X6R674_HUMAN Loading...

Influenza virus NS1A binding protein

AlphaFold DB , UniProt , Accession X6R674, Species HUMAN (Homo sapiens, Human), Gene IVNS1ABP, Length 135 aa.

						>X6R674_HUMAN|X6R674|IVNS1ABP
MIPNGYLMFEDENFIESSVAKLNALRKSGQFCDVRLQVCGHEMLAHRAVLACCSPYLFEIFNSDSDPHGISHVKFDDLNPEAVEVLLNYAYTAQLKADKELVKDVYSAAKKLKMDRVKQHLLYFCLHSTSTSSLL
					

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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	59.6	Low	81.8	Confident	235 Å²	235	135.5 Å²	135.5	100%	1.158	71%	0.707	S	S	*	*				0	130.8	0	-80.9	179.6	-64.6	0	0	108.1	P3	M1-P3 WeakPolarHBondContact O-CD 3.48Å
2	I	76.1	Confident	82.8	Confident	97 Å²	97	138.3 Å²	138.3	50%	0.497	72%	0.715	S	S	.	*			trans	-82.8	111.5	174	-59.3	174.3	0	0	0	107	N4 G5 Y6 L7	I2-N4 PolarHBondContact O-N 3.16Å; I2-G5 PolarHBondContact O-N 3.2Å; I2-Y6 VanDerWaalsContact CG2-C 3.43Å; I2-Y6 WeakPolarHBondContact CG2-O 3.3Å; I2-L7 HydrophobicContact CD1-CB 4.34Å
3	P	62.7	Low	83.8	Confident	122 Å²	122	136.2 Å²	136.2	79%	0.792	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-22.9	-165.5	-22.7	32.9	0	0	0	114.7	M1	M1-P3 WeakPolarHBondContact O-CD 3.48Å
4	N	71.6	Confident	84.5	Confident	123 Å²	123	134.9 Å²	134.9	66%	0.658	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.7	6	-174.2	-60.8	-21.3	0	0	0	113.6	I2 Y6	I2-N4 PolarHBondContact O-N 3.16Å; N4-Y6 VanDerWaalsContact C-N 3.31Å; N4-Y6 HydrophobicContact CB-CE1 4.16Å; N4-Y6 WeakPolarHBondContact O-CD1 3.38Å; N4-Y6 WeakPolarHBondContact O-CE1 3.31Å; N4-Y6 PolarHBondContact O-N 2.96Å
5	G	86.1	Confident	85.1	Confident	71 Å²	71	133.8 Å²	133.8	73%	0.732	69%	0.686	S	S	*	*	S	Bend	trans	79.8	-1.5	-179.1	0	0	0	0	0	116.2	I2	I2-G5 PolarHBondContact O-N 3.2Å
6	Y	81.6	Confident	85.5	Confident	142 Å²	142	135 Å²	135	56%	0.557	69%	0.688	S	S	*	*	S	Bend	trans	-150.5	148.2	174.9	59.8	-83.7	0	0	0	112.4	I2 N4 M8	I2-Y6 VanDerWaalsContact CG2-C 3.43Å; I2-Y6 WeakPolarHBondContact CG2-O 3.3Å; N4-Y6 VanDerWaalsContact C-N 3.31Å; N4-Y6 HydrophobicContact CB-CE1 4.16Å; N4-Y6 WeakPolarHBondContact O-CD1 3.38Å; N4-Y6 WeakPolarHBondContact O-CE1 3.31Å; N4-Y6 PolarHBondContact O-N 2.96Å; Y6-M8 HydrophobicContact CD2-CG 3.49Å; Y6-M8 VanDerWaalsContact CD2-CG 3.49Å; Y6-M8 HydrophobicContact CD2-SD 3.56Å; Y6-M8 VanDerWaalsContact CD2-SD 3.56Å; Y6-M8 HydrophobicContact CE2-CG 3.26Å; Y6-M8 HydrophobicContact CE2-SD 3.53Å; Y6-M8 VanDerWaalsContact CE2-SD 3.53Å
7	L	90.9	Very high	86	Confident	144 Å²	144	129.5 Å²	129.5	75%	0.754	67%	0.665	S	S	*	*			trans	-88	124.9	173.1	175.9	68	0	0	0	108.6	I2	I2-L7 HydrophobicContact CD1-CB 4.34Å
8	M	89.4	Confident	86.5	Confident	145 Å²	145	124.1 Å²	124.1	71%	0.714	64%	0.64	S	S	*	*			trans	-105.8	135.4	168.4	-67.5	-61.1	-71	0	0	109.6	Y6	Y6-M8 HydrophobicContact CD2-CG 3.49Å; Y6-M8 VanDerWaalsContact CD2-CG 3.49Å; Y6-M8 HydrophobicContact CD2-SD 3.56Å; Y6-M8 VanDerWaalsContact CD2-SD 3.56Å; Y6-M8 HydrophobicContact CE2-CG 3.26Å; Y6-M8 HydrophobicContact CE2-SD 3.53Å; Y6-M8 VanDerWaalsContact CE2-SD 3.53Å
9	F	92.3	Very high	86.9	Confident	170 Å²	170	120.3 Å²	120.3	75%	0.746	62%	0.623	S	S	*	*			trans	-132.2	127.1	170	171.5	-107.5	0	0	0	108	D11	F9-D11 HydrophobicContact CE1-CB 3.78Å; F9-D11 HydrophobicContact CZ-CB 3.94Å
10	E	93.9	Very high	87.4	Confident	170 Å²	170	117.3 Å²	117.3	79%	0.794	62%	0.616	S	S	*	*			trans	-117.2	119.2	177.2	-174.7	167.8	-166.6	0	0	107.8
11	D	95.2	Very high	87.9	Confident	71 Å²	71	117.9 Å²	117.9	38%	0.38	61%	0.614	S	S	.	*			trans	-97.3	98.8	174.9	-178.6	-3.2	0	0	0	109.1	F9 N13 F14	F9-D11 HydrophobicContact CE1-CB 3.78Å; F9-D11 HydrophobicContact CZ-CB 3.94Å; D11-N13 PolarHBondContact O-N 3.45Å; D11-N13 VanDerWaalsContact O-N 3.16Å; D11-N13 PolarHBondContact OD1-N 3.13Å; D11-F14 HydrophobicContact CB-CB 3.91Å; D11-F14 WeakPolarHBondContact O-CB 3.43Å; D11-F14 PolarHBondContact O-N 3.42Å; D11-F14 VanDerWaalsContact O-N 3.15Å; D11-F14 PolarHBondContact OD1-N 3.37Å
12	E	94.8	Very high	89.7	Confident	170 Å²	170	109.8 Å²	109.8	79%	0.794	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-24.3	-179	-62.1	179.5	176.6	0	0	112.8
13	N	94.8	Very high	90.8	Very high	110 Å²	110	106.1 Å²	106.1	59%	0.588	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	-14.1	-178	-59.4	-64.5	0	0	0	113.1	D11 I15 E16 S17	D11-N13 PolarHBondContact O-N 3.45Å; D11-N13 VanDerWaalsContact O-N 3.16Å; D11-N13 PolarHBondContact OD1-N 3.13Å; N13-I15 VanDerWaalsContact C-N 3.3Å; N13-I15 PolarHBondContact O-N 3.26Å; N13-E16 PolarHBondContact O-N 2.6Å; N13-S17 WeakPolarHBondContact O-CB 3.46Å; N13-S17 PolarHBondContact O-N 3.13Å
14	F	94.4	Very high	92.4	Very high	118 Å²	118	103.1 Å²	103.1	52%	0.518	54%	0.542	S	S	.	.	H	α-helix	trans	-59.9	-41	-172.2	-178.4	-104.9	0	0	0	112.1	D11 S18	D11-F14 HydrophobicContact CB-CB 3.91Å; D11-F14 WeakPolarHBondContact O-CB 3.43Å; D11-F14 PolarHBondContact O-N 3.42Å; D11-F14 VanDerWaalsContact O-N 3.15Å; D11-F14 PolarHBondContact OD1-N 3.37Å; F14-S18 WeakPolarHBondContact O-CB 3.07Å; F14-S18 PolarHBondContact O-N 3.4Å; F14-S18 PolarHBondContact O-OG 3.13Å
15	I	92.6	Very high	93.7	Very high	119 Å²	119	99.4 Å²	99.4	61%	0.61	52%	0.522	S	S	*	.	H	α-helix	trans	-66.3	-50.4	-177.8	-57.8	-59.6	0	0	0	111.1	N13 S18 V19	N13-I15 VanDerWaalsContact C-N 3.3Å; N13-I15 PolarHBondContact O-N 3.26Å; I15-S18 PolarHBondContact O-N 3.29Å; I15-V19 WeakPolarHBondContact O-CG2 3.5Å; I15-V19 PolarHBondContact O-N 2.95Å
16	E	91.5	Very high	94.3	Very high	153 Å²	153	96.7 Å²	96.7	72%	0.715	49%	0.49	S	S	*	.	H	α-helix	trans	-61.3	-47.8	179.2	-174.4	179.6	-179.9	0	0	111.2	N13 S18 V19 A20	N13-E16 PolarHBondContact O-N 2.6Å; E16-S18 VanDerWaalsContact C-N 3.3Å; E16-S18 PolarHBondContact O-N 3.44Å; E16-V19 PolarHBondContact O-N 3.36Å; E16-A20 WeakPolarHBondContact O-CB 3.47Å; E16-A20 PolarHBondContact O-N 2.94Å
17	S	94.7	Very high	95	Very high	42 Å²	42	97 Å²	97	29%	0.294	49%	0.494	S	S	.	.	H	α-helix	trans	-61.4	-38.6	177.1	136.9	0	0	0	0	111.8	N13 A20 K21	N13-S17 WeakPolarHBondContact O-CB 3.46Å; N13-S17 PolarHBondContact O-N 3.13Å; S17-A20 PolarHBondContact O-N 3.14Å; S17-K21 WeakPolarHBondContact O-CB 3.46Å; S17-K21 WeakPolarHBondContact O-CD 3.49Å; S17-K21 VanDerWaalsContact O-CG 3.24Å; S17-K21 WeakPolarHBondContact O-CG 3.48Å; S17-K21 PolarHBondContact O-N 3.12Å; S17-K21 PolarHBondContact OG-NZ 3.23Å
18	S	95.3	Very high	95.4	Very high	32 Å²	32	93.6 Å²	93.6	22%	0.224	48%	0.482	C	S	.	.	H	α-helix	trans	-66.3	-44.8	178.9	-65.4	0	0	0	0	111.8	F14 I15 E16 A20 K21 L22	F14-S18 WeakPolarHBondContact O-CB 3.07Å; F14-S18 PolarHBondContact O-N 3.4Å; F14-S18 PolarHBondContact O-OG 3.13Å; I15-S18 PolarHBondContact O-N 3.29Å; E16-S18 VanDerWaalsContact C-N 3.3Å; E16-S18 PolarHBondContact O-N 3.44Å; S18-A20 PolarHBondContact O-N 3.16Å; S18-K21 PolarHBondContact O-N 3.39Å; S18-L22 WeakPolarHBondContact O-CG 3.44Å; S18-L22 PolarHBondContact O-N 2.98Å
19	V	93.9	Very high	95.7	Very high	51 Å²	51	88 Å²	88	31%	0.309	46%	0.462	S	S	.	.	H	α-helix	trans	-62.8	-43	176.6	172.8	0	0	0	0	110.9	I15 E16 K21 L22 N23 Y91	I15-V19 WeakPolarHBondContact O-CG2 3.5Å; I15-V19 PolarHBondContact O-N 2.95Å; E16-V19 PolarHBondContact O-N 3.36Å; V19-K21 PolarHBondContact O-N 3.16Å; V19-L22 PolarHBondContact O-N 3.45Å; V19-N23 PolarHBondContact O-N 2.86Å; V19-Y91 WeakPolarHBondContact CG1-O 3.5Å
20	A	96.4	Very high	96	Very high	60 Å²	60	85.1 Å²	85.1	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-61	-41.9	175.3	0	0	0	0	0	112.4	E16 S17 S18 N23 A24	E16-A20 WeakPolarHBondContact O-CB 3.47Å; E16-A20 PolarHBondContact O-N 2.94Å; S17-A20 PolarHBondContact O-N 3.14Å; S18-A20 PolarHBondContact O-N 3.16Å; A20-N23 WeakPolarHBondContact O-CB 3.41Å; A20-N23 PolarHBondContact O-N 3.48Å; A20-A24 PolarHBondContact O-N 2.98Å
21	K	97.9	Very high	96.1	Very high	131 Å²	131	84.6 Å²	84.6	57%	0.57	45%	0.446	S	S	*	.	H	α-helix	trans	-65.5	-41.8	175.5	-74.2	165.1	-179.5	161.3	0	112	S17 S18 V19 N23 A24 L25	S17-K21 WeakPolarHBondContact O-CB 3.46Å; S17-K21 WeakPolarHBondContact O-CD 3.49Å; S17-K21 VanDerWaalsContact O-CG 3.24Å; S17-K21 WeakPolarHBondContact O-CG 3.48Å; S17-K21 PolarHBondContact O-N 3.12Å; S17-K21 PolarHBondContact OG-NZ 3.23Å; S18-K21 PolarHBondContact O-N 3.39Å; V19-K21 PolarHBondContact O-N 3.16Å; K21-N23 VanDerWaalsContact C-N 3.26Å; K21-N23 PolarHBondContact O-N 2.93Å; K21-A24 WeakPolarHBondContact O-CB 3.43Å; K21-A24 PolarHBondContact O-N 3.4Å; K21-A24 VanDerWaalsContact O-N 3.12Å; K21-L25 WeakPolarHBondContact O-CG 3.34Å; K21-L25 PolarHBondContact O-N 3.25Å
