X5DR54_HUMAN Loading...

Epididymis secretory sperm binding protein

AlphaFold DB (Q9NXR1), UniProt , Accession X5DR54, 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 172.8 ms (Link to these results)

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