	175	-177.4	0	111.8
189	P	44.3	Very low	54.3	Low	92 Å²	92	131.4 Å²	131.4	60%	0.597	70%	0.699	S	S	*	*			cis	-136	160.4	-26.2	36.9	-21.6	0	0	0	114.3
190	R	43.3	Very low	52.1	Low	254 Å²	254	133.8 Å²	133.8	96%	0.958	71%	0.71	S	S	*	*			trans	-146.9	112.1	132.3	-74.3	-154.5	173.6	160.6	2.3	111.6
191	T	45.2	Very low	50.6	Low	123 Å²	123	138.6 Å²	138.6	76%	0.755	72%	0.722	S	S	*	*			trans	-97.7	176.8	178	50.3	0	0	0	0	111.4
192	P	48.3	Very low	49	Very low	111 Å²	111	142.3 Å²	142.3	72%	0.721	74%	0.74	S	S	*	*			cis	-124.5	-152.1	-48.4	39.7	-21.2	0	0	0	108.4
193	M	48.3	Very low	47.4	Very low	176 Å²	176	145.8 Å²	145.8	87%	0.867	76%	0.756	S	S	*	*			cis	-155.7	158.2	-8.1	-145	146.7	-175.6	0	0	108.4
194	P	44	Very low	46	Very low	123 Å²	123	146 Å²	146	80%	0.799	77%	0.765	S	S	*	*			trans	-113.8	170.8	-167.2	41.8	-34.3	0	0	0	117.1
195	S	33.1	Very low	45.1	Very low	116 Å²	116	143.7 Å²	143.7	81%	0.811	77%	0.772	S	S	*	*			trans	-100.5	164.9	159	41.5	0	0	0	0	109.9
196	S	38	Very low	44.8	Very low	103 Å²	103	142.1 Å²	142.1	72%	0.72	78%	0.776	S	S	*	*			cis	-166.2	-160.9	-18.5	-173.5	0	0	0	0	106.4
197	V	45.5	Very low	44.1	Very low	118 Å²	118	142.8 Å²	142.8	72%	0.715	78%	0.78	S	S	*	*			trans	59.2	119.3	166.9	-74.9	0	0	0	0	116.9
198	E	37.7	Very low	44	Very low	187 Å²	187	139.5 Å²	139.5	87%	0.874	78%	0.782	S	S	*	*				85.5	112.7	68.4	-77.1	-176	168.5	0	0	115.5
199	A	45.5	Very low	44.4	Very low	91 Å²	91	137 Å²	137	75%	0.752	78%	0.782	S	S	*	*			trans	169.7	131.7	159.2	0	0	0	0	0	106.2
200	E	38.7	Very low	44.4	Very low	161 Å²	161	136.1 Å²	136.1	75%	0.752	79%	0.789	S	S	*	*			cis	71.9	132.7	15.1	-140.9	-155.8	-176.5	0	0	117.4
201	R	48	Very low	44.5	Very low	195 Å²	195	129.2 Å²	129.2	74%	0.736	78%	0.779	S	S	*	*			trans	93.1	107.2	-168.6	-60.5	167.8	-169.8	75.7	7.2	112.8
202	T	46.2	Very low	45.1	Very low	119 Å²	119	130.1 Å²	130.1	73%	0.73	78%	0.784	S	S	*	*				78.3	105.7	57.9	65.4	0	0	0	0	114.7
203	D	45.4	Very low	45	Very low	151 Å²	151	130 Å²	130	81%	0.807	78%	0.784	S	S	*	*			trans	-163.9	122.8	134	-100	-39.4	0	0	0	108
204	T	44	Very low	44.8	Very low	117 Å²	117	127 Å²	127	72%	0.718	78%	0.78	S	S	*	*				85	94.5	76.8	-60.1	0	0	0	0	112
205	A	47.3	Very low	44.8	Very low	103 Å²	103	127.6 Å²	127.6	85%	0.851	78%	0.781	S	S	*	*			trans	-109.9	135.2	171.4	0	0	0	0	0	110.1
206	V	56.7	Low	45.5	Very low	134 Å²	134	127.6 Å²	127.6	81%	0.812	78%	0.779	S	S	*	*			trans	-93.6	138.7	-164.4	174.1	0	0	0	0	112.2
207	Q	43.7	Very low	45.9	Very low	179 Å²	179	130.1 Å²	130.1	84%	0.836	78%	0.783	S	S	*	*			trans	-79.1	137.6	166.6	-68.9	-178.2	-12.9	0	0	110.9
208	A	45	Very low	45.6	Very low	103 Å²	103	128.8 Å²	128.8	85%	0.851	78%	0.784	S	S	*	*			trans	-126	118.8	167.2	0	0	0	0	0	109.8
209	T	43.6	Very low	46	Very low	122 Å²	122	128.4 Å²	128.4	75%	0.748	78%	0.782	S	S	*	*			trans	-123.8	101.4	-175	35.3	0	0	0	0	112.5
210	G	45.1	Very low	46	Very low	73 Å²	73	135.5 Å²	135.5	75%	0.753	79%	0.789	S	S	*	*			trans	-97.2	132.4	152.9	0	0	0	0	0	108.6
211	S	46.2	Very low	45.8	Very low	108 Å²	108	131.3 Å²	131.3	76%	0.755	79%	0.789	S	S	*	*			cis	59.3	124.1	31.9	-43.1	0	0	0	0	111.1
212	V	56.2	Low	45.6	Very low	142 Å²	142	128.2 Å²	128.2	86%	0.861	79%	0.794	S	S	*	*			cis	-141.4	162.7	23	-121.5	0	0	0	0	111.2
213	P	46.2	Very low	45.4	Very low	109 Å²	109	127.6 Å²	127.6	71%	0.708	79%	0.794	S	S	*	*			trans	-119.3	-173.8	-163.3	43	-32.7	0	0	0	116.6
214	S	44.2	Very low	45.3	Very low	112 Å²	112	125.5 Å²	125.5	78%	0.783	79%	0.792	S	S	*	*			trans	104.1	136.3	148.3	-61.7	0	0	0	0	120
215	T	45.1	Very low	45.1	Very low	136 Å²	136	124.5 Å²	124.5	83%	0.834	79%	0.789	S	S	*	*			trans	-112.3	-165.5	166.2	60.9	0	0	0	0	109
216	P	47.4	Very low	45.2	Very low	116 Å²	116	126.5 Å²	126.5	75%	0.753	79%	0.785	S	S	*	*				-113.8	159.9	-111.9	32.8	-14.9	0	0	0	115
217	I	46.3	Very low	44.6	Very low	157 Å²	157	127.5 Å²	127.5	81%	0.805	79%	0.786	S	S	*	*			trans	-130.5	132.5	168.5	-64.8	-179.9	0	0	0	109.3
218	A	40.1	Very low	44.6	Very low	90 Å²	90	124.5 Å²	124.5	74%	0.744	78%	0.78	S	S	*	*			trans	-106.5	132.8	177.6	0	0	0	0	0	111.2
219	H	46.2	Very low	44.4	Very low	178 Å²	178	125.7 Å²	125.7	82%	0.824	78%	0.779	S	S	*	*			trans	-150	127	167.1	-87.4	-44.4	0	0	0	114.5
220	R	43.7	Very low	44.4	Very low	241 Å²	241	123.7 Å²	123.7	91%	0.909	78%	0.782	S	S	*	*			trans	75.1	100.1	132.1	-161.2	-180	-153.7	160	6.2	120.7