22	L	97.9	Very high	96.2	Very high	65 Å²	65	82 Å²	82	34%	0.34	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-38.1	173.6	-73.9	170.1	0	0	0	111.8	S18 V19 L25 R26 V49 Y91	S18-L22 WeakPolarHBondContact O-CG 3.44Å; S18-L22 PolarHBondContact O-N 2.98Å; V19-L22 PolarHBondContact O-N 3.45Å; L22-L25 HydrophobicContact CD2-CD1 4.45Å; L22-L25 PolarHBondContact O-N 2.93Å; L22-R26 PolarHBondContact O-N 3.5Å; L22-V49 HydrophobicContact CD1-CG2 4.27Å; L22-Y91 HydrophobicContact CB-CD1 4.18Å; L22-Y91 HydrophobicContact CB-CE1 4.24Å
23	N	98	Very high	96.2	Very high	19 Å²	19	76.6 Å²	76.6	10%	0.102	41%	0.41	C	S	.	.	H	α-helix	trans	-66.7	-39.7	175	-163.5	22.5	0	0	0	112	V19 A20 K21 R26 K27 Y91 T92	V19-N23 PolarHBondContact O-N 2.86Å; A20-N23 WeakPolarHBondContact O-CB 3.41Å; A20-N23 PolarHBondContact O-N 3.48Å; K21-N23 VanDerWaalsContact C-N 3.26Å; K21-N23 PolarHBondContact O-N 2.93Å; N23-R26 PolarHBondContact O-N 2.89Å; N23-R26 PolarHBondContact OD1-NE 2.93Å; N23-R26 PolarHBondContact OD1-NH2 3.46Å; N23-K27 WeakPolarHBondContact O-CG 3.38Å; N23-K27 PolarHBondContact O-N 3.22Å; N23-Y91 HydrophobicContact CB-CD1 4.17Å; N23-Y91 HydrophobicContact CB-CG 4.42Å; N23-Y91 WeakPolarHBondContact OD1-CB 3.42Å; N23-T92 WeakPolarHBondContact ND2-CG2 3.2Å
24	A	98.2	Very high	96.3	Very high	59 Å²	59	71.4 Å²	71.4	49%	0.488	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174.9	0	0	0	0	0	111.4	A20 K21 R26 K27 S28	A20-A24 PolarHBondContact O-N 2.98Å; K21-A24 WeakPolarHBondContact O-CB 3.43Å; K21-A24 PolarHBondContact O-N 3.4Å; K21-A24 VanDerWaalsContact O-N 3.12Å; A24-R26 PolarHBondContact O-N 3.08Å; A24-K27 PolarHBondContact O-N 2.94Å; A24-S28 PolarHBondContact O-N 3.33Å; A24-S28 PolarHBondContact O-OG 2.8Å
25	L	98.5	Very high	96.3	Very high	45 Å²	45	69 Å²	69	24%	0.236	37%	0.37	C	S	.	.	H	α-helix	trans	-57	-48.6	174.2	-67.9	172.4	0	0	0	110.8	K21 L22 K27 S28 G29 Q30 F31	K21-L25 WeakPolarHBondContact O-CG 3.34Å; K21-L25 PolarHBondContact O-N 3.25Å; L22-L25 HydrophobicContact CD2-CD1 4.45Å; L22-L25 PolarHBondContact O-N 2.93Å; L25-K27 PolarHBondContact O-N 3.41Å; L25-S28 WeakPolarHBondContact CA-OG 3.47Å; L25-S28 CarbonylContact O-C 3.54Å; L25-S28 PolarHBondContact O-N 3.04Å; L25-S28 VanDerWaalsContact O-N 3.13Å; L25-S28 PolarHBondContact O-OG 3.35Å; L25-G29 PolarHBondContact O-N 2.76Å; L25-Q30 HydrophobicContact CB-CB 4.49Å; L25-Q30 HydrophobicContact CD2-CB 3.88Å; L25-Q30 VanDerWaalsContact CD2-OE1 3.29Å; L25-Q30 PolarHBondContact O-N 2.75Å; L25-F31 HydrophobicContact CD1-CD2 4.11Å; L25-F31 HydrophobicContact CD1-CE2 4.5Å; L25-F31 HydrophobicContact CD2-CD2 3.96Å; L25-F31 HydrophobicContact CD2-CE2 3.97Å
26	R	98.1	Very high	96.6	Very high	15 Å²	15	63.4 Å²	63.4	6%	0.057	34%	0.341	C	S	.	.	H	α-helix	trans	-54.3	-52.2	176.1	178.8	-173	66	105	-6.2	111.7	L22 N23 A24 S28 G29 L44 E84 N88 Y91	L22-R26 PolarHBondContact O-N 3.5Å; N23-R26 PolarHBondContact O-N 2.89Å; N23-R26 PolarHBondContact OD1-NE 2.93Å; N23-R26 PolarHBondContact OD1-NH2 3.46Å; A24-R26 PolarHBondContact O-N 3.08Å; R26-S28 PolarHBondContact O-N 3.45Å; R26-G29 PolarHBondContact O-N 3.2Å; R26-L44 VanDerWaalsContact CG-O 3.3Å; R26-L44 WeakPolarHBondContact CG-O 3.44Å; R26-E84 IonicContact CZ-OE1 3.35Å; R26-E84 IonicContact NH1-OE1 2.64Å; R26-E84 PolarHBondContact NH1-OE1 3.1Å; R26-E84 IonicContact NH1-OE2 2.98Å; R26-E84 IonicContact NH2-OE1 3.19Å; R26-N88 PolarHBondContact NH2-OD1 3.29Å; R26-Y91 HydrophobicContact CB-CD1 4.31Å; R26-Y91 HydrophobicContact CB-CE1 3.87Å; R26-Y91 HydrophobicContact CG-CE1 4.46Å
27	K	97.4	Very high	96.8	Very high	148 Å²	148	60 Å²	60	64%	0.643	33%	0.325	S	S	*	.	H	α-helix	trans	-63.2	-28.8	-177.7	-72.7	-178	178.5	-171.7	0	112.9	N23 A24 L25	N23-K27 WeakPolarHBondContact O-CG 3.38Å; N23-K27 PolarHBondContact O-N 3.22Å; A24-K27 PolarHBondContact O-N 2.94Å; L25-K27 PolarHBondContact O-N 3.41Å
28	S	97.6	Very high	97	Very high	72 Å²	72	58 Å²	58	50%	0.503	31%	0.311	S	S	.	.	H	α-helix	trans	-85.9	-5.4	174.1	69.1	0	0	0	0	114.2	A24 L25 R26 Q30	A24-S28 PolarHBondContact O-N 3.33Å; A24-S28 PolarHBondContact O-OG 2.8Å; L25-S28 WeakPolarHBondContact CA-OG 3.47Å; L25-S28 CarbonylContact O-C 3.54Å; L25-S28 PolarHBondContact O-N 3.04Å; L25-S28 VanDerWaalsContact O-N 3.13Å; L25-S28 PolarHBondContact O-OG 3.35Å; R26-S28 PolarHBondContact O-N 3.45Å; S28-Q30 PolarHBondContact O-N 3.37Å; S28-Q30 VanDerWaalsContact OG-CG 3.32Å; S28-Q30 WeakPolarHBondContact OG-CG 3.49Å
29	G	96.9	Very high	97	Very high	29 Å²	29	59.2 Å²	59.2	30%	0.299	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	6.7	-174.6	0	0	0	0	0	114.5	L25 R26	L25-G29 PolarHBondContact O-N 2.76Å; R26-G29 PolarHBondContact O-N 3.2Å
30	Q	97.5	Very high	96.9	Very high	109 Å²	109	59.4 Å²	59.4	51%	0.509	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	131.7	-179	-71.6	-174.7	-37.5	0	0	110.8	L25 S28 C32 H46	L25-Q30 HydrophobicContact CB-CB 4.49Å; L25-Q30 HydrophobicContact CD2-CB 3.88Å; L25-Q30 VanDerWaalsContact CD2-OE1 3.29Å; L25-Q30 PolarHBondContact O-N 2.75Å; S28-Q30 PolarHBondContact O-N 3.37Å; S28-Q30 VanDerWaalsContact OG-CG 3.32Å; S28-Q30 WeakPolarHBondContact OG-CG 3.49Å; Q30-C32 PolarHBondContact O-N 3.28Å; Q30-H46 PolarHBondContact O-NE2 3.01Å; Q30-H46 VanDerWaalsContact O-NE2 3.08Å
31	F	96.1	Very high	96.9	Very high	158 Å²	158	61.8 Å²	61.8	69%	0.693	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	8.7	-179	-46.8	-66.3	0	0	0	115.2	L25 D33 H46	L25-F31 HydrophobicContact CD1-CD2 4.11Å; L25-F31 HydrophobicContact CD1-CE2 4.5Å; L25-F31 HydrophobicContact CD2-CD2 3.96Å; L25-F31 HydrophobicContact CD2-CE2 3.97Å; F31-D33 PolarHBondContact O-N 2.82Å; F31-H46 PolarHBondContact O-CD2 3.35Å
32	C	96.8	Very high	96.9	Very high	17 Å²	17	60.6 Å²	60.6	12%	0.115	33%	0.328	C	S	.	.			trans	-64.7	120.7	172.2	-69.5	0	0	0	0	109.9	Q30 L44 A45	Q30-C32 PolarHBondContact O-N 3.28Å; C32-L44 HydrophobicContact CB-CB 3.93Å; C32-A45 CarbonylContact C-O 3.53Å; C32-A45 VanDerWaalsContact CA-O 3.25Å; C32-A45 WeakPolarHBondContact CA-O 3.09Å; C32-A45 WeakPolarHBondContact CB-O 3.32Å
33	D	95.4	Very high	96.9	Very high	57 Å²	57	58.4 Å²	58.4	31%	0.305	32%	0.317	S	S	.	.			trans	-116.1	5.6	-176.4	59	-5	0	0	0	111.7	F31 A45 H46 R47 I70 S71	F31-D33 PolarHBondContact O-N 2.82Å; D33-A45 PolarHBondContact N-O 2.64Å; D33-H46 WeakPolarHBondContact OD1-CA 3.31Å; D33-R47 WeakPolarHBondContact OD1-CG 3.37Å; D33-R47 PolarHBondContact OD1-N 3.13Å; D33-I70 WeakPolarHBondContact O-CA 3.3Å; D33-S71 PolarHBondContact O-N 2.81Å
34	V	96.3	Very high	96.8	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.7	169.9	57.4	0	0	0	0	111.7	L36 A45 R47 L50 F61 S71 V73	V34-L36 HydrophobicContact CG2-CD2 3.8Å; V34-A45 HydrophobicContact CG1-CB 3.93Å; V34-A45 WeakPolarHBondContact CG1-O 3.46Å; V34-A45 PolarHBondContact N-O 3.49Å; V34-A45 VanDerWaalsContact N-O 3.16Å; V34-A45 PolarHBondContact O-N 3.25Å; V34-R47 HydrophobicContact CB-CG 3.67Å; V34-R47 HydrophobicContact CG1-CG 3.86Å; V34-L50 HydrophobicContact CG1-CD1 4.22Å; V34-F61 HydrophobicContact CB-CE1 4.33Å; V34-F61 HydrophobicContact CB-CZ 4.43Å; V34-F61 HydrophobicContact CG1-CZ 4.33Å; V34-F61 HydrophobicContact CG2-CE1 3.71Å; V34-F61 HydrophobicContact CG2-CZ 3.99Å; V34-S71 CarbonylContact C-O 3.56Å; V34-S71 WeakPolarHBondContact CA-O 3.37Å; V34-S71 WeakPolarHBondContact CG2-O 3.24Å; V34-V73 HydrophobicContact CG2-CG2 4.26Å
35	R	95.9	Very high	96.8	Very high	68 Å²	68	57.5 Å²	57.5	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.1	171.9	-174.5	-179.7	-68.1	-174.1	14	109.9	E42 L44 I70 S71 V73	R35-E42 WeakPolarHBondContact CD-OE2 3.45Å; R35-E42 HydrophobicContact CG-CG 3.42Å; R35-E42 VanDerWaalsContact CG-CG 3.42Å; R35-E42 IonicContact CZ-OE1 3.2Å; R35-E42 IonicContact CZ-OE2 3.9Å; R35-E42 VanDerWaalsContact NE-CD 3.26Å; R35-E42 IonicContact NE-OE1 2.82Å; R35-E42 PolarHBondContact NE-OE1 3.46Å; R35-E42 IonicContact NE-OE2 3.99Å; R35-E42 PolarHBondContact NE-OE2 3.24Å; R35-E42 IonicContact NH1-OE1 2.75Å; R35-E42 IonicContact NH1-OE2 3.89Å; R35-E42 PolarHBondContact NH1-OE2 2.64Å; R35-L44 HydrophobicContact CB-CD2 4.3Å; R35-L44 HydrophobicContact CG-CD2 4.25Å; R35-I70 HydrophobicContact CB-CG2 4Å; R35-S71 PolarHBondContact N-O 2.9Å; R35-V73 PolarHBondContact O-N 3.01Å