221	G	36.2	Very low	44.2	Very low	72 Å²	72	124.9 Å²	124.9	74%	0.742	78%	0.78	S	S	*	*				92.1	132	110	0	0	0	0	0	118.5
222	P	44	Very low	44	Very low	130 Å²	130	128.9 Å²	128.9	84%	0.844	78%	0.784	S	S	*	*			trans	-108.2	149.7	-172.9	39.3	-33.4	0	0	0	115.7
223	S	40.8	Very low	43.3	Very low	106 Å²	106	134 Å²	134	74%	0.741	79%	0.787	S	S	*	*			trans	-171.4	137.8	158.6	54.1	0	0	0	0	112.3
224	S	43.2	Very low	43.2	Very low	107 Å²	107	138.4 Å²	138.4	75%	0.748	79%	0.79	S	S	*	*			trans	39.7	139.5	146.1	57.4	0	0	0	0	121.8
225	S	40.8	Very low	42.8	Very low	96 Å²	96	136 Å²	136	67%	0.671	78%	0.783	S	S	*	*			cis	175.8	171.1	0.4	48.9	0	0	0	0	111.7
226	L	47.7	Very low	42.6	Very low	146 Å²	146	138.1 Å²	138.1	76%	0.764	79%	0.788	S	S	*	*			trans	81.9	159.8	158.7	-65.2	153.7	0	0	0	119.2
227	N	45.9	Very low	42.5	Very low	154 Å²	154	136.7 Å²	136.7	82%	0.824	77%	0.774	S	S	*	*			trans	87.8	88.9	-174.7	-55.1	-17.9	0	0	0	114.1
228	T	43.1	Very low	42.1	Very low	117 Å²	117	136.3 Å²	136.3	72%	0.718	77%	0.774	S	S	*	*			cis	82.5	132.5	36.6	-47	0	0	0	0	113.2
229	P	40.9	Very low	42.2	Very low	127 Å²	127	137.2 Å²	137.2	83%	0.825	77%	0.774	S	S	*	*			cis	-131.4	176.7	-24.1	39.2	-23.3	0	0	0	114.4
230	G	42.5	Very low	42.1	Very low	80 Å²	80	135.9 Å²	135.9	83%	0.825	78%	0.779	S	S	*	*			trans	177.4	108.3	162.3	0	0	0	0	0	119
231	S	41.8	Very low	42.3	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	77%	0.767	S	S	*	*				119.6	35.2	110.3	164.3	0	0	0	0	120.6
232	F	42.7	Very low	42.9	Very low	192 Å²	192	128 Å²	128	84%	0.842	77%	0.772	S	S	*	*			trans	70.4	119.2	160.5	-51.8	-61.6	0	0	0	120
233	R	40.5	Very low	43.9	Very low	249 Å²	249	127.7 Å²	127.7	94%	0.94	77%	0.769	S	S	*	*			trans	-87.6	144.4	139	-68.5	177.8	173	-176.7	-3.1	108.3
234	R	43.8	Very low	45.3	Very low	201 Å²	201	128.2 Å²	128.2	76%	0.758	77%	0.769	S	S	*	*			trans	-147.4	144	156.8	-156	167.2	-157.8	-113.9	-10.3	110.4	D237	R234-D237 VanDerWaalsContact CZ-CG 3.45Å; R234-D237 IonicContact CZ-OD1 3.72Å; R234-D237 IonicContact CZ-OD2 2.64Å; R234-D237 IonicContact NE-OD1 3.74Å; R234-D237 IonicContact NH1-OD1 3.92Å; R234-D237 PolarHBondContact NH1-OD1 3.1Å; R234-D237 IonicContact NH1-OD2 4Å; R234-D237 PolarHBondContact NH1-OD2 3.43Å; R234-D237 VanDerWaalsContact NH2-CG 3.3Å; R234-D237 IonicContact NH2-OD1 3.31Å; R234-D237 PolarHBondContact NH2-OD1 3.04Å; R234-D237 IonicContact NH2-OD2 2.74Å; R234-D237 PolarHBondContact NH2-OD2 3.14Å
235	G	36.5	Very low	46.9	Very low	61 Å²	61	128.3 Å²	128.3	63%	0.629	76%	0.761	S	S	*	*			trans	-148	150.4	172.4	0	0	0	0	0	110
236	L	41.3	Very low	49	Very low	181 Å²	181	127.8 Å²	127.8	95%	0.948	75%	0.754	S	S	*	*			trans	48.4	80.8	166.1	-166.3	71	0	0	0	116.8
237	D	43.5	Very low	50.8	Low	87 Å²	87	125.4 Å²	125.4	47%	0.465	75%	0.747	S	S	.	*			trans	-149.8	141.8	150	57.2	-47.8	0	0	0	112.1	R234	R234-D237 VanDerWaalsContact CZ-CG 3.45Å; R234-D237 IonicContact CZ-OD1 3.72Å; R234-D237 IonicContact CZ-OD2 2.64Å; R234-D237 IonicContact NE-OD1 3.74Å; R234-D237 IonicContact NH1-OD1 3.92Å; R234-D237 PolarHBondContact NH1-OD1 3.1Å; R234-D237 IonicContact NH1-OD2 4Å; R234-D237 PolarHBondContact NH1-OD2 3.43Å; R234-D237 VanDerWaalsContact NH2-CG 3.3Å; R234-D237 IonicContact NH2-OD1 3.31Å; R234-D237 PolarHBondContact NH2-OD1 3.04Å; R234-D237 IonicContact NH2-OD2 2.74Å; R234-D237 PolarHBondContact NH2-OD2 3.14Å
238	D	38.1	Very low	52.8	Low	148 Å²	148	121.5 Å²	121.5	79%	0.791	74%	0.736	S	S	*	*			trans	-64.2	132.7	-174.6	177.7	26.2	0	0	0	112.8
239	S	43.1	Very low	55	Low	109 Å²	109	117.9 Å²	117.9	76%	0.762	72%	0.718	S	S	*	*			trans	-164	115.5	166.4	-84.4	0	0	0	0	112.4	G241	S239-G241 PolarHBondContact O-N 2.94Å
240	T	43.4	Very low	57.4	Low	151 Å²	151	118.6 Å²	118.6	93%	0.926	70%	0.704	S	S	*	*			trans	-69.7	77.4	175.6	32.7	0	0	0	0	112.9
241	G	48.6	Very low	59.7	Low	64 Å²	64	119.6 Å²	119.6	66%	0.66	69%	0.69	S	S	*	*			trans	-114.8	95.5	175	0	0	0	0	0	112.8	S239 T243	S239-G241 PolarHBondContact O-N 2.94Å; G241-T243 PolarHBondContact O-N 2.7Å; G241-T243 VanDerWaalsContact O-N 3.13Å
242	G	48.5	Very low	62.1	Low	82 Å²	82	117.9 Å²	117.9	85%	0.845	68%	0.678	S	S	*	*			trans	-72.8	101.3	-171.2	0	0	0	0	0	115.1
243	T	64.3	Low	64.4	Low	125 Å²	125	111 Å²	111	77%	0.767	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-70.9	136.6	159.5	46.6	0	0	0	0	110	G241 L245	G241-T243 PolarHBondContact O-N 2.7Å; G241-T243 VanDerWaalsContact O-N 3.13Å; T243-L245 PolarHBondContact O-N 3.31Å
244	P	72	Confident	67	Low	116 Å²	116	104.5 Å²	104.5	75%	0.753	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-69.7	117.1	-178.6	26.7	-33.2	0	0	0	110.6	T246	P244-T246 PolarHBondContact O-N 3.06Å
245	L	75.6	Confident	69.3	Low	109 Å²	109	99.8 Å²	99.8	57%	0.571	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-51.6	128.5	176.6	-70.4	173.5	0	0	0	111.2	T243 A249 R250	T243-L245 PolarHBondContact O-N 3.31Å; L245-A249 HydrophobicContact CD2-CB 4.39Å; L245-R250 PolarHBondContact O-NH2 3.44Å
246	T	85.3	Confident	72	Confident	85 Å²	85	102 Å²	102	52%	0.521	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-56.6	151.7	176.9	65.7	0	0	0	0	110.5	P244 A248 A249 R250	P244-T246 PolarHBondContact O-N 3.06Å; T246-A248 PolarHBondContact O-N 2.79Å; T246-A249 PolarHBondContact O-N 2.89Å; T246-A249 VanDerWaalsContact O-N 3.07Å; T246-A249 WeakPolarHBondContact OG1-CB 3.27Å; T246-A249 PolarHBondContact OG1-N 3.15Å; T246-R250 PolarHBondContact O-N 3.46Å
247	P	85.6	Confident	74.6	Confident	97 Å²	97	97.1 Å²	97.1	63%	0.63	60%	0.603	S	S	*	*	H	α-helix	trans	-53.9	-39.6	179.4	-28.2	36.1	0	0	0	113	R250 I251	P247-R250 PolarHBondContact O-N 3.12Å; P247-I251 WeakPolarHBondContact O-CB 3.46Å; P247-I251 WeakPolarHBondContact O-CD1 3.28Å; P247-I251 VanDerWaalsContact O-CG1 3.25Å; P247-I251 WeakPolarHBondContact O-CG1 3.37Å; P247-I251 PolarHBondContact O-N 3.42Å
248	A	87.1	Confident	77	Confident	72 Å²	72	94.4 Å²	94.4	60%	0.595	60%	0.595	S	S	*	*	H	α-helix	trans	-64	-45.9	175.7	0	0	0	0	0	112.9	T246 R250 I251 S252	T246-A248 PolarHBondContact O-N 2.79Å; A248-R250 VanDerWaalsContact C-N 3.31Å; A248-R250 PolarHBondContact O-N 3Å; A248-I251 PolarHBondContact O-N 3.49Å; A248-S252 WeakPolarHBondContact O-CB 3.36Å; A248-S252 PolarHBondContact O-N 2.97Å
249	A	89.4	Confident	79.7	Confident	40 Å²	40	90.8 Å²	90.8	33%	0.331	58%	0.576	S	S	.	*	H	α-helix	trans	-63	-38.5	176.2	0	0	0	0	0	111.7	L245 T246 A253	L245-A249 HydrophobicContact CD2-CB 4.39Å; T246-A249 PolarHBondContact O-N 2.89Å; T246-A249 VanDerWaalsContact O-N 3.07Å; T246-A249 WeakPolarHBondContact OG1-CB 3.27Å; T246-A249 PolarHBondContact OG1-N 3.15Å; A249-A253 WeakPolarHBondContact O-CB 3.34Å; A249-A253 PolarHBondContact O-N 2.77Å
250	R	91.8	Very high	82.2	Confident	142 Å²	142	90.7 Å²	90.7	54%	0.536	57%	0.567	S	S	.	*	H	α-helix	trans	-65.5	-45.6	176.7	-165.6	-175.8	-53.8	-169.6	3.7	112.3	L245 T246 P247 A248 A253 L254	L245-R250 PolarHBondContact O-NH2 3.44Å; T246-R250 PolarHBondContact O-N 3.46Å; P247-R250 PolarHBondContact O-N 3.12Å; A248-R250 VanDerWaalsContact C-N 3.31Å; A248-R250 PolarHBondContact O-N 3Å; R250-A253 PolarHBondContact O-N 3.22Å; R250-L254 HydrophobicContact CG-CD1 4.29Å; R250-L254 WeakPolarHBondContact O-CB 3.39Å; R250-L254 VanDerWaalsContact O-CG 3.29Å; R250-L254 WeakPolarHBondContact O-CG 3.15Å; R250-L254 PolarHBondContact O-N 2.89Å
251	I	89.9	Confident	84.8	Confident	102 Å²	102	89.2 Å²	89.2	52%	0.523	55%	0.552	S	S	.	*	H	α-helix	trans	-65.1	-42.7	177	-68.3	163.3	0	0	0	110.5	P247 A248 L254 N255	P247-I251 WeakPolarHBondContact O-CB 3.46Å; P247-I251 WeakPolarHBondContact O-CD1 3.28Å; P247-I251 VanDerWaalsContact O-CG1 3.25Å; P247-I251 WeakPolarHBondContact O-CG1 3.37Å; P247-I251 PolarHBondContact O-N 3.42Å; A248-I251 PolarHBondContact O-N 3.49Å; I251-L254 PolarHBondContact O-N 2.76Å; I251-N255 WeakPolarHBondContact O-CB 3.5Å; I251-N255 PolarHBondContact O-N 2.94Å
252	S	93	Very high	86.9	Confident	63 Å²	63	94.3 Å²	94.3	44%	0.441	55%	0.552	S	S	.	*	H	α-helix	trans	-59.3	-49	175.5	-173.8	0	0	0	0	111.8	A248 L254 N255 I256	A248-S252 WeakPolarHBondContact O-CB 3.36Å; A248-S252 PolarHBondContact O-N 2.97Å; S252-L254 PolarHBondContact O-N 2.96Å; S252-N255 PolarHBondContact O-N 3.19Å; S252-I256 VanDerWaalsContact O-CG1 3.3Å; S252-I256 WeakPolarHBondContact O-CG1 3.48Å; S252-I256 PolarHBondContact O-N 2.86Å
253	A	91.9	Very high	89.2	Confident	47 Å²	47	96.8 Å²	96.8	39%	0.388	54%	0.539	S	S	.	.	H	α-helix	trans	-60.5	-42.2	176.4	0	0	0	0	0	112.7	A249 R250 I256 V257	A249-A253 WeakPolarHBondContact O-CB 3.34Å; A249-A253 PolarHBondContact O-N 2.77Å; R250-A253 PolarHBondContact O-N 3.22Å; A253-I256 PolarHBondContact O-N 3.39Å; A253-V257 WeakPolarHBondContact O-CG2 3.48Å; A253-V257 PolarHBondContact O-N 3.09Å