36	L	97.3	Very high	96.8	Very high	1 Å²	1	56 Å²	56	1%	0.005	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.1	170.2	-49.8	-175.6	0	0	0	108.5	V34 M43 L50 V73 F75 V83 L87	V34-L36 HydrophobicContact CG2-CD2 3.8Å; L36-M43 HydrophobicContact CB-CB 4.34Å; L36-M43 PolarHBondContact N-O 2.98Å; L36-M43 PolarHBondContact O-N 2.64Å; L36-L50 HydrophobicContact CD1-CD1 3.96Å; L36-L50 HydrophobicContact CD2-CD1 4.42Å; L36-L50 HydrophobicContact CG-CD1 4.43Å; L36-V73 CarbonylContact C-O 3.58Å; L36-V73 WeakPolarHBondContact CA-O 3.48Å; L36-V73 HydrophobicContact CD2-CB 3.81Å; L36-V73 HydrophobicContact CD2-CG1 4.49Å; L36-V73 HydrophobicContact CD2-CG2 4.26Å; L36-F75 HydrophobicContact CD2-CE2 4.32Å; L36-V83 HydrophobicContact CD1-CG1 4.34Å; L36-L87 HydrophobicContact CD1-CD1 4.42Å; L36-L87 HydrophobicContact CD1-CD2 3.97Å
37	Q	97.4	Very high	96.7	Very high	81 Å²	81	57.3 Å²	57.3	38%	0.379	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107.5	173.3	-171.1	171.1	41	0	0	109.2	H41 V73 K74 F75	Q37-H41 CarbonylContact C-O 3.53Å; Q37-H41 WeakPolarHBondContact CA-O 3.46Å; Q37-V73 PolarHBondContact N-O 2.87Å; Q37-K74 HydrophobicContact CB-CG 4.32Å; Q37-K74 CarbonylContact O-C 3.56Å; Q37-K74 WeakPolarHBondContact O-CA 3.22Å; Q37-F75 PolarHBondContact O-N 2.84Å
38	V	97.8	Very high	96.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	110.6	-176.3	-171.7	0	0	0	0	109.4	G40 H41 M43 F75 L78 P80 V83	V38-G40 PolarHBondContact O-N 2.81Å; V38-G40 VanDerWaalsContact O-N 3.13Å; V38-H41 PolarHBondContact N-O 2.84Å; V38-H41 VanDerWaalsContact O-CB 3.31Å; V38-H41 WeakPolarHBondContact O-CB 3.39Å; V38-H41 PolarHBondContact O-N 2.85Å; V38-H41 PolarHBondContact O-ND1 3.23Å; V38-M43 HydrophobicContact CB-CE 4.35Å; V38-M43 HydrophobicContact CG2-CE 4.31Å; V38-M43 HydrophobicContact CG2-SD 4.15Å; V38-F75 CarbonylContact C-O 3.58Å; V38-F75 VanDerWaalsContact CA-O 3.31Å; V38-F75 WeakPolarHBondContact CA-O 3.43Å; V38-F75 HydrophobicContact CG1-CB 4.47Å; V38-F75 HydrophobicContact CG2-CB 4.41Å; V38-F75 HydrophobicContact CG2-CD2 4.22Å; V38-L78 HydrophobicContact CG1-CB 3.92Å; V38-L78 VanDerWaalsContact CG1-O 3.22Å; V38-L78 WeakPolarHBondContact CG1-O 3.37Å; V38-P80 HydrophobicContact CB-CB 4.39Å; V38-P80 HydrophobicContact CB-CG 4.44Å; V38-P80 HydrophobicContact CG1-CB 4.23Å; V38-P80 HydrophobicContact CG1-CG 4.05Å; V38-V83 HydrophobicContact CG1-CG2 4.02Å; V38-V83 HydrophobicContact CG2-CB 4.12Å; V38-V83 HydrophobicContact CG2-CG1 4.02Å; V38-V83 HydrophobicContact CG2-CG2 4.03Å
39	C	95.1	Very high	96.6	Very high	58 Å²	58	51.2 Å²	51.2	39%	0.392	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	44	47.2	-174.9	-64.7	0	0	0	0	113	H41 F75 D76 L78 P80	C39-H41 VanDerWaalsContact C-N 3.27Å; C39-H41 PolarHBondContact O-N 2.96Å; C39-H41 PolarHBondContact O-ND1 2.98Å; C39-H41 VanDerWaalsContact O-ND1 3.12Å; C39-F75 PolarHBondContact N-O 3.01Å; C39-D76 PolarHBondContact SG-O 2.83Å; C39-L78 PolarHBondContact SG-O 3.13Å; C39-P80 HydrophobicContact CB-CG 4.08Å
40	G	92.1	Very high	96.7	Very high	55 Å²	55	50 Å²	50	57%	0.567	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.1	-9.1	-178.3	0	0	0	0	0	116.2	V38	V38-G40 PolarHBondContact O-N 2.81Å; V38-G40 VanDerWaalsContact O-N 3.13Å
41	H	96.8	Very high	96.6	Very high	111 Å²	111	46 Å²	46	51%	0.514	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	134	175.8	-61.6	71.6	0	0	0	110.6	Q37 V38 C39 P80	Q37-H41 CarbonylContact C-O 3.53Å; Q37-H41 WeakPolarHBondContact CA-O 3.46Å; V38-H41 PolarHBondContact N-O 2.84Å; V38-H41 VanDerWaalsContact O-CB 3.31Å; V38-H41 WeakPolarHBondContact O-CB 3.39Å; V38-H41 PolarHBondContact O-N 2.85Å; V38-H41 PolarHBondContact O-ND1 3.23Å; C39-H41 VanDerWaalsContact C-N 3.27Å; C39-H41 PolarHBondContact O-N 2.96Å; C39-H41 PolarHBondContact O-ND1 2.98Å; C39-H41 VanDerWaalsContact O-ND1 3.12Å; H41-P80 HydrophobicContact CB-CB 4.06Å; H41-P80 HydrophobicContact CB-CG 4.31Å; H41-P80 WeakPolarHBondContact ND1-CG 3.35Å
42	E	96.7	Very high	96.6	Very high	106 Å²	106	44.1 Å²	44.1	50%	0.495	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.6	-178.6	-168.8	177.9	108	0	0	111	R35	R35-E42 WeakPolarHBondContact CD-OE2 3.45Å; R35-E42 HydrophobicContact CG-CG 3.42Å; R35-E42 VanDerWaalsContact CG-CG 3.42Å; R35-E42 IonicContact CZ-OE1 3.2Å; R35-E42 IonicContact CZ-OE2 3.9Å; R35-E42 VanDerWaalsContact NE-CD 3.26Å; R35-E42 IonicContact NE-OE1 2.82Å; R35-E42 PolarHBondContact NE-OE1 3.46Å; R35-E42 IonicContact NE-OE2 3.99Å; R35-E42 PolarHBondContact NE-OE2 3.24Å; R35-E42 IonicContact NH1-OE1 2.75Å; R35-E42 IonicContact NH1-OE2 3.89Å; R35-E42 PolarHBondContact NH1-OE2 2.64Å
43	M	97.9	Very high	96.6	Very high	18 Å²	18	45.2 Å²	45.2	9%	0.089	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	120.7	175.4	-59.4	165.6	-171.4	0	0	109.7	L36 V38 P80 V83 E84 L87	L36-M43 HydrophobicContact CB-CB 4.34Å; L36-M43 PolarHBondContact N-O 2.98Å; L36-M43 PolarHBondContact O-N 2.64Å; V38-M43 HydrophobicContact CB-CE 4.35Å; V38-M43 HydrophobicContact CG2-CE 4.31Å; V38-M43 HydrophobicContact CG2-SD 4.15Å; M43-P80 HydrophobicContact CE-CB 3.85Å; M43-P80 WeakPolarHBondContact CE-O 3.44Å; M43-V83 HydrophobicContact CE-CB 4.4Å; M43-V83 HydrophobicContact SD-CB 4.18Å; M43-V83 HydrophobicContact SD-CG1 3.84Å; M43-E84 HydrophobicContact CE-CB 4.34Å; M43-L87 HydrophobicContact CB-CD1 3.78Å; M43-L87 HydrophobicContact CG-CD1 4.21Å; M43-L87 HydrophobicContact SD-CD1 3.77Å
44	L	97.8	Very high	96.7	Very high	59 Å²	59	42.5 Å²	42.5	31%	0.309	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	140.8	175.7	-60.6	178.2	0	0	0	110.7	R26 C32 R35	R26-L44 VanDerWaalsContact CG-O 3.3Å; R26-L44 WeakPolarHBondContact CG-O 3.44Å; C32-L44 HydrophobicContact CB-CB 3.93Å; R35-L44 HydrophobicContact CB-CD2 4.3Å; R35-L44 HydrophobicContact CG-CD2 4.25Å
45	A	98.1	Very high	96.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	176	176.3	0	0	0	0	0	112	C32 D33 V34 L50	C32-A45 CarbonylContact C-O 3.53Å; C32-A45 VanDerWaalsContact CA-O 3.25Å; C32-A45 WeakPolarHBondContact CA-O 3.09Å; C32-A45 WeakPolarHBondContact CB-O 3.32Å; D33-A45 PolarHBondContact N-O 2.64Å; V34-A45 HydrophobicContact CG1-CB 3.93Å; V34-A45 WeakPolarHBondContact CG1-O 3.46Å; V34-A45 PolarHBondContact N-O 3.49Å; V34-A45 VanDerWaalsContact N-O 3.16Å; V34-A45 PolarHBondContact O-N 3.25Å; A45-L50 HydrophobicContact CB-CD1 3.7Å; A45-L50 HydrophobicContact CB-CD2 4.42Å; A45-L50 HydrophobicContact CB-CG 4.07Å
46	H	97.5	Very high	96.8	Very high	15 Å²	15	45.3 Å²	45.3	7%	0.069	27%	0.268	C	S	.	.			trans	-99.1	127.9	170.3	-48.8	92.4	0	0	0	110.8	Q30 F31 D33 A48 V49 L50 Y91	Q30-H46 PolarHBondContact O-NE2 3.01Å; Q30-H46 VanDerWaalsContact O-NE2 3.08Å; F31-H46 PolarHBondContact O-CD2 3.35Å; D33-H46 WeakPolarHBondContact OD1-CA 3.31Å; H46-A48 VanDerWaalsContact C-N 3.28Å; H46-A48 PolarHBondContact O-N 2.94Å; H46-V49 HydrophobicContact CB-CB 4.4Å; H46-V49 HydrophobicContact CB-CG2 4.09Å; H46-V49 PolarHBondContact O-N 3.33Å; H46-L50 PolarHBondContact O-N 3.34Å; H46-L50 VanDerWaalsContact O-N 3.16Å; H46-Y91 WeakPolarHBondContact CB-OH 3.25Å; H46-Y91 PolarHBondContact N-OH 3.06Å; H46-Y91 AromaticContact ND1-CE1 3.54Å; H46-Y91 AromaticContact ND1-CZ 3.63Å; H46-Y91 PolarHBondContact ND1-OH 3.24Å
47	R	96.3	Very high	96.7	Very high	42 Å²	42	45.5 Å²	45.5	16%	0.158	27%	0.269	C	S	.	.	H	α-helix	trans	-54.3	-46.2	176.4	-70	168.1	68.8	-174.2	3.1	110.9	D33 V34 V49 L50 A51 F61 S71	D33-R47 WeakPolarHBondContact OD1-CG 3.37Å; D33-R47 PolarHBondContact OD1-N 3.13Å; V34-R47 HydrophobicContact CB-CG 3.67Å; V34-R47 HydrophobicContact CG1-CG 3.86Å; R47-V49 PolarHBondContact O-N 2.88Å; R47-L50 PolarHBondContact O-N 3.35Å; R47-A51 WeakPolarHBondContact O-CB 3.43Å; R47-A51 PolarHBondContact O-N 2.85Å; R47-F61 HydrophobicContact CB-CD2 3.77Å; R47-F61 HydrophobicContact CB-CE2 3.98Å; R47-F61 HydrophobicContact CB-CG 4.18Å; R47-F61 HydrophobicContact CG-CD1 4.11Å; R47-F61 HydrophobicContact CG-CD2 4.03Å; R47-F61 HydrophobicContact CG-CE1 4.23Å; R47-F61 HydrophobicContact CG-CE2 4.15Å; R47-F61 HydrophobicContact CG-CG 4.02Å; R47-F61 HydrophobicContact CG-CZ 4.25Å; R47-F61 PolarHBondContact NH2-O 3.46Å; R47-S71 PolarHBondContact NE-OG 3.44Å