254	L	94.3	Very high	90.7	Very high	113 Å²	113	93.9 Å²	93.9	59%	0.592	52%	0.521	S	S	*	.	H	α-helix	trans	-64.9	-39.4	176.6	-73.9	169.2	0	0	0	112.5	R250 I251 S252 V257 G258	R250-L254 HydrophobicContact CG-CD1 4.29Å; R250-L254 WeakPolarHBondContact O-CB 3.39Å; R250-L254 VanDerWaalsContact O-CG 3.29Å; R250-L254 WeakPolarHBondContact O-CG 3.15Å; R250-L254 PolarHBondContact O-N 2.89Å; I251-L254 PolarHBondContact O-N 2.76Å; S252-L254 PolarHBondContact O-N 2.96Å; L254-V257 PolarHBondContact O-N 3.26Å; L254-G258 PolarHBondContact O-N 3.45Å
255	N	92.5	Very high	91.7	Very high	102 Å²	102	90 Å²	90	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-64.5	-45.2	174.5	-74.5	-9.8	0	0	0	111.4	I251 S252 V257 G258 D259	I251-N255 WeakPolarHBondContact O-CB 3.5Å; I251-N255 PolarHBondContact O-N 2.94Å; S252-N255 PolarHBondContact O-N 3.19Å; N255-V257 PolarHBondContact O-N 2.94Å; N255-G258 PolarHBondContact O-N 3.44Å; N255-D259 PolarHBondContact O-N 2.87Å
256	I	93.2	Very high	92.5	Very high	107 Å²	107	87.4 Å²	87.4	55%	0.549	50%	0.496	S	S	.	.	H	α-helix	trans	-59.2	-46.5	176.5	-68.2	163.4	0	0	0	110.5	S252 A253 D259 L260	S252-I256 VanDerWaalsContact O-CG1 3.3Å; S252-I256 WeakPolarHBondContact O-CG1 3.48Å; S252-I256 PolarHBondContact O-N 2.86Å; A253-I256 PolarHBondContact O-N 3.39Å; I256-D259 PolarHBondContact O-N 2.77Å; I256-L260 WeakPolarHBondContact O-CB 3.41Å; I256-L260 PolarHBondContact O-N 3.31Å
257	V	94.8	Very high	93	Very high	79 Å²	79	88.8 Å²	88.8	48%	0.479	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-41.9	176.6	170.3	0	0	0	0	111.6	A253 L254 N255 L260 L261	A253-V257 WeakPolarHBondContact O-CG2 3.48Å; A253-V257 PolarHBondContact O-N 3.09Å; L254-V257 PolarHBondContact O-N 3.26Å; N255-V257 PolarHBondContact O-N 2.94Å; V257-L260 PolarHBondContact O-N 2.95Å; V257-L261 HydrophobicContact CG1-CD1 4.03Å; V257-L261 HydrophobicContact CG1-CG 4.43Å; V257-L261 WeakPolarHBondContact O-CG 3.32Å; V257-L261 PolarHBondContact O-N 3.5Å
258	G	94.6	Very high	93.3	Very high	29 Å²	29	90.3 Å²	90.3	30%	0.299	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-41	177.2	0	0	0	0	0	113.3	L254 N255 R262	L254-G258 PolarHBondContact O-N 3.45Å; N255-G258 PolarHBondContact O-N 3.44Å; G258-R262 WeakPolarHBondContact O-CB 3.22Å; G258-R262 PolarHBondContact O-N 2.66Å
259	D	95.2	Very high	93.5	Very high	73 Å²	73	90.8 Å²	90.8	39%	0.39	50%	0.498	S	S	.	.	H	α-helix	trans	-71	-34	174.1	-80	-3	0	0	0	112.3	N255 I256 R262 K263	N255-D259 PolarHBondContact O-N 2.87Å; I256-D259 PolarHBondContact O-N 2.77Å; D259-R262 PolarHBondContact O-N 2.75Å; D259-R262 IonicContact OD1-CZ 3.71Å; D259-R262 VanDerWaalsContact OD1-CZ 3.3Å; D259-R262 IonicContact OD1-NH1 3.35Å; D259-R262 PolarHBondContact OD1-NH1 3.41Å; D259-R262 IonicContact OD1-NH2 2.76Å; D259-R262 PolarHBondContact OD1-NH2 3.4Å; D259-K263 WeakPolarHBondContact O-CB 3.42Å; D259-K263 WeakPolarHBondContact O-CD 3.22Å; D259-K263 VanDerWaalsContact O-CG 3.23Å; D259-K263 WeakPolarHBondContact O-CG 3.44Å; D259-K263 PolarHBondContact O-N 3.47Å
260	L	96.4	Very high	93.6	Very high	107 Å²	107	96 Å²	96	56%	0.56	51%	0.513	S	S	*	.	H	α-helix	trans	-64.6	-47	173.9	-147	75	0	0	0	111	I256 V257 R262 K263 V264	I256-L260 WeakPolarHBondContact O-CB 3.41Å; I256-L260 PolarHBondContact O-N 3.31Å; V257-L260 PolarHBondContact O-N 2.95Å; L260-R262 VanDerWaalsContact C-N 3.33Å; L260-R262 PolarHBondContact O-N 3Å; L260-K263 WeakPolarHBondContact O-CB 3.44Å; L260-K263 PolarHBondContact O-N 2.88Å; L260-V264 WeakPolarHBondContact O-CG2 3.48Å; L260-V264 PolarHBondContact O-N 3.3Å
261	L	96.2	Very high	93.6	Very high	119 Å²	119	95.2 Å²	95.2	62%	0.623	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-40.9	174.7	-71.3	170	0	0	0	111.7	V257 K263 V264 G265	V257-L261 HydrophobicContact CG1-CD1 4.03Å; V257-L261 HydrophobicContact CG1-CG 4.43Å; V257-L261 WeakPolarHBondContact O-CG 3.32Å; V257-L261 PolarHBondContact O-N 3.5Å; L261-K263 PolarHBondContact O-N 3.07Å; L261-V264 PolarHBondContact O-N 2.88Å; L261-G265 PolarHBondContact O-N 2.97Å
262	R	94.3	Very high	93.4	Very high	171 Å²	171	92.8 Å²	92.8	65%	0.645	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-36.9	175.9	-156.4	-177.3	-52.9	114.9	14	112.3	G258 D259 L260 A266	G258-R262 WeakPolarHBondContact O-CB 3.22Å; G258-R262 PolarHBondContact O-N 2.66Å; D259-R262 PolarHBondContact O-N 2.75Å; D259-R262 IonicContact OD1-CZ 3.71Å; D259-R262 VanDerWaalsContact OD1-CZ 3.3Å; D259-R262 IonicContact OD1-NH1 3.35Å; D259-R262 PolarHBondContact OD1-NH1 3.41Å; D259-R262 IonicContact OD1-NH2 2.76Å; D259-R262 PolarHBondContact OD1-NH2 3.4Å; L260-R262 VanDerWaalsContact C-N 3.33Å; L260-R262 PolarHBondContact O-N 3Å; R262-A266 WeakPolarHBondContact O-CB 3.42Å; R262-A266 PolarHBondContact O-N 3.02Å
263	K	95.9	Very high	93	Very high	135 Å²	135	92.9 Å²	92.9	59%	0.587	51%	0.514	S	S	*	.	H	α-helix	trans	-68.5	-41.1	173.3	-72.9	164.5	-175	-73.2	0	112	D259 L260 L261 A266 L267	D259-K263 WeakPolarHBondContact O-CB 3.42Å; D259-K263 WeakPolarHBondContact O-CD 3.22Å; D259-K263 VanDerWaalsContact O-CG 3.23Å; D259-K263 WeakPolarHBondContact O-CG 3.44Å; D259-K263 PolarHBondContact O-N 3.47Å; L260-K263 WeakPolarHBondContact O-CB 3.44Å; L260-K263 PolarHBondContact O-N 2.88Å; L261-K263 PolarHBondContact O-N 3.07Å; K263-A266 PolarHBondContact O-N 3.05Å; K263-L267 WeakPolarHBondContact O-CG 3.21Å; K263-L267 PolarHBondContact O-N 3.07Å
264	V	95.1	Very high	92.4	Very high	63 Å²	63	94.4 Å²	94.4	38%	0.382	52%	0.521	S	S	.	.	H	α-helix	trans	-63.5	-50.1	176.5	169.9	0	0	0	0	110.8	L260 L261 A266 L267 E268	L260-V264 WeakPolarHBondContact O-CG2 3.48Å; L260-V264 PolarHBondContact O-N 3.3Å; L261-V264 PolarHBondContact O-N 2.88Å; V264-A266 VanDerWaalsContact C-N 3.26Å; V264-A266 PolarHBondContact O-N 3.48Å; V264-L267 CarbonylContact O-C 3.57Å; V264-L267 WeakPolarHBondContact O-CA 3.12Å; V264-L267 WeakPolarHBondContact O-CB 3.36Å; V264-L267 PolarHBondContact O-N 3.1Å; V264-E268 HydrophobicContact CG1-CG 4.25Å; V264-E268 WeakPolarHBondContact O-CG 3.33Å; V264-E268 PolarHBondContact O-N 2.91Å
265	G	93.8	Very high	91.8	Very high	34 Å²	34	96.9 Å²	96.9	35%	0.351	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-33.5	177.1	0	0	0	0	0	113.6	L261 S269	L261-G265 PolarHBondContact O-N 2.97Å; G265-S269 VanDerWaalsContact O-CB 3.31Å; G265-S269 WeakPolarHBondContact O-CB 3.46Å; G265-S269 PolarHBondContact O-N 3.29Å
266	A	93	Very high	90.9	Very high	55 Å²	55	97 Å²	97	46%	0.455	52%	0.524	S	S	.	.	H	α-helix	trans	-69.9	-34.4	172.4	0	0	0	0	0	113	R262 K263 V264 K270	R262-A266 WeakPolarHBondContact O-CB 3.42Å; R262-A266 PolarHBondContact O-N 3.02Å; K263-A266 PolarHBondContact O-N 3.05Å; V264-A266 VanDerWaalsContact C-N 3.26Å; V264-A266 PolarHBondContact O-N 3.48Å; A266-K270 WeakPolarHBondContact O-CG 3.26Å; A266-K270 PolarHBondContact O-N 2.87Å; A266-K270 VanDerWaalsContact O-N 3.15Å
267	L	94.8	Very high	89.8	Confident	114 Å²	114	96.4 Å²	96.4	60%	0.597	52%	0.521	S	S	*	.	H	α-helix	trans	-69.6	-45.1	172.5	-81	162.4	0	0	0	111.6	K263 V264 S269 K270 L271	K263-L267 WeakPolarHBondContact O-CG 3.21Å; K263-L267 PolarHBondContact O-N 3.07Å; V264-L267 CarbonylContact O-C 3.57Å; V264-L267 WeakPolarHBondContact O-CA 3.12Å; V264-L267 WeakPolarHBondContact O-CB 3.36Å; V264-L267 PolarHBondContact O-N 3.1Å; L267-S269 PolarHBondContact O-N 2.88Å; L267-K270 PolarHBondContact O-N 3.15Å; L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 3.35Å
268	E	92.5	Very high	88.3	Confident	129 Å²	129	97.6 Å²	97.6	60%	0.603	53%	0.528	S	S	*	.	H	α-helix	trans	-60.7	-43.3	176.3	-71	178.1	150	0	0	111.6	V264 L271 A272	V264-E268 HydrophobicContact CG1-CG 4.25Å; V264-E268 WeakPolarHBondContact O-CG 3.33Å; V264-E268 PolarHBondContact O-N 2.91Å; E268-L271 PolarHBondContact O-N 3.06Å; E268-A272 WeakPolarHBondContact O-CB 3.38Å; E268-A272 PolarHBondContact O-N 3.24Å
269	S	90.2	Very high	86.7	Confident	82 Å²	82	104.1 Å²	104.1	57%	0.573	55%	0.545	S	S	*	.	H	α-helix	trans	-59.9	-44.7	173.8	179.9	0	0	0	0	112.3	G265 L267 S273	G265-S269 VanDerWaalsContact O-CB 3.31Å; G265-S269 WeakPolarHBondContact O-CB 3.46Å; G265-S269 PolarHBondContact O-N 3.29Å; L267-S269 PolarHBondContact O-N 2.88Å; S269-S273 WeakPolarHBondContact O-CB 3.4Å; S269-S273 PolarHBondContact O-N 3.37Å
270	K	92.2	Very high	84.9	Confident	151 Å²	151	107.7 Å²	107.7	66%	0.657	56%	0.564	S	S	*	*	H	α-helix	trans	-63.3	-42	173	-78.3	-174.2	175.4	-170.5	0	112.4	A266 L267 S273 C274	A266-K270 WeakPolarHBondContact O-CG 3.26Å; A266-K270 PolarHBondContact O-N 2.87Å; A266-K270 VanDerWaalsContact O-N 3.15Å; L267-K270 PolarHBondContact O-N 3.15Å; K270-S273 WeakPolarHBondContact O-CB 3.42Å; K270-S273 PolarHBondContact O-N 3.44Å; K270-C274 PolarHBondContact O-N 2.83Å; K270-C274 PolarHBondContact O-SG 3.17Å