48	A	96.1	Very high	96.6	Very high	69 Å²	69	46.8 Å²	46.8	57%	0.57	27%	0.274	S	S	*	.	H	α-helix	trans	-56.7	-45.9	-178.9	0	0	0	0	0	112.6	H46 C52	H46-A48 VanDerWaalsContact C-N 3.28Å; H46-A48 PolarHBondContact O-N 2.94Å; A48-C52 PolarHBondContact O-N 3.39Å; A48-C52 PolarHBondContact O-SG 3.45Å
49	V	97.4	Very high	96.5	Very high	22 Å²	22	51.7 Å²	51.7	13%	0.133	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-45.8	179.8	178.7	0	0	0	0	110.9	L22 H46 R47 A51 C52 C53 A90 Y91	L22-V49 HydrophobicContact CD1-CG2 4.27Å; H46-V49 HydrophobicContact CB-CB 4.4Å; H46-V49 HydrophobicContact CB-CG2 4.09Å; H46-V49 PolarHBondContact O-N 3.33Å; R47-V49 PolarHBondContact O-N 2.88Å; V49-A51 PolarHBondContact O-N 3.26Å; V49-C52 PolarHBondContact O-N 3.45Å; V49-C53 PolarHBondContact O-N 2.87Å; V49-A90 HydrophobicContact CG1-CB 4.38Å; V49-Y91 HydrophobicContact CB-CE1 4.08Å; V49-Y91 HydrophobicContact CB-CE2 4.09Å; V49-Y91 HydrophobicContact CG1-CD1 4.17Å; V49-Y91 HydrophobicContact CG1-CD2 3.94Å; V49-Y91 HydrophobicContact CG1-CE1 3.85Å; V49-Y91 HydrophobicContact CG1-CE2 3.57Å; V49-Y91 HydrophobicContact CG1-CG 4.24Å; V49-Y91 HydrophobicContact CG2-CE1 3.86Å
50	L	97.5	Very high	96.4	Very high	5 Å²	5	51.5 Å²	51.5	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-66.3	-38	-179.2	-62.9	-167.6	0	0	0	112.4	V34 L36 A45 H46 R47 C52 C53 S54 L57 F61 L87 A90 Y91	V34-L50 HydrophobicContact CG1-CD1 4.22Å; L36-L50 HydrophobicContact CD1-CD1 3.96Å; L36-L50 HydrophobicContact CD2-CD1 4.42Å; L36-L50 HydrophobicContact CG-CD1 4.43Å; A45-L50 HydrophobicContact CB-CD1 3.7Å; A45-L50 HydrophobicContact CB-CD2 4.42Å; A45-L50 HydrophobicContact CB-CG 4.07Å; H46-L50 PolarHBondContact O-N 3.34Å; H46-L50 VanDerWaalsContact O-N 3.16Å; R47-L50 PolarHBondContact O-N 3.35Å; L50-C52 VanDerWaalsContact C-N 3.31Å; L50-C52 PolarHBondContact O-N 3.06Å; L50-C53 PolarHBondContact O-N 3.48Å; L50-C53 VanDerWaalsContact O-N 3.11Å; L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 3.41Å; L50-L57 HydrophobicContact CB-CD1 3.87Å; L50-L57 HydrophobicContact CD1-CD1 3.99Å; L50-L57 HydrophobicContact CG-CD1 4.46Å; L50-F61 HydrophobicContact CB-CE2 3.97Å; L50-F61 HydrophobicContact CB-CZ 4.33Å; L50-F61 HydrophobicContact CD1-CZ 4.39Å; L50-L87 HydrophobicContact CD1-CD2 4.03Å; L50-L87 HydrophobicContact CD2-CD2 3.46Å; L50-L87 VanDerWaalsContact CD2-CD2 3.46Å; L50-L87 HydrophobicContact CG-CD2 4.39Å; L50-A90 HydrophobicContact CD2-CB 4.26Å; L50-Y91 HydrophobicContact CD2-CE2 4.14Å
51	A	96.7	Very high	96.5	Very high	24 Å²	24	49.3 Å²	49.3	20%	0.198	27%	0.266	C	S	.	.	H	α-helix	trans	-60.2	-38.1	175	0	0	0	0	0	112.8	R47 V49 C53 F58 F61	R47-A51 WeakPolarHBondContact O-CB 3.43Å; R47-A51 PolarHBondContact O-N 2.85Å; V49-A51 PolarHBondContact O-N 3.26Å; A51-C53 PolarHBondContact O-N 3.19Å; A51-F58 HydrophobicContact CB-CB 4.01Å; A51-F58 HydrophobicContact CB-CD2 3.99Å; A51-F61 HydrophobicContact CB-CD2 4.33Å
52	C	95.9	Very high	96.2	Very high	118 Å²	118	49.1 Å²	49.1	80%	0.797	27%	0.269	S	S	*	.	H	α-helix	trans	-63.9	-29	175.5	-69	0	0	0	0	113	A48 V49 L50	A48-C52 PolarHBondContact O-N 3.39Å; A48-C52 PolarHBondContact O-SG 3.45Å; V49-C52 PolarHBondContact O-N 3.45Å; L50-C52 VanDerWaalsContact C-N 3.31Å; L50-C52 PolarHBondContact O-N 3.06Å
53	C	96	Very high	95.8	Very high	40 Å²	40	48.5 Å²	48.5	27%	0.27	28%	0.276	S	S	.	.	H	α-helix	trans	-99	-19.1	-177	-59.9	0	0	0	0	113.9	V49 L50 A51 A90 M114	V49-C53 PolarHBondContact O-N 2.87Å; L50-C53 PolarHBondContact O-N 3.48Å; L50-C53 VanDerWaalsContact O-N 3.11Å; A51-C53 PolarHBondContact O-N 3.19Å; C53-A90 HydrophobicContact CB-CB 4.28Å; C53-M114 HydrophobicContact CB-CE 3.87Å
54	S	97.9	Very high	95.1	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.007	29%	0.286	C	S	.	.			trans	-137.8	105.6	-171.3	173	0	0	0	0	110.9	L50 Y56 L57 F58 L112	L50-S54 WeakPolarHBondContact O-CB 3.49Å; L50-S54 PolarHBondContact O-N 3.41Å; S54-Y56 PolarHBondContact O-N 2.97Å; S54-L57 PolarHBondContact O-N 3.33Å; S54-L57 WeakPolarHBondContact OG-CG 3.23Å; S54-L57 PolarHBondContact OG-N 3.08Å; S54-F58 PolarHBondContact O-N 3.18Å; S54-L112 WeakPolarHBondContact CB-O 3.33Å; S54-L112 PolarHBondContact OG-O 3.36Å
55	P	96.8	Very high	93.7	Very high	63 Å²	63	53 Å²	53	41%	0.409	31%	0.311	S	S	.	.	H	α-helix	trans	-58.1	-32.2	171.3	-24.9	34.8	0	0	0	112.8	F58 E59 K113	P55-F58 PolarHBondContact O-N 3.23Å; P55-E59 WeakPolarHBondContact O-CG 3.38Å; P55-E59 PolarHBondContact O-N 3.35Å; P55-K113 WeakPolarHBondContact CD-O 3.4Å
56	Y	97	Very high	92.6	Very high	63 Å²	63	57.1 Å²	57.1	25%	0.247	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-48.9	175.4	174.6	-99.7	0	0	0	111.7	S54 F58 E59 I60 F75 L112	S54-Y56 PolarHBondContact O-N 2.97Å; Y56-F58 VanDerWaalsContact C-N 3.34Å; Y56-E59 PolarHBondContact O-N 2.88Å; Y56-I60 HydrophobicContact CD1-CG1 4.35Å; Y56-I60 HydrophobicContact CE1-CD1 4.49Å; Y56-I60 HydrophobicContact CE1-CG1 3.95Å; Y56-I60 HydrophobicContact CE2-CD1 4.41Å; Y56-I60 HydrophobicContact CE2-CG1 4.3Å; Y56-I60 VanDerWaalsContact O-CG1 3.3Å; Y56-I60 WeakPolarHBondContact O-CG1 3.49Å; Y56-I60 PolarHBondContact O-N 3.33Å; Y56-F75 AromaticContact CE1-CE1 3.84Å; Y56-F75 HydrophobicContact CE1-CE1 3.84Å; Y56-F75 AromaticContact CE1-CZ 3.98Å; Y56-F75 HydrophobicContact CE1-CZ 3.98Å; Y56-L112 HydrophobicContact CD1-CD2 4.03Å; Y56-L112 HydrophobicContact CE1-CD2 4.29Å
57	L	96	Very high	91.1	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-68.7	-34.7	178.5	-68.8	174.8	0	0	0	111.5	L50 S54 E59 I60 F61 V73 F75 L112	L50-L57 HydrophobicContact CB-CD1 3.87Å; L50-L57 HydrophobicContact CD1-CD1 3.99Å; L50-L57 HydrophobicContact CG-CD1 4.46Å; S54-L57 PolarHBondContact O-N 3.33Å; S54-L57 WeakPolarHBondContact OG-CG 3.23Å; S54-L57 PolarHBondContact OG-N 3.08Å; L57-E59 PolarHBondContact O-N 2.84Å; L57-I60 PolarHBondContact O-N 2.91Å; L57-F61 HydrophobicContact CB-CD2 4.36Å; L57-F61 HydrophobicContact CB-CE2 3.7Å; L57-F61 HydrophobicContact CB-CZ 3.83Å; L57-F61 HydrophobicContact CD2-CE1 4.45Å; L57-F61 HydrophobicContact CD2-CZ 4.1Å; L57-F61 HydrophobicContact CG-CZ 4.37Å; L57-F61 WeakPolarHBondContact O-CB 3.38Å; L57-F61 WeakPolarHBondContact O-CD2 3.13Å; L57-F61 WeakPolarHBondContact O-CG 3.31Å; L57-F61 PolarHBondContact O-N 2.93Å; L57-V73 HydrophobicContact CD2-CG1 4.45Å; L57-F75 HydrophobicContact CD2-CZ 4.14Å; L57-L112 HydrophobicContact CD1-CD2 4.44Å; L57-L112 HydrophobicContact CD2-CD2 4.34Å; L57-L112 HydrophobicContact CG-CD2 4.34Å
58	F	95.8	Very high	89.8	Confident	108 Å²	108	66.9 Å²	66.9	47%	0.474	39%	0.387	S	S	.	.	H	α-helix	trans	-57.2	-46.8	170.7	175.1	-96.9	0	0	0	112.3	A51 S54 P55 Y56 F61 N62	A51-F58 HydrophobicContact CB-CB 4.01Å; A51-F58 HydrophobicContact CB-CD2 3.99Å; S54-F58 PolarHBondContact O-N 3.18Å; P55-F58 PolarHBondContact O-N 3.23Å; Y56-F58 VanDerWaalsContact C-N 3.34Å; F58-F61 PolarHBondContact O-N 3.08Å; F58-N62 WeakPolarHBondContact CE1-ND2 3.36Å; F58-N62 VanDerWaalsContact CE2-ND2 3.31Å; F58-N62 WeakPolarHBondContact CE2-ND2 3.32Å; F58-N62 WeakPolarHBondContact CZ-ND2 3.07Å; F58-N62 PolarHBondContact O-N 3.37Å; F58-N62 VanDerWaalsContact O-N 3.08Å; F58-N62 PolarHBondContact O-ND2 2.94Å
59	E	94.9	Very high	88.9	Confident	104 Å²	104	64.8 Å²	64.8	49%	0.486	37%	0.372	S	S	.	.	H	α-helix	trans	-59.8	-47.1	175.6	-73.4	164.7	-177.2	0	0	111.3	P55 Y56 L57 F61 N62 S63 K113	P55-E59 WeakPolarHBondContact O-CG 3.38Å; P55-E59 PolarHBondContact O-N 3.35Å; Y56-E59 PolarHBondContact O-N 2.88Å; L57-E59 PolarHBondContact O-N 2.84Å; E59-F61 PolarHBondContact O-N 2.77Å; E59-N62 PolarHBondContact O-N 3.38Å; E59-S63 PolarHBondContact O-N 3.38Å; E59-S63 VanDerWaalsContact O-N 3.14Å; E59-S63 PolarHBondContact O-OG 3.27Å; E59-K113 IonicContact OE1-NZ 3.53Å; E59-K113 IonicContact OE2-NZ 2.98Å; E59-K113 PolarHBondContact OE2-NZ 2.98Å
60	I	93.4	Very high	88.3	Confident	54 Å²	54	67.4 Å²	67.4	28%	0.277	38%	0.384	S	S	.	.	H	α-helix	trans	-60.6	-43.7	178.4	-67.8	-75.3	0	0	0	111.6	Y56 L57 N62 S63 D64 V73	Y56-I60 HydrophobicContact CD1-CG1 4.35Å; Y56-I60 HydrophobicContact CE1-CD1 4.49Å; Y56-I60 HydrophobicContact CE1-CG1 3.95Å; Y56-I60 HydrophobicContact CE2-CD1 4.41Å; Y56-I60 HydrophobicContact CE2-CG1 4.3Å; Y56-I60 VanDerWaalsContact O-CG1 3.3Å; Y56-I60 WeakPolarHBondContact O-CG1 3.49Å; Y56-I60 PolarHBondContact O-N 3.33Å; L57-I60 PolarHBondContact O-N 2.91Å; I60-N62 VanDerWaalsContact C-N 3.35Å; I60-S63 PolarHBondContact O-N 3.23Å; I60-S63 PolarHBondContact O-OG 3.03Å; I60-S63 VanDerWaalsContact O-OG 3.06Å; I60-D64 PolarHBondContact O-N 2.96Å; I60-V73 HydrophobicContact CG2-CG1 4.43Å; I60-V73 HydrophobicContact CG2-CG2 3.82Å