271	L	90.8	Very high	82.9	Confident	124 Å²	124	109.7 Å²	109.7	65%	0.649	57%	0.57	S	S	*	*	H	α-helix	trans	-68.7	-37.8	-178	-154.2	160.7	0	0	0	111	L267 E268 C274 R275	L267-L271 WeakPolarHBondContact O-CB 3.39Å; L267-L271 PolarHBondContact O-N 3.35Å; E268-L271 PolarHBondContact O-N 3.06Å; L271-C274 PolarHBondContact O-N 2.76Å; L271-R275 WeakPolarHBondContact O-CB 3.49Å; L271-R275 PolarHBondContact O-N 2.98Å
272	A	87.4	Confident	80.1	Confident	51 Å²	51	108 Å²	108	42%	0.421	57%	0.569	S	S	.	*	H	α-helix	trans	-62.5	-43.7	169.4	0	0	0	0	0	112	E268 R275 N276	E268-A272 WeakPolarHBondContact O-CB 3.38Å; E268-A272 PolarHBondContact O-N 3.24Å; A272-R275 PolarHBondContact O-N 2.98Å; A272-N276 PolarHBondContact O-N 2.92Å
273	S	83.5	Confident	77.7	Confident	65 Å²	65	104.8 Å²	104.8	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-61.1	-45.4	174.4	-178.3	0	0	0	0	112.1	S269 K270 R275 N276 L277	S269-S273 WeakPolarHBondContact O-CB 3.4Å; S269-S273 PolarHBondContact O-N 3.37Å; K270-S273 WeakPolarHBondContact O-CB 3.42Å; K270-S273 PolarHBondContact O-N 3.44Å; S273-R275 VanDerWaalsContact C-N 3.33Å; S273-R275 PolarHBondContact O-N 2.91Å; S273-N276 PolarHBondContact O-N 3.07Å; S273-L277 WeakPolarHBondContact O-CD1 3.29Å; S273-L277 PolarHBondContact O-N 3.25Å
274	C	80.2	Confident	75	Confident	79 Å²	79	105.2 Å²	105.2	53%	0.534	58%	0.579	S	S	.	*	H	α-helix	trans	-60.6	-40.1	173.4	-67.9	0	0	0	0	112.2	K270 L271 N276 L277 V278	K270-C274 PolarHBondContact O-N 2.83Å; K270-C274 PolarHBondContact O-SG 3.17Å; L271-C274 PolarHBondContact O-N 2.76Å; C274-N276 VanDerWaalsContact C-N 3.34Å; C274-N276 PolarHBondContact O-N 3.07Å; C274-L277 PolarHBondContact O-N 3.43Å; C274-V278 WeakPolarHBondContact O-CG2 3.39Å; C274-V278 PolarHBondContact O-N 2.83Å
275	R	80.4	Confident	72.5	Confident	165 Å²	165	114 Å²	114	62%	0.623	61%	0.605	S	S	*	*	H	α-helix	trans	-64	-38.7	176.9	-169.4	173.2	-175.6	156.8	2.1	111.9	L271 A272 S273 V278 Y279	L271-R275 WeakPolarHBondContact O-CB 3.49Å; L271-R275 PolarHBondContact O-N 2.98Å; A272-R275 PolarHBondContact O-N 2.98Å; S273-R275 VanDerWaalsContact C-N 3.33Å; S273-R275 PolarHBondContact O-N 2.91Å; R275-V278 PolarHBondContact O-N 2.76Å; R275-Y279 HydrophobicContact CG-CD2 4.46Å; R275-Y279 WeakPolarHBondContact O-CD2 3.36Å; R275-Y279 PolarHBondContact O-N 2.93Å
276	N	75.5	Confident	70	Confident	106 Å²	106	119.3 Å²	119.3	57%	0.567	63%	0.631	S	S	*	*	H	α-helix	trans	-66	-46.6	173.1	-68.2	-5.2	0	0	0	111.2	A272 S273 C274 V278 Y279 D280	A272-N276 PolarHBondContact O-N 2.92Å; S273-N276 PolarHBondContact O-N 3.07Å; C274-N276 VanDerWaalsContact C-N 3.34Å; C274-N276 PolarHBondContact O-N 3.07Å; N276-V278 PolarHBondContact O-N 3.03Å; N276-Y279 PolarHBondContact O-N 3.47Å; N276-D280 PolarHBondContact O-N 3.39Å
277	L	69.5	Low	67.5	Low	94 Å²	94	120.7 Å²	120.7	49%	0.492	65%	0.65	S	S	.	*	H	α-helix	trans	-58.9	-31.9	176.3	-101	75.4	0	0	0	113.7	S273 C274 Q281	S273-L277 WeakPolarHBondContact O-CD1 3.29Å; S273-L277 PolarHBondContact O-N 3.25Å; C274-L277 PolarHBondContact O-N 3.43Å; L277-Q281 WeakPolarHBondContact O-CB 3.32Å; L277-Q281 WeakPolarHBondContact O-CG 3.43Å; L277-Q281 PolarHBondContact O-N 2.86Å; L277-Q281 PolarHBondContact O-NE2 3.49Å
278	V	63.9	Low	65	Low	103 Å²	103	118.3 Å²	118.3	62%	0.624	65%	0.653	S	S	*	*	H	α-helix	trans	-76.7	-28.7	176.3	168.8	0	0	0	0	112	C274 R275 N276	C274-V278 WeakPolarHBondContact O-CG2 3.39Å; C274-V278 PolarHBondContact O-N 2.83Å; R275-V278 PolarHBondContact O-N 2.76Å; N276-V278 PolarHBondContact O-N 3.03Å
279	Y	60.1	Low	62.6	Low	166 Å²	166	118.8 Å²	118.8	65%	0.651	67%	0.668	S	S	*	*	H	α-helix	trans	-79.7	-40.3	173.2	-93.6	-95.6	0	0	0	112.7	R275 N276 Q281 S282	R275-Y279 HydrophobicContact CG-CD2 4.46Å; R275-Y279 WeakPolarHBondContact O-CD2 3.36Å; R275-Y279 PolarHBondContact O-N 2.93Å; N276-Y279 PolarHBondContact O-N 3.47Å; Y279-Q281 VanDerWaalsContact C-N 3.31Å; Y279-Q281 PolarHBondContact O-N 3.42Å; Y279-S282 WeakPolarHBondContact O-CB 3.48Å; Y279-S282 PolarHBondContact O-N 3.05Å; Y279-S282 VanDerWaalsContact O-N 3.16Å
280	D	57.2	Low	60.5	Low	149 Å²	149	119.8 Å²	119.8	80%	0.797	68%	0.68	S	S	*	*	H	α-helix	trans	-66.8	-29.7	175.8	-95.7	-32.5	0	0	0	112.9	N276 S282	N276-D280 PolarHBondContact O-N 3.39Å; D280-S282 VanDerWaalsContact C-N 3.25Å; D280-S282 PolarHBondContact O-N 3.37Å