61	F	93.1	Very high	87.8	Confident	8 Å²	8	67.2 Å²	67.2	4%	0.035	38%	0.384	C	S	.	.	H	α-helix	trans	-72.6	-28.4	-178.2	-60	-28.7	0	0	0	112.9	V34 R47 L50 A51 L57 F58 E59 V73	V34-F61 HydrophobicContact CB-CE1 4.33Å; V34-F61 HydrophobicContact CB-CZ 4.43Å; V34-F61 HydrophobicContact CG1-CZ 4.33Å; V34-F61 HydrophobicContact CG2-CE1 3.71Å; V34-F61 HydrophobicContact CG2-CZ 3.99Å; R47-F61 HydrophobicContact CB-CD2 3.77Å; R47-F61 HydrophobicContact CB-CE2 3.98Å; R47-F61 HydrophobicContact CB-CG 4.18Å; R47-F61 HydrophobicContact CG-CD1 4.11Å; R47-F61 HydrophobicContact CG-CD2 4.03Å; R47-F61 HydrophobicContact CG-CE1 4.23Å; R47-F61 HydrophobicContact CG-CE2 4.15Å; R47-F61 HydrophobicContact CG-CG 4.02Å; R47-F61 HydrophobicContact CG-CZ 4.25Å; R47-F61 PolarHBondContact NH2-O 3.46Å; L50-F61 HydrophobicContact CB-CE2 3.97Å; L50-F61 HydrophobicContact CB-CZ 4.33Å; L50-F61 HydrophobicContact CD1-CZ 4.39Å; A51-F61 HydrophobicContact CB-CD2 4.33Å; L57-F61 HydrophobicContact CB-CD2 4.36Å; L57-F61 HydrophobicContact CB-CE2 3.7Å; L57-F61 HydrophobicContact CB-CZ 3.83Å; L57-F61 HydrophobicContact CD2-CE1 4.45Å; L57-F61 HydrophobicContact CD2-CZ 4.1Å; L57-F61 HydrophobicContact CG-CZ 4.37Å; L57-F61 WeakPolarHBondContact O-CB 3.38Å; L57-F61 WeakPolarHBondContact O-CD2 3.13Å; L57-F61 WeakPolarHBondContact O-CG 3.31Å; L57-F61 PolarHBondContact O-N 2.93Å; F58-F61 PolarHBondContact O-N 3.08Å; E59-F61 PolarHBondContact O-N 2.77Å; F61-V73 HydrophobicContact CE1-CG2 3.9Å
62	N	90.7	Very high	87.5	Confident	108 Å²	108	72.2 Å²	72.2	58%	0.578	40%	0.403	S	S	*	.	H	α-helix	trans	-79.7	-23.5	176.4	-76.6	-30.5	0	0	0	113.1	F58 E59 I60 D64	F58-N62 WeakPolarHBondContact CE1-ND2 3.36Å; F58-N62 VanDerWaalsContact CE2-ND2 3.31Å; F58-N62 WeakPolarHBondContact CE2-ND2 3.32Å; F58-N62 WeakPolarHBondContact CZ-ND2 3.07Å; F58-N62 PolarHBondContact O-N 3.37Å; F58-N62 VanDerWaalsContact O-N 3.08Å; F58-N62 PolarHBondContact O-ND2 2.94Å; E59-N62 PolarHBondContact O-N 3.38Å; I60-N62 VanDerWaalsContact C-N 3.35Å; N62-D64 VanDerWaalsContact C-N 3.34Å
63	S	88.1	Confident	87.4	Confident	92 Å²	92	67.2 Å²	67.2	64%	0.643	37%	0.368	S	S	*	.	S	Bend	trans	-87.7	-5	174.3	62.6	0	0	0	0	113.3	E59 I60 S65	E59-S63 PolarHBondContact O-N 3.38Å; E59-S63 VanDerWaalsContact O-N 3.14Å; E59-S63 PolarHBondContact O-OG 3.27Å; I60-S63 PolarHBondContact O-N 3.23Å; I60-S63 PolarHBondContact O-OG 3.03Å; I60-S63 VanDerWaalsContact O-OG 3.06Å; S63-S65 PolarHBondContact O-N 3.39Å
64	D	83.3	Confident	87.4	Confident	54 Å²	54	70.9 Å²	70.9	29%	0.289	38%	0.38	S	S	.	.			trans	-65.8	123.8	178.7	-161.2	-14.5	0	0	0	110.7	I60 N62 D66 S71	I60-D64 PolarHBondContact O-N 2.96Å; N62-D64 VanDerWaalsContact C-N 3.34Å; D64-D66 VanDerWaalsContact C-N 3.32Å; D64-D66 PolarHBondContact OD1-N 3.03Å; D64-S71 WeakPolarHBondContact OD2-CB 3.34Å; D64-S71 PolarHBondContact OD2-OG 3.12Å
65	S	69.4	Low	87.4	Confident	119 Å²	119	71 Å²	71	83%	0.832	38%	0.38	S	S	*	.	S	Bend	trans	-82.1	-9.9	-175.1	58.8	0	0	0	0	113.5	S63 P67	S63-S65 PolarHBondContact O-N 3.39Å; S65-P67 WeakPolarHBondContact O-CD 3.5Å
66	D	74.4	Confident	87.3	Confident	85 Å²	85	72.7 Å²	72.7	46%	0.455	39%	0.386	S	S	.	.			trans	-112.1	90.4	172	-172	-4.8	0	0	0	110.9	D64 H68 G69	D64-D66 VanDerWaalsContact C-N 3.32Å; D64-D66 PolarHBondContact OD1-N 3.03Å; D66-H68 PolarHBondContact O-N 2.99Å; D66-H68 PolarHBondContact OD1-N 3.01Å; D66-H68 VanDerWaalsContact OD1-N 3.09Å; D66-G69 PolarHBondContact OD1-N 2.86Å
67	P	65.8	Low	87.3	Confident	83 Å²	83	74.7 Å²	74.7	54%	0.539	40%	0.401	S	S	.	.	S	Bend	trans	-72.6	-11.3	-179.1	27.8	-33.1	0	0	0	113.8	S65	S65-P67 WeakPolarHBondContact O-CD 3.5Å
68	H	69.6	Low	87.4	Confident	180 Å²	180	74.8 Å²	74.8	83%	0.833	40%	0.401	S	S	*	.	S	Bend	trans	-109.3	-11.9	-173.6	-61.8	-53.5	0	0	0	113.6	D66	D66-H68 PolarHBondContact O-N 2.99Å; D66-H68 PolarHBondContact OD1-N 3.01Å; D66-H68 VanDerWaalsContact OD1-N 3.09Å
69	G	78.1	Confident	87.5	Confident	25 Å²	25	72.2 Å²	72.2	26%	0.258	39%	0.392	S	S	.	.	S	Bend	trans	-87.8	174.8	173.2	0	0	0	0	0	114.4	D66 S71	D66-G69 PolarHBondContact OD1-N 2.86Å; G69-S71 PolarHBondContact O-N 2.96Å
70	I	82.9	Confident	87.6	Confident	76 Å²	76	68.4 Å²	68.4	39%	0.39	38%	0.377	S	S	.	.			trans	-75.7	120.8	166.9	-64.2	174.3	0	0	0	107.4	D33 R35 H72	D33-I70 WeakPolarHBondContact O-CA 3.3Å; R35-I70 HydrophobicContact CB-CG2 4Å; I70-H72 PolarHBondContact O-CD2 3.04Å
71	S	87.1	Confident	87.9	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.014	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.8	174.5	-65.3	0	0	0	0	110.4	D33 V34 R35 R47 D64 G69	D33-S71 PolarHBondContact O-N 2.81Å; V34-S71 CarbonylContact C-O 3.56Å; V34-S71 WeakPolarHBondContact CA-O 3.37Å; V34-S71 WeakPolarHBondContact CG2-O 3.24Å; R35-S71 PolarHBondContact N-O 2.9Å; R47-S71 PolarHBondContact NE-OG 3.44Å; D64-S71 WeakPolarHBondContact OD2-CB 3.34Å; D64-S71 PolarHBondContact OD2-OG 3.12Å; G69-S71 PolarHBondContact O-N 2.96Å
72	H	91.1	Very high	88.1	Confident	129 Å²	129	70.8 Å²	70.8	60%	0.597	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.4	176	-70.9	-95.2	0	0	0	110.3	I70	I70-H72 PolarHBondContact O-CD2 3.04Å
73	V	94.3	Very high	88.5	Confident	13 Å²	13	65.6 Å²	65.6	8%	0.079	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.4	178.6	-172.3	0	0	0	0	109.6	V34 R35 L36 Q37 L57 I60 F61 F75	V34-V73 HydrophobicContact CG2-CG2 4.26Å; R35-V73 PolarHBondContact O-N 3.01Å; L36-V73 CarbonylContact C-O 3.58Å; L36-V73 WeakPolarHBondContact CA-O 3.48Å; L36-V73 HydrophobicContact CD2-CB 3.81Å; L36-V73 HydrophobicContact CD2-CG1 4.49Å; L36-V73 HydrophobicContact CD2-CG2 4.26Å; Q37-V73 PolarHBondContact N-O 2.87Å; L57-V73 HydrophobicContact CD2-CG1 4.45Å; I60-V73 HydrophobicContact CG2-CG1 4.43Å; I60-V73 HydrophobicContact CG2-CG2 3.82Å; F61-V73 HydrophobicContact CE1-CG2 3.9Å; V73-F75 HydrophobicContact CB-CE2 4.34Å; V73-F75 HydrophobicContact CG1-CD2 4.41Å; V73-F75 HydrophobicContact CG1-CE1 4.27Å; V73-F75 HydrophobicContact CG1-CE2 3.56Å; V73-F75 HydrophobicContact CG1-CZ 3.46Å; V73-F75 VanDerWaalsContact CG1-CZ 3.46Å
74	K	96.1	Very high	89	Confident	117 Å²	117	64.1 Å²	64.1	51%	0.509	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.9	-174.5	-165.2	175.8	-171.2	-120.6	0	112.1	Q37 D76	Q37-K74 HydrophobicContact CB-CG 4.32Å; Q37-K74 CarbonylContact O-C 3.56Å; Q37-K74 WeakPolarHBondContact O-CA 3.22Å; K74-D76 WeakPolarHBondContact CE-OD1 3.42Å; K74-D76 IonicContact NZ-OD1 3.74Å; K74-D76 PolarHBondContact NZ-OD1 3.36Å; K74-D76 IonicContact NZ-OD2 3.47Å; K74-D76 PolarHBondContact NZ-OD2 3.29Å
75	F	96.9	Very high	89.7	Confident	3 Å²	3	62.3 Å²	62.3	1%	0.013	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	105	174.4	-58.1	-74.2	0	0	0	109.7	L36 Q37 V38 C39 Y56 L57 V73 L78 L112	L36-F75 HydrophobicContact CD2-CE2 4.32Å; Q37-F75 PolarHBondContact O-N 2.84Å; V38-F75 CarbonylContact C-O 3.58Å; V38-F75 VanDerWaalsContact CA-O 3.31Å; V38-F75 WeakPolarHBondContact CA-O 3.43Å; V38-F75 HydrophobicContact CG1-CB 4.47Å; V38-F75 HydrophobicContact CG2-CB 4.41Å; V38-F75 HydrophobicContact CG2-CD2 4.22Å; C39-F75 PolarHBondContact N-O 3.01Å; Y56-F75 AromaticContact CE1-CE1 3.84Å; Y56-F75 HydrophobicContact CE1-CE1 3.84Å; Y56-F75 AromaticContact CE1-CZ 3.98Å; Y56-F75 HydrophobicContact CE1-CZ 3.98Å; L57-F75 HydrophobicContact CD2-CZ 4.14Å; V73-F75 HydrophobicContact CB-CE2 4.34Å; V73-F75 HydrophobicContact CG1-CD2 4.41Å; V73-F75 HydrophobicContact CG1-CE1 4.27Å; V73-F75 HydrophobicContact CG1-CE2 3.56Å; V73-F75 HydrophobicContact CG1-CZ 3.46Å; V73-F75 VanDerWaalsContact CG1-CZ 3.46Å; F75-L78 HydrophobicContact CB-CB 4.19Å; F75-L78 HydrophobicContact CB-CD1 3.88Å; F75-L78 HydrophobicContact CB-CG 4.06Å; F75-L78 HydrophobicContact CD1-CD1 3.91Å; F75-L78 HydrophobicContact CD2-CD1 4.46Å; F75-L78 HydrophobicContact CG-CD1 3.84Å; F75-L78 HydrophobicContact CG-CG 4.5Å; F75-L112 HydrophobicContact CE1-CD2 3.84Å; F75-L112 HydrophobicContact CE2-CD2 4.13Å; F75-L112 HydrophobicContact CZ-CD2 3.49Å; F75-L112 VanDerWaalsContact CZ-CD2 3.49Å