281	Q	54.5	Low	58.4	Low	148 Å²	148	118.9 Å²	118.9	69%	0.692	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	16.4	174.2	-70.2	173.9	97.7	0	0	113.5	L277 Y279 P283	L277-Q281 WeakPolarHBondContact O-CB 3.32Å; L277-Q281 WeakPolarHBondContact O-CG 3.43Å; L277-Q281 PolarHBondContact O-N 2.86Å; L277-Q281 PolarHBondContact O-NE2 3.49Å; Y279-Q281 VanDerWaalsContact C-N 3.31Å; Y279-Q281 PolarHBondContact O-N 3.42Å; Q281-P283 WeakPolarHBondContact O-CD 3.46Å
282	S	37.3	Very low	56.1	Low	84 Å²	84	116.1 Å²	116.1	59%	0.587	70%	0.695	S	S	*	*			trans	-103	89.6	173.6	-164	0	0	0	0	110.9	Y279 D280	Y279-S282 WeakPolarHBondContact O-CB 3.48Å; Y279-S282 PolarHBondContact O-N 3.05Å; Y279-S282 VanDerWaalsContact O-N 3.16Å; D280-S282 VanDerWaalsContact C-N 3.25Å; D280-S282 PolarHBondContact O-N 3.37Å
283	P	44.7	Very low	54.1	Low	104 Å²	104	125.3 Å²	125.3	68%	0.675	72%	0.718	S	S	*	*			trans	-66.3	148.5	178.2	27.6	-34.9	0	0	0	111.9	Q281	Q281-P283 WeakPolarHBondContact O-CD 3.46Å
284	N	39.3	Very low	52.3	Low	144 Å²	144	127.3 Å²	127.3	77%	0.77	73%	0.732	S	S	*	*			trans	69.3	79.4	169.6	-57.2	-29.8	0	0	0	117.7
285	R	41.4	Very low	50.7	Low	248 Å²	248	127.7 Å²	127.7	94%	0.936	74%	0.736	S	S	*	*			trans	-157.9	46.6	142.3	-111.4	159.9	-154.1	-100.8	1.9	114.9	G287	R285-G287 PolarHBondContact O-N 2.9Å
286	T	42.8	Very low	49.5	Very low	145 Å²	145	128.4 Å²	128.4	89%	0.89	74%	0.743	S	S	*	*			trans	-69.3	84.7	169.8	26	0	0	0	0	112.1	G288	T286-G288 PolarHBondContact O-N 3.23Å
287	G	39	Very low	48.3	Very low	84 Å²	84	129.4 Å²	129.4	87%	0.866	75%	0.749	S	S	*	*			trans	-87.5	91	173.1	0	0	0	0	0	112.8	R285	R285-G287 PolarHBondContact O-N 2.9Å
288	G	43.6	Very low	47.4	Very low	64 Å²	64	135.2 Å²	135.2	66%	0.66	76%	0.764	S	S	*	*			trans	-109.5	144.7	169.6	0	0	0	0	0	111.6	T286	T286-G288 PolarHBondContact O-N 3.23Å
289	P	41.3	Very low	46.7	Very low	139 Å²	139	136.8 Å²	136.8	90%	0.903	77%	0.769	S	S	*	*			trans	-89	120.8	-163.3	32.7	-34.7	0	0	0	114.6
290	A	45.5	Very low	46.1	Very low	102 Å²	102	132.3 Å²	132.3	84%	0.843	77%	0.773	S	S	*	*			trans	-147.1	129.2	162.5	0	0	0	0	0	113.1
291	S	47.9	Very low	45.5	Very low	133 Å²	133	128.9 Å²	128.9	93%	0.93	77%	0.773	S	S	*	*			trans	-46.7	146.4	178.9	-174.9	0	0	0	0	117.8
292	G	43.6	Very low	45.2	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	78%	0.778	S	S	*	*			trans	152.5	92	147.7	0	0	0	0	0	119.9
293	R	45.6	Very low	45.6	Very low	245 Å²	245	136.3 Å²	136.3	93%	0.925	79%	0.79	S	S	*	*			trans	58.2	120.2	157.1	-69.1	172.5	164.2	170.9	-7.3	117.8
294	S	45.2	Very low	45.8	Very low	107 Å²	107	141.6 Å²	141.6	75%	0.748	80%	0.796	S	S	*	*				69.9	125.9	68.4	-167.9	0	0	0	0	113
295	S	46.9	Very low	46.1	Very low	87 Å²	87	140.7 Å²	140.7	61%	0.608	80%	0.798	S	S	*	*			cis	-163.2	157.9	9.2	-110.9	0	0	0	0	113.6
296	K	55.4	Low	46.5	Very low	179 Å²	179	133.1 Å²	133.1	78%	0.778	78%	0.783	S	S	*	*			trans	51	127.9	144.4	-62	172.2	-176.5	177.6	0	118.5
297	N	49.7	Very low	46.6	Very low	128 Å²	128	131.9 Å²	131.9	68%	0.684	78%	0.78	S	S	*	*				-171.5	142.3	59.6	-110.9	-23.1	0	0	0	109.8
298	R	49.9	Very low	47.3	Very low	215 Å²	215	134.6 Å²	134.6	81%	0.811	78%	0.78	S	S	*	*				63.4	141.9	104	-88.1	-172.3	161.4	167.5	1	117.1
299	D	50.1	Low	47.5	Very low	136 Å²	136	136.7 Å²	136.7	73%	0.727	79%	0.785	S	S	*	*			cis	-160.3	165.7	-2.5	-142.2	-31.7	0	0	0	111.5
300	G	47.6	Very low	47.8	Very low	72 Å²	72	136.6 Å²	136.6	74%	0.742	78%	0.781	S	S	*	*			trans	57.3	138.6	158.3	0	0	0	0	0	122
301	G	44.2	Very low	47.7	Very low	77 Å²	77	136.8 Å²	136.8	79%	0.794	77%	0.774	S	S	*	*			cis	117.3	74	-23.5	0	0	0	0	0	119.2
302	E	48.3	Very low	47.6	Very low	170 Å²	170	138.7 Å²	138.7	79%	0.794	77%	0.773	S	S	*	*			trans	-158.3	124.1	149.3	-90.2	-150	121.7	0	0	110.4
303	R	45.8	Very low	47.4	Very low	219 Å²	219	139 Å²	139	83%	0.826	78%	0.775	S	S	*	*				77.9	101.9	79.9	-71.4	-168	-170.4	-158.2	0.8	116.7
304	R	49.6	Very low	47.3	Very low	215 Å²	215	134.5 Å²	134.5	81%	0.811	77%	0.77	S	S	*	*				178.5	121.7	120.2	-100.3	-174.9	81.3	170.4	5.4	112.8	S306	R304-S306 PolarHBondContact NE-OG 2.97Å; R304-S306 PolarHBondContact NH2-OG 3Å
305	P	44.1	Very low	47.7	Very low	125 Å²	125	139.2 Å²	139.2	81%	0.812	78%	0.777	S	S	*	*			trans	-97.7	152.9	146.3	35.1	-29.1	0	0	0	110.1
306	S	51.4	Low	47.4	Very low	88 Å²	88	138.2 Å²	138.2	62%	0.615	78%	0.781	S	S	*	*			trans	-152.4	110.2	168.8	-63.8	0	0	0	0	109.7	R304	R304-S306 PolarHBondContact NE-OG 2.97Å; R304-S306 PolarHBondContact NH2-OG 3Å