76	D	96.1	Very high	91.1	Very high	98 Å²	98	56.8 Å²	56.8	52%	0.524	29%	0.294	S	S	.	.	S	Bend	trans	-92.6	-6.3	-178.2	-67.3	-44.5	0	0	0	113.3	C39 K74	C39-D76 PolarHBondContact SG-O 2.83Å; K74-D76 WeakPolarHBondContact CE-OD1 3.42Å; K74-D76 IonicContact NZ-OD1 3.74Å; K74-D76 PolarHBondContact NZ-OD1 3.36Å; K74-D76 IonicContact NZ-OD2 3.47Å; K74-D76 PolarHBondContact NZ-OD2 3.29Å
77	D	96.1	Very high	92.2	Very high	106 Å²	106	53 Å²	53	57%	0.567	27%	0.274	S	S	*	.	S	Bend	trans	-118.9	10.9	-173.9	65.9	-35	0	0	0	113.2	K111	D77-K111 IonicContact OD1-NZ 2.65Å; D77-K111 PolarHBondContact OD1-NZ 2.88Å; D77-K111 IonicContact OD2-NZ 2.64Å; D77-K111 PolarHBondContact OD2-NZ 3.29Å
78	L	97.8	Very high	93.7	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.037	26%	0.261	C	S	.	.	S	Bend	trans	-112.1	145	178	-64.8	-174.8	0	0	0	111.1	V38 C39 F75 P80 V83 A108 K111	V38-L78 HydrophobicContact CG1-CB 3.92Å; V38-L78 VanDerWaalsContact CG1-O 3.22Å; V38-L78 WeakPolarHBondContact CG1-O 3.37Å; C39-L78 PolarHBondContact SG-O 3.13Å; F75-L78 HydrophobicContact CB-CB 4.19Å; F75-L78 HydrophobicContact CB-CD1 3.88Å; F75-L78 HydrophobicContact CB-CG 4.06Å; F75-L78 HydrophobicContact CD1-CD1 3.91Å; F75-L78 HydrophobicContact CD2-CD1 4.46Å; F75-L78 HydrophobicContact CG-CD1 3.84Å; F75-L78 HydrophobicContact CG-CG 4.5Å; L78-P80 WeakPolarHBondContact O-CD 3.48Å; L78-V83 HydrophobicContact CB-CG2 3.97Å; L78-V83 HydrophobicContact CD1-CG2 3.85Å; L78-A108 HydrophobicContact CD1-CB 4.32Å; L78-A108 HydrophobicContact CD2-CB 4.1Å; L78-K111 HydrophobicContact CD1-CD 4.14Å; L78-K111 HydrophobicContact CD2-CB 4.34Å; L78-K111 HydrophobicContact CD2-CD 3.87Å; L78-K111 HydrophobicContact CG-CD 4.09Å
79	N	98.1	Very high	95.1	Very high	53 Å²	53	45.3 Å²	45.3	28%	0.283	23%	0.231	S	C	.	.			trans	-70.2	124	169.9	-177.5	-27.6	0	0	0	109.4	E81 A82 V83 L101 D104	N79-E81 VanDerWaalsContact C-N 3.32Å; N79-E81 PolarHBondContact O-N 3.26Å; N79-E81 WeakPolarHBondContact OD1-CB 3.27Å; N79-E81 PolarHBondContact OD1-N 3.49Å; N79-A82 HydrophobicContact CB-CB 3.94Å; N79-A82 WeakPolarHBondContact O-CB 3.43Å; N79-A82 PolarHBondContact O-N 3.38Å; N79-V83 PolarHBondContact O-N 2.96Å; N79-V83 VanDerWaalsContact O-N 3.16Å; N79-L101 WeakPolarHBondContact ND2-CD1 3.21Å; N79-D104 HydrophobicContact CB-CB 3.98Å; N79-D104 PolarHBondContact ND2-OD2 3.37Å
80	P	98.3	Very high	96	Very high	24 Å²	24	44.9 Å²	44.9	16%	0.156	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-42.9	178.7	-23.9	32.6	0	0	0	113.6	V38 C39 H41 M43 L78 A82 V83 E84	V38-P80 HydrophobicContact CB-CB 4.39Å; V38-P80 HydrophobicContact CB-CG 4.44Å; V38-P80 HydrophobicContact CG1-CB 4.23Å; V38-P80 HydrophobicContact CG1-CG 4.05Å; C39-P80 HydrophobicContact CB-CG 4.08Å; H41-P80 HydrophobicContact CB-CB 4.06Å; H41-P80 HydrophobicContact CB-CG 4.31Å; H41-P80 WeakPolarHBondContact ND1-CG 3.35Å; M43-P80 HydrophobicContact CE-CB 3.85Å; M43-P80 WeakPolarHBondContact CE-O 3.44Å; L78-P80 WeakPolarHBondContact O-CD 3.48Å; P80-A82 VanDerWaalsContact C-N 3.29Å; P80-A82 PolarHBondContact O-N 2.95Å; P80-V83 PolarHBondContact O-N 3.47Å; P80-V83 VanDerWaalsContact O-N 3.16Å; P80-E84 PolarHBondContact O-N 3.44Å
81	E	98.3	Very high	96.7	Very high	112 Å²	112	41.3 Å²	41.3	52%	0.523	21%	0.206	S	C	.	.	H	α-helix	trans	-64.9	-38.4	-178.4	-166	-180	-177.6	0	0	111.2	N79 V83 E84 V85 L101	N79-E81 VanDerWaalsContact C-N 3.32Å; N79-E81 PolarHBondContact O-N 3.26Å; N79-E81 WeakPolarHBondContact OD1-CB 3.27Å; N79-E81 PolarHBondContact OD1-N 3.49Å; E81-V83 VanDerWaalsContact C-N 3.34Å; E81-V83 PolarHBondContact O-N 2.98Å; E81-E84 PolarHBondContact O-N 3.15Å; E81-V85 WeakPolarHBondContact O-CG2 3.14Å; E81-V85 PolarHBondContact O-N 3.27Å; E81-L101 HydrophobicContact CB-CD1 4.11Å; E81-L101 HydrophobicContact CB-CD2 4.12Å; E81-L101 HydrophobicContact CG-CD1 4.37Å; E81-L101 HydrophobicContact CG-CD2 3.67Å
82	A	98.4	Very high	97.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.1	-38.4	175.5	0	0	0	0	0	112.4	N79 P80 V85 L86 L101 D104 V105 A108	N79-A82 HydrophobicContact CB-CB 3.94Å; N79-A82 WeakPolarHBondContact O-CB 3.43Å; N79-A82 PolarHBondContact O-N 3.38Å; P80-A82 VanDerWaalsContact C-N 3.29Å; P80-A82 PolarHBondContact O-N 2.95Å; A82-V85 PolarHBondContact O-N 2.85Å; A82-L86 WeakPolarHBondContact O-CG 3.28Å; A82-L86 PolarHBondContact O-N 3.18Å; A82-L101 HydrophobicContact CB-CD1 4.32Å; A82-L101 HydrophobicContact CB-CG 4.38Å; A82-D104 HydrophobicContact CB-CB 3.77Å; A82-V105 HydrophobicContact CB-CG2 4.01Å; A82-A108 HydrophobicContact CB-CB 4.42Å
83	V	98.4	Very high	97.4	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-68.5	-39.5	174.7	179.7	0	0	0	0	110.8	L36 V38 M43 L78 N79 P80 E81 V85 L86 L87 A108	L36-V83 HydrophobicContact CD1-CG1 4.34Å; V38-V83 HydrophobicContact CG1-CG2 4.02Å; V38-V83 HydrophobicContact CG2-CB 4.12Å; V38-V83 HydrophobicContact CG2-CG1 4.02Å; V38-V83 HydrophobicContact CG2-CG2 4.03Å; M43-V83 HydrophobicContact CE-CB 4.4Å; M43-V83 HydrophobicContact SD-CB 4.18Å; M43-V83 HydrophobicContact SD-CG1 3.84Å; L78-V83 HydrophobicContact CB-CG2 3.97Å; L78-V83 HydrophobicContact CD1-CG2 3.85Å; N79-V83 PolarHBondContact O-N 2.96Å; N79-V83 VanDerWaalsContact O-N 3.16Å; P80-V83 PolarHBondContact O-N 3.47Å; P80-V83 VanDerWaalsContact O-N 3.16Å; E81-V83 VanDerWaalsContact C-N 3.34Å; E81-V83 PolarHBondContact O-N 2.98Å; V83-V85 VanDerWaalsContact C-N 3.3Å; V83-V85 PolarHBondContact O-N 3.39Å; V83-L86 WeakPolarHBondContact O-CB 3.39Å; V83-L86 PolarHBondContact O-N 3.04Å; V83-L87 HydrophobicContact CG1-CG 4.4Å; V83-L87 WeakPolarHBondContact O-CG 3.24Å; V83-L87 PolarHBondContact O-N 2.8Å; V83-A108 HydrophobicContact CG2-CB 4.36Å
84	E	98.2	Very high	97.5	Very high	60 Å²	60	45.4 Å²	45.4	28%	0.28	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-37.5	175.5	-172.9	59.2	-145.4	0	0	111.8	R26 M43 P80 E81 L86 L87 N88	R26-E84 IonicContact CZ-OE1 3.35Å; R26-E84 IonicContact NH1-OE1 2.64Å; R26-E84 PolarHBondContact NH1-OE1 3.1Å; R26-E84 IonicContact NH1-OE2 2.98Å; R26-E84 IonicContact NH2-OE1 3.19Å; M43-E84 HydrophobicContact CE-CB 4.34Å; P80-E84 PolarHBondContact O-N 3.44Å; E81-E84 PolarHBondContact O-N 3.15Å; E84-L86 VanDerWaalsContact C-N 3.33Å; E84-L86 PolarHBondContact O-N 3.19Å; E84-L87 PolarHBondContact O-N 2.99Å; E84-N88 WeakPolarHBondContact O-CB 3.35Å; E84-N88 PolarHBondContact O-N 3.2Å; E84-N88 PolarHBondContact O-ND2 3.49Å; E84-N88 PolarHBondContact OE1-ND2 2.95Å
85	V	98.4	Very high	97.5	Very high	16 Å²	16	42.1 Å²	42.1	10%	0.097	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-44.1	171.4	167.8	0	0	0	0	111.6	E81 A82 V83 N88 Y89 L95 K96 A97 L101 V105	E81-V85 WeakPolarHBondContact O-CG2 3.14Å; E81-V85 PolarHBondContact O-N 3.27Å; A82-V85 PolarHBondContact O-N 2.85Å; V83-V85 VanDerWaalsContact C-N 3.3Å; V83-V85 PolarHBondContact O-N 3.39Å; V85-N88 PolarHBondContact O-N 3.27Å; V85-Y89 PolarHBondContact O-N 2.86Å; V85-L95 HydrophobicContact CG1-CD1 3.65Å; V85-L95 HydrophobicContact CG1-CG 4.4Å; V85-K96 WeakPolarHBondContact CG1-O 3.5Å; V85-K96 WeakPolarHBondContact CG2-O 3.36Å; V85-A97 HydrophobicContact CG1-CB 4.18Å; V85-L101 HydrophobicContact CG2-CD2 3.84Å; V85-V105 HydrophobicContact CB-CG2 4.16Å; V85-V105 HydrophobicContact CG1-CG1 3.92Å; V85-V105 HydrophobicContact CG1-CG2 4.04Å; V85-V105 HydrophobicContact CG2-CG2 4.42Å
86	L	98.6	Very high	97.4	Very high	3 Å²	3	49.1 Å²	49.1	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-37.5	178.6	-64.7	178.5	0	0	0	112.5	A82 V83 E84 Y89 A90 L95 V105 A108 A109 L112 M114 V117	A82-L86 WeakPolarHBondContact O-CG 3.28Å; A82-L86 PolarHBondContact O-N 3.18Å; V83-L86 WeakPolarHBondContact O-CB 3.39Å; V83-L86 PolarHBondContact O-N 3.04Å; E84-L86 VanDerWaalsContact C-N 3.33Å; E84-L86 PolarHBondContact O-N 3.19Å; L86-Y89 PolarHBondContact O-N 2.65Å; L86-A90 PolarHBondContact O-N 3.49Å; L86-L95 HydrophobicContact CD2-CD1 4.33Å; L86-V105 HydrophobicContact CD2-CG1 3.7Å; L86-V105 HydrophobicContact CG-CG1 4.16Å; L86-A108 HydrophobicContact CD1-CB 3.57Å; L86-A109 HydrophobicContact CD1-CB 4.23Å; L86-A109 HydrophobicContact CD2-CB 4.06Å; L86-L112 HydrophobicContact CD1-CD1 3.95Å; L86-M114 HydrophobicContact CB-CE 4.33Å; L86-M114 HydrophobicContact CB-SD 3.86Å; L86-M114 HydrophobicContact CD1-SD 3.99Å; L86-M114 HydrophobicContact CD2-SD 4.07Å; L86-M114 HydrophobicContact CG-SD 4.19Å; L86-V117 HydrophobicContact CD2-CB 4.36Å; L86-V117 HydrophobicContact CD2-CG1 3.64Å; L86-V117 HydrophobicContact CD2-CG2 4.48Å
87	L	98.1	Very high	97.4	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-62.3	-46.9	171.8	-67.6	-177.3	0	0	0	110.4	L36 M43 L50 V83 E84 Y89 A90 Y91	L36-L87 HydrophobicContact CD1-CD1 4.42Å; L36-L87 HydrophobicContact CD1-CD2 3.97Å; M43-L87 HydrophobicContact CB-CD1 3.78Å; M43-L87 HydrophobicContact CG-CD1 4.21Å; M43-L87 HydrophobicContact SD-CD1 3.77Å; L50-L87 HydrophobicContact CD1-CD2 4.03Å; L50-L87 HydrophobicContact CD2-CD2 3.46Å; L50-L87 VanDerWaalsContact CD2-CD2 3.46Å; L50-L87 HydrophobicContact CG-CD2 4.39Å; V83-L87 HydrophobicContact CG1-CG 4.4Å; V83-L87 WeakPolarHBondContact O-CG 3.24Å; V83-L87 PolarHBondContact O-N 2.8Å; E84-L87 PolarHBondContact O-N 2.99Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 3.05Å; L87-A90 PolarHBondContact O-N 2.93Å; L87-A90 VanDerWaalsContact O-N 3.1Å; L87-Y91 VanDerWaalsContact O-CD2 3.27Å; L87-Y91 WeakPolarHBondContact O-CD2 3.36Å; L87-Y91 PolarHBondContact O-N 3.08Å
88	N	97.9	Very high	97.3	Very high	51 Å²	51	46.3 Å²	46.3	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-59.6	-41.2	176.5	-73.4	-44.6	0	0	0	111.8	R26 E84 V85 A90 Y91 T92	R26-N88 PolarHBondContact NH2-OD1 3.29Å; E84-N88 WeakPolarHBondContact O-CB 3.35Å; E84-N88 PolarHBondContact O-N 3.2Å; E84-N88 PolarHBondContact O-ND2 3.49Å; E84-N88 PolarHBondContact OE1-ND2 2.95Å; V85-N88 PolarHBondContact O-N 3.27Å; N88-A90 PolarHBondContact O-N 2.84Å; N88-Y91 CarbonylContact O-C 3.6Å; N88-Y91 PolarHBondContact O-N 3.08Å; N88-T92 WeakPolarHBondContact O-CB 3.43Å; N88-T92 WeakPolarHBondContact O-CG2 3.35Å; N88-T92 PolarHBondContact O-N 3.2Å; N88-T92 PolarHBondContact O-OG1 3.37Å
89	Y	98.1	Very high	97	Very high	51 Å²	51	54 Å²	54	20%	0.2	28%	0.283	C	S	.	.	H	α-helix	trans	-58.8	-46.2	172.5	167.5	-91.8	0	0	0	112.3	V85 L86 L87 Y91 T92 A93 Q94 L95 M114 V117	V85-Y89 PolarHBondContact O-N 2.86Å; L86-Y89 PolarHBondContact O-N 2.65Å; L87-Y89 VanDerWaalsContact C-N 3.29Å; L87-Y89 PolarHBondContact O-N 3.05Å; Y89-Y91 PolarHBondContact O-N 3.17Å; Y89-Y91 VanDerWaalsContact O-N 3.15Å; Y89-T92 PolarHBondContact O-N 3.16Å; Y89-A93 VanDerWaalsContact O-CA 3.28Å; Y89-A93 WeakPolarHBondContact O-CA 3.38Å; Y89-A93 PolarHBondContact O-N 3.18Å; Y89-Q94 WeakPolarHBondContact CA-O 3.22Å; Y89-L95 HydrophobicContact CD2-CB 4.13Å; Y89-L95 HydrophobicContact CG-CD1 4.43Å; Y89-M114 HydrophobicContact CD1-CE 3.7Å; Y89-M114 HydrophobicContact CE1-CE 4.07Å; Y89-V117 HydrophobicContact CD1-CG2 3.51Å; Y89-V117 HydrophobicContact CD2-CG2 3.98Å; Y89-V117 HydrophobicContact CE1-CG2 3.39Å; Y89-V117 HydrophobicContact CE2-CG2 3.85Å; Y89-V117 HydrophobicContact CG-CG2 3.81Å
90	A	97.8	Very high	96.8	Very high	15 Å²	15	59 Å²	59	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-27.8	180	0	0	0	0	0	113.2	V49 L50 C53 L86 L87 N88	V49-A90 HydrophobicContact CG1-CB 4.38Å; L50-A90 HydrophobicContact CD2-CB 4.26Å; C53-A90 HydrophobicContact CB-CB 4.28Å; L86-A90 PolarHBondContact O-N 3.49Å; L87-A90 PolarHBondContact O-N 2.93Å; L87-A90 VanDerWaalsContact O-N 3.1Å; N88-A90 PolarHBondContact O-N 2.84Å
91	Y	97.6	Very high	96.7	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-106	0.2	-177.1	-76.6	-94.7	0	0	0	114.7	V19 L22 N23 R26 H46 V49 L50 L87 N88 Y89	V19-Y91 WeakPolarHBondContact CG1-O 3.5Å; L22-Y91 HydrophobicContact CB-CD1 4.18Å; L22-Y91 HydrophobicContact CB-CE1 4.24Å; N23-Y91 HydrophobicContact CB-CD1 4.17Å; N23-Y91 HydrophobicContact CB-CG 4.42Å; N23-Y91 WeakPolarHBondContact OD1-CB 3.42Å; R26-Y91 HydrophobicContact CB-CD1 4.31Å; R26-Y91 HydrophobicContact CB-CE1 3.87Å; R26-Y91 HydrophobicContact CG-CE1 4.46Å; H46-Y91 WeakPolarHBondContact CB-OH 3.25Å; H46-Y91 PolarHBondContact N-OH 3.06Å; H46-Y91 AromaticContact ND1-CE1 3.54Å; H46-Y91 AromaticContact ND1-CZ 3.63Å; H46-Y91 PolarHBondContact ND1-OH 3.24Å; V49-Y91 HydrophobicContact CB-CE1 4.08Å; V49-Y91 HydrophobicContact CB-CE2 4.09Å; V49-Y91 HydrophobicContact CG1-CD1 4.17Å; V49-Y91 HydrophobicContact CG1-CD2 3.94Å; V49-Y91 HydrophobicContact CG1-CE1 3.85Å; V49-Y91 HydrophobicContact CG1-CE2 3.57Å; V49-Y91 HydrophobicContact CG1-CG 4.24Å; V49-Y91 HydrophobicContact CG2-CE1 3.86Å; L50-Y91 HydrophobicContact CD2-CE2 4.14Å; L87-Y91 VanDerWaalsContact O-CD2 3.27Å; L87-Y91 WeakPolarHBondContact O-CD2 3.36Å; L87-Y91 PolarHBondContact O-N 3.08Å; N88-Y91 CarbonylContact O-C 3.6Å; N88-Y91 PolarHBondContact O-N 3.08Å; Y89-Y91 PolarHBondContact O-N 3.17Å; Y89-Y91 VanDerWaalsContact O-N 3.15Å
92	T	96.2	Very high	96.6	Very high	49 Å²	49	53.6 Å²	53.6	30%	0.301	28%	0.278	S	S	.	.	H	α-helix	trans	-140.4	-8.9	-177.9	66.8	0	0	0	0	114	N23 N88 Y89 Q94	N23-T92 WeakPolarHBondContact ND2-CG2 3.2Å; N88-T92 WeakPolarHBondContact O-CB 3.43Å; N88-T92 WeakPolarHBondContact O-CG2 3.35Å; N88-T92 PolarHBondContact O-N 3.2Å; N88-T92 PolarHBondContact O-OG1 3.37Å; Y89-T92 PolarHBondContact O-N 3.16Å; T92-Q94 PolarHBondContact O-N 2.71Å; T92-Q94 VanDerWaalsContact O-N 3.08Å; T92-Q94 PolarHBondContact OG1-N 2.8Å
93	A	95.6	Very high	96.5	Very high	80 Å²	80	61.3 Å²	61.3	66%	0.661	31%	0.312	S	S	*	.	S	Bend	trans	56.5	11.6	-167.4	0	0	0	0	0	114.7	Y89	Y89-A93 VanDerWaalsContact O-CA 3.28Å; Y89-A93 WeakPolarHBondContact O-CA 3.38Å; Y89-A93 PolarHBondContact O-N 3.18Å
94	Q	95.6	Very high	96.5	Very high	100 Å²	100	64.6 Å²	64.6	47%	0.467	33%	0.329	S	S	.	.			trans	-109	126.2	179.2	-64.5	179.9	12.7	0	0	110.5	Y89 T92	Y89-Q94 WeakPolarHBondContact CA-O 3.22Å; T92-Q94 PolarHBondContact O-N 2.71Å; T92-Q94 VanDerWaalsContact O-N 3.08Å; T92-Q94 PolarHBondContact OG1-N 2.8Å
95	L	96.4	Very high	96.5	Very high	48 Å²	48	61.8 Å²	61.8	25%	0.251	32%	0.316	S	S	.	.			trans	-98.8	106.1	173.2	-169.5	74.8	0	0	0	109.1	V85 L86 Y89 V105 V117 L121	V85-L95 HydrophobicContact CG1-CD1 3.65Å; V85-L95 HydrophobicContact CG1-CG 4.4Å; L86-L95 HydrophobicContact CD2-CD1 4.33Å; Y89-L95 HydrophobicContact CD2-CB 4.13Å; Y89-L95 HydrophobicContact CG-CD1 4.43Å; L95-V105 HydrophobicContact CD1-CG1 4.21Å; L95-V117 HydrophobicContact CD1-CG1 3.72Å; L95-V117 HydrophobicContact CD1-CG2 4.38Å; L95-V117 HydrophobicContact CD2-CG1 3.75Å; L95-V117 HydrophobicContact CG-CG1 4.4Å; L95-L121 HydrophobicContact CD2-CD1 4.31Å; L95-L121 HydrophobicContact CD2-CD2 3.77Å; L95-L121 HydrophobicContact CD2-CG 3.96Å
96	K	96.1	Very high	96.4	Very high	151 Å²	151	64.4 Å²	64.4	66%	0.657	33%	0.325	S	S	*	.			trans	-116	110.7	177.2	-64.9	179.2	-176.2	169.1	0	108.4	V85	V85-K96 WeakPolarHBondContact CG1-O 3.5Å; V85-K96 WeakPolarHBondContact CG2-O 3.36Å
97	A	95.7	Very high	96.4	Very high	35 Å²	35	67.2 Å²	67.2	29%	0.289	35%	0.345	S	S	.	.			trans	-138.7	137.6	179	0	0	0	0	0	109.3	V85 V102 V105	V85-A97 HydrophobicContact CG1-CB 4.18Å; A97-V102 HydrophobicContact CB-CG2 4.47Å; A97-V105 HydrophobicContact CB-CG2 3.96Å
98	D	93.9	Very high	96.4	Very high	109 Å²	109	67 Å²	67	58%	0.583	34%	0.343	S	S	*	.			trans	-68.8	152.8	169.4	-66.8	-27.9	0	0	0	110.2	E100 L101 V102	D98-E100 PolarHBondContact O-N 3.26Å; D98-E100 VanDerWaalsContact O-N 3.16Å; D98-L101 PolarHBondContact O-N 2.89Å; D98-V102 PolarHBondContact O-N 2.93Å
99	K	91.6	Very high	96.4	Very high	169 Å²	169	64.5 Å²	64.5	74%	0.735	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-34.8	-172.7	-73.3	-177.4	179.5	178.6	0	112	L101	K99-L101 VanDerWaalsContact C-N 3.3Å
100	E	93.9	Very high	96.4	Very high	158 Å²	158	68.3 Å²	68.3	74%	0.738	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-34.5	179.5	-60.9	73	-158.5	0	0	111.2	D98	D98-E100 PolarHBondContact O-N 3.26Å; D98-E100 VanDerWaalsContact O-N 3.16Å
101	L	96.4	Very high	96.4	Very high	11 Å²	11	71.1 Å²	71.1	6%	0.058	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-18	-177	-162.3	70.2	0	0	0	112.9	N79 E81 A82 V85 D98 K99 K103 D104 V105	N79-L101 WeakPolarHBondContact ND2-CD1 3.21Å; E81-L101 HydrophobicContact CB-CD1 4.11Å; E81-L101 HydrophobicContact CB-CD2 4.12Å; E81-L101 HydrophobicContact CG-CD1 4.37Å; E81-L101 HydrophobicContact CG-CD2 3.67Å; A82-L101 HydrophobicContact CB-CD1 4.32Å; A82-L101 HydrophobicContact CB-CG 4.38Å; V85-L101 HydrophobicContact CG2-CD2 3.84Å; D98-L101 PolarHBondContact O-N 2.89Å; K99-L101 VanDerWaalsContact C-N 3.3Å; L101-K103 PolarHBondContact O-N 3.35Å; L101-K103 VanDerWaalsContact O-N 3.08Å; L101-D104 HydrophobicContact CD1-CB 4.22Å; L101-D104 WeakPolarHBondContact O-CA 3.37Å; L101-D104 WeakPolarHBondContact O-CB 3.38Å; L101-D104 PolarHBondContact O-N 2.68Å; L101-V105 HydrophobicContact CD2-CG2 4.05Å; L101-V105 HydrophobicContact CG-CG2 3.92Å; L101-V105 WeakPolarHBondContact O-CG2 3.46Å; L101-V105 PolarHBondContact O-N 2.98Å