307	S	43.7	Very low	47	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	78%	0.783	S	S	*	*			trans	-86	142.5	177.4	51.6	0	0	0	0	111.7
308	T	54.2	Low	46.8	Very low	142 Å²	142	138.4 Å²	138.4	87%	0.871	79%	0.789	S	S	*	*			trans	-133.3	125.2	162.9	-50	0	0	0	0	109.3
309	S	47.2	Very low	46.8	Very low	107 Å²	107	133.9 Å²	133.9	75%	0.748	79%	0.785	S	S	*	*			trans	-117.2	127	-174.3	54.5	0	0	0	0	111.8
310	V	47.6	Very low	46.7	Very low	138 Å²	138	132.2 Å²	132.2	84%	0.836	79%	0.785	S	S	*	*			trans	-144.3	132.3	156.5	-170.2	0	0	0	0	108.4
311	P	43.4	Very low	46.6	Very low	105 Å²	105	134.9 Å²	134.9	68%	0.682	79%	0.791	S	S	*	*			trans	-103	-160.9	178.6	38.2	-30.7	0	0	0	112.9
312	L	45.5	Very low	46.7	Very low	173 Å²	173	141.4 Å²	141.4	91%	0.906	79%	0.791	S	S	*	*			trans	75.8	144.9	-169	-66.9	72.7	0	0	0	113.6
313	G	39.6	Very low	46.9	Very low	71 Å²	71	145.7 Å²	145.7	73%	0.732	80%	0.8	S	S	*	*			cis	166.6	133.8	-7.3	0	0	0	0	0	112.5
314	D	43.1	Very low	47.1	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	79%	0.794	S	S	*	*			trans	34.3	104.2	165.5	-173.7	27.7	0	0	0	119.5
315	K	54.2	Low	46.9	Very low	206 Å²	206	137.3 Å²	137.3	90%	0.896	80%	0.797	S	S	*	*			trans	-146.1	120.4	132.6	-69.8	-161	177.9	-179.4	0	110.2
316	G	41.1	Very low	47.3	Very low	66 Å²	66	140 Å²	140	68%	0.68	80%	0.796	S	S	*	*			trans	-73.6	147	167.1	0	0	0	0	0	112.5
317	L	47.2	Very low	47.1	Very low	159 Å²	159	141.2 Å²	141.2	83%	0.832	81%	0.805	S	S	*	*			trans	-135	110.9	163.9	-77.9	178.3	0	0	0	110
318	D	44.4	Very low	47.9	Very low	152 Å²	152	142.3 Å²	142.3	81%	0.813	81%	0.806	S	S	*	*			trans	-59.9	133.5	152.7	168.4	18.3	0	0	0	108.5	S320	D318-S320 PolarHBondContact OD1-N 3.08Å
319	T	51.4	Low	48.3	Very low	119 Å²	119	141.9 Å²	141.9	73%	0.73	80%	0.804	S	S	*	*			trans	-153	83.2	165.9	-26.4	0	0	0	0	112.8
320	S	47.7	Very low	48.7	Very low	102 Å²	102	148.8 Å²	148.8	71%	0.713	81%	0.813	S	S	*	*			trans	-5.5	124.6	151.6	-173.8	0	0	0	0	117.3	D318 R322	D318-S320 PolarHBondContact OD1-N 3.08Å; S320-R322 PolarHBondContact O-N 3.08Å
321	C	44.6	Very low	49.4	Very low	128 Å²	128	147.8 Å²	147.8	87%	0.865	81%	0.812	S	S	*	*			trans	-56.9	126.5	176.5	-63.5	0	0	0	0	113.3
322	R	46.3	Very low	50.2	Low	213 Å²	213	148.4 Å²	148.4	80%	0.804	82%	0.819	S	S	*	*			trans	-130.8	92.8	172.9	-176.1	-173.2	-66.9	-105.6	-2.6	111.7	S320	S320-R322 PolarHBondContact O-N 3.08Å
323	W	53.8	Low	50.9	Low	261 Å²	261	146 Å²	146	99%	0.989	82%	0.817	S	S	*	*			trans	-93.7	109.9	160.9	-82.8	95.1	0	0	0	109.4
324	L	49.5	Very low	52	Low	133 Å²	133	147.8 Å²	147.8	70%	0.696	82%	0.818	S	S	*	*			trans	-112.6	108.4	178.9	-158.2	81.2	0	0	0	109.8	K326	L324-K326 PolarHBondContact O-N 2.99Å
325	S	45.8	Very low	52.6	Low	124 Å²	124	150.1 Å²	150.1	87%	0.867	84%	0.844	S	S	*	*			trans	-82.8	107.6	-173.8	-171.2	0	0	0	0	112.9
326	K	51.3	Low	52.5	Low	181 Å²	181	147.4 Å²	147.4	79%	0.787	84%	0.842	S	S	*	*			trans	-149.5	141.5	159.3	-59.9	-170.6	178.8	-178.1	0	106.4	L324	L324-K326 PolarHBondContact O-N 2.99Å
327	S	48.2	Very low	53.1	Low	115 Å²	115	151.6 Å²	151.6	80%	0.804	85%	0.85	S	S	*	*			cis	-150.8	141.7	24.8	-46.4	0	0	0	0	111.5
328	T	59.3	Low	53.4	Low	142 Å²	142	151.2 Å²	151.2	87%	0.871	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-95.4	139.9	162.7	-57.2	0	0	0	0	109.5
329	T	62.5	Low	53.9	Low	133 Å²	133	151.2 Å²	151.2	82%	0.816	85%	0.854	S	S	*	*	P	Polyproline II helix	trans	-72	146.6	-175	34.6	0	0	0	0	113.3
330	R	55.8	Low	54.1	Low	252 Å²	252	153.2 Å²	153.2	95%	0.951	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-67	135.8	166	-70.2	162	65	-158.4	3.7	109
331	S	62.5	Low	54.5	Low	116 Å²	116	156.6 Å²	156.6	81%	0.811	87%	0.871	S	S	*	*			trans	-108.3	156	155.3	-163.7	0	0	0	0	109.6
332	S	60.4	Low	55.2	Low	119 Å²	119	158.6 Å²	158.6	83%	0.832	87%	0.872	S	S	*	*			trans	-67.7	152.1	-160.6	-56.5	0	0	0	0	115.1
333	S	60.8	Low	55.9	Low	121 Å²	121	154.5 Å²	154.5	85%	0.846	88%	0.877	S	S	*	*			trans	-123.2	126.6	160	-46.5	0	0	0	0	108.1
334	S	61.9	Low	56.1	Low	109 Å²	109	145.6 Å²	145.6	76%	0.762	87%	0.867	S	S	*	*			trans	-164.9	130.6	161.1	-166.2	0	0	0	0	110
335	C	55.2	Low	56.7	Low	202 Å²	202	146.7 Å²	146.7	100%	1.365	88%	0.883	S	S	*	*			trans	57.9	0	169.6	-56.5	0	0	0	0	116.4

Retrieved 335 of 335 residues in 49.4 ms (Link to these results)

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