102	V	96.1	Very high	96.4	Very high	12 Å²	12	71.2 Å²	71.2	7%	0.073	36%	0.358	C	S	.	.	H	α-helix	trans	-48.4	-41.9	-175.4	161.8	0	0	0	0	113.6	A97 D98 V105 Y106 L121 F124	A97-V102 HydrophobicContact CB-CG2 4.47Å; D98-V102 PolarHBondContact O-N 2.93Å; V102-V105 PolarHBondContact O-N 3.34Å; V102-Y106 WeakPolarHBondContact O-CB 3.45Å; V102-Y106 PolarHBondContact O-N 3.37Å; V102-L121 HydrophobicContact CG1-CD2 4.2Å; V102-F124 HydrophobicContact CG1-CD1 4.06Å; V102-F124 HydrophobicContact CG1-CE1 4.24Å; V102-F124 HydrophobicContact CG2-CE1 4.16Å
103	K	95.5	Very high	96.5	Very high	162 Å²	162	72.9 Å²	72.9	70%	0.704	36%	0.361	S	S	*	.	H	α-helix	trans	-66.5	-39.9	179.5	-70.6	-178.4	-179.5	174.9	0	112.2	L101 Y106 S107	L101-K103 PolarHBondContact O-N 3.35Å; L101-K103 VanDerWaalsContact O-N 3.08Å; K103-Y106 PolarHBondContact O-N 3.16Å; K103-S107 PolarHBondContact O-N 2.97Å
104	D	97.8	Very high	96.6	Very high	69 Å²	69	69.6 Å²	69.6	37%	0.369	33%	0.332	S	S	.	.	H	α-helix	trans	-70.2	-41.4	177.8	-68	-19	0	0	0	110.9	N79 A82 L101 Y106 S107 A108	N79-D104 HydrophobicContact CB-CB 3.98Å; N79-D104 PolarHBondContact ND2-OD2 3.37Å; A82-D104 HydrophobicContact CB-CB 3.77Å; L101-D104 HydrophobicContact CD1-CB 4.22Å; L101-D104 WeakPolarHBondContact O-CA 3.37Å; L101-D104 WeakPolarHBondContact O-CB 3.38Å; L101-D104 PolarHBondContact O-N 2.68Å; D104-Y106 VanDerWaalsContact C-N 3.29Å; D104-Y106 PolarHBondContact O-N 2.88Å; D104-S107 WeakPolarHBondContact O-CB 3.39Å; D104-S107 PolarHBondContact O-N 3.24Å; D104-A108 WeakPolarHBondContact O-CB 3.38Å; D104-A108 PolarHBondContact O-N 3.47Å
105	V	98.3	Very high	96.6	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-41.5	173.7	-173.7	0	0	0	0	110.5	A82 V85 L86 L95 A97 L101 V102 A108 A109 L121	A82-V105 HydrophobicContact CB-CG2 4.01Å; V85-V105 HydrophobicContact CB-CG2 4.16Å; V85-V105 HydrophobicContact CG1-CG1 3.92Å; V85-V105 HydrophobicContact CG1-CG2 4.04Å; V85-V105 HydrophobicContact CG2-CG2 4.42Å; L86-V105 HydrophobicContact CD2-CG1 3.7Å; L86-V105 HydrophobicContact CG-CG1 4.16Å; L95-V105 HydrophobicContact CD1-CG1 4.21Å; A97-V105 HydrophobicContact CB-CG2 3.96Å; L101-V105 HydrophobicContact CD2-CG2 4.05Å; L101-V105 HydrophobicContact CG-CG2 3.92Å; L101-V105 WeakPolarHBondContact O-CG2 3.46Å; L101-V105 PolarHBondContact O-N 2.98Å; V102-V105 PolarHBondContact O-N 3.34Å; V105-A108 PolarHBondContact O-N 3.29Å; V105-A109 VanDerWaalsContact O-CB 3.23Å; V105-A109 WeakPolarHBondContact O-CB 3.3Å; V105-A109 PolarHBondContact O-N 2.96Å; V105-L121 HydrophobicContact CB-CD1 3.94Å; V105-L121 HydrophobicContact CG1-CD1 3.62Å
106	Y	97.8	Very high	96.6	Very high	71 Å²	71	75.8 Å²	75.8	28%	0.278	35%	0.353	S	S	.	.	H	α-helix	trans	-62.4	-45.1	175.2	172.6	-97.2	0	0	0	111.9	V102 K103 D104 A109 K110 K118 L121 L122	V102-Y106 WeakPolarHBondContact O-CB 3.45Å; V102-Y106 PolarHBondContact O-N 3.37Å; K103-Y106 PolarHBondContact O-N 3.16Å; D104-Y106 VanDerWaalsContact C-N 3.29Å; D104-Y106 PolarHBondContact O-N 2.88Å; Y106-A109 PolarHBondContact O-N 3.19Å; Y106-K110 WeakPolarHBondContact O-CB 3.17Å; Y106-K110 PolarHBondContact O-N 3.49Å; Y106-K118 HydrophobicContact CD2-CG 4.07Å; Y106-K118 HydrophobicContact CE2-CG 3.55Å; Y106-L121 HydrophobicContact CD2-CB 4.08Å; Y106-L122 HydrophobicContact CE2-CB 4.12Å
107	S	97.4	Very high	96.6	Very high	63 Å²	63	68.7 Å²	68.7	44%	0.441	32%	0.323	S	S	.	.	H	α-helix	trans	-60.6	-47.7	177.7	-170.7	0	0	0	0	111.6	K103 D104 K110 K111	K103-S107 PolarHBondContact O-N 2.97Å; D104-S107 WeakPolarHBondContact O-CB 3.39Å; D104-S107 PolarHBondContact O-N 3.24Å; S107-K110 PolarHBondContact O-N 3.34Å; S107-K111 PolarHBondContact O-N 3.11Å
108	A	98.3	Very high	96.7	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-44.8	176.1	0	0	0	0	0	111.8	L78 A82 V83 L86 D104 V105 K110 K111 L112	L78-A108 HydrophobicContact CD1-CB 4.32Å; L78-A108 HydrophobicContact CD2-CB 4.1Å; A82-A108 HydrophobicContact CB-CB 4.42Å; V83-A108 HydrophobicContact CG2-CB 4.36Å; L86-A108 HydrophobicContact CD1-CB 3.57Å; D104-A108 WeakPolarHBondContact O-CB 3.38Å; D104-A108 PolarHBondContact O-N 3.47Å; V105-A108 PolarHBondContact O-N 3.29Å; A108-K110 VanDerWaalsContact C-N 3.31Å; A108-K110 PolarHBondContact O-N 2.56Å; A108-K111 PolarHBondContact O-N 3.04Å; A108-L112 WeakPolarHBondContact O-CB 3.33Å; A108-L112 WeakPolarHBondContact O-CG 3.37Å; A108-L112 PolarHBondContact O-N 3.29Å
109	A	98.4	Very high	96.7	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-39.2	178.3	0	0	0	0	0	111.8	L86 V105 Y106 K113 M114 V117 K118	L86-A109 HydrophobicContact CD1-CB 4.23Å; L86-A109 HydrophobicContact CD2-CB 4.06Å; V105-A109 VanDerWaalsContact O-CB 3.23Å; V105-A109 WeakPolarHBondContact O-CB 3.3Å; V105-A109 PolarHBondContact O-N 2.96Å; Y106-A109 PolarHBondContact O-N 3.19Å; A109-K113 PolarHBondContact O-N 3.26Å; A109-K113 VanDerWaalsContact O-N 3.08Å; A109-M114 HydrophobicContact CB-CB 4.31Å; A109-M114 PolarHBondContact O-N 2.88Å; A109-V117 HydrophobicContact CB-CB 4.27Å; A109-V117 HydrophobicContact CB-CG1 3.95Å; A109-K118 HydrophobicContact CB-CB 4.27Å
110	K	97.8	Very high	96.9	Very high	131 Å²	131	68 Å²	68	57%	0.57	31%	0.312	S	S	*	.	H	α-helix	trans	-63	-47.6	173.8	-178.3	-176.3	175.9	-173.8	0	111.1	Y106 S107 A108 K113 K118	Y106-K110 WeakPolarHBondContact O-CB 3.17Å; Y106-K110 PolarHBondContact O-N 3.49Å; S107-K110 PolarHBondContact O-N 3.34Å; A108-K110 VanDerWaalsContact C-N 3.31Å; A108-K110 PolarHBondContact O-N 2.56Å; K110-K113 PolarHBondContact O-N 3.42Å; K110-K118 HydrophobicContact CB-CD 4.19Å; K110-K118 HydrophobicContact CB-CG 4.46Å; K110-K118 HydrophobicContact CG-CD 4.35Å
111	K	97.7	Very high	97	Very high	73 Å²	73	60.8 Å²	60.8	32%	0.317	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-44.5	179.7	-176.1	164.9	-173.6	163.3	0	112	D77 L78 S107 A108 K113	D77-K111 IonicContact OD1-NZ 2.65Å; D77-K111 PolarHBondContact OD1-NZ 2.88Å; D77-K111 IonicContact OD2-NZ 2.64Å; D77-K111 PolarHBondContact OD2-NZ 3.29Å; L78-K111 HydrophobicContact CD1-CD 4.14Å; L78-K111 HydrophobicContact CD2-CB 4.34Å; L78-K111 HydrophobicContact CD2-CD 3.87Å; L78-K111 HydrophobicContact CG-CD 4.09Å; S107-K111 PolarHBondContact O-N 3.11Å; A108-K111 PolarHBondContact O-N 3.04Å; K111-K113 PolarHBondContact O-N 3.15Å
112	L	97.9	Very high	96.8	Very high	5 Å²	5	64 Å²	64	3%	0.026	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	7.2	178.4	-60.2	177.6	0	0	0	113.1	S54 Y56 L57 F75 L86 A108 M114	S54-L112 WeakPolarHBondContact CB-O 3.33Å; S54-L112 PolarHBondContact OG-O 3.36Å; Y56-L112 HydrophobicContact CD1-CD2 4.03Å; Y56-L112 HydrophobicContact CE1-CD2 4.29Å; L57-L112 HydrophobicContact CD1-CD2 4.44Å; L57-L112 HydrophobicContact CD2-CD2 4.34Å; L57-L112 HydrophobicContact CG-CD2 4.34Å; F75-L112 HydrophobicContact CE1-CD2 3.84Å; F75-L112 HydrophobicContact CE2-CD2 4.13Å; F75-L112 HydrophobicContact CZ-CD2 3.49Å; F75-L112 VanDerWaalsContact CZ-CD2 3.49Å; L86-L112 HydrophobicContact CD1-CD1 3.95Å; A108-L112 WeakPolarHBondContact O-CB 3.33Å; A108-L112 WeakPolarHBondContact O-CG 3.37Å; A108-L112 PolarHBondContact O-N 3.29Å; L112-M114 HydrophobicContact CB-CG 4.1Å; L112-M114 HydrophobicContact CB-SD 4.37Å; L112-M114 PolarHBondContact O-N 3.35Å; L112-M114 VanDerWaalsContact O-N 3.15Å
113	K	98.1	Very high	96.5	Very high	83 Å²	83	70.1 Å²	70.1	36%	0.361	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	35	-178.4	-60	-178.3	-173.6	169.1	0	113.8	P55 E59 A109 K110 K111 D115	P55-K113 WeakPolarHBondContact CD-O 3.4Å; E59-K113 IonicContact OE1-NZ 3.53Å; E59-K113 IonicContact OE2-NZ 2.98Å; E59-K113 PolarHBondContact OE2-NZ 2.98Å; A109-K113 PolarHBondContact O-N 3.26Å; A109-K113 VanDerWaalsContact O-N 3.08Å; K110-K113 PolarHBondContact O-N 3.42Å; K111-K113 PolarHBondContact O-N 3.15Å; K113-D115 VanDerWaalsContact C-N 3.34Å; K113-D115 PolarHBondContact O-N 3.41Å; K113-D115 VanDerWaalsContact O-N 3.1Å
114	M	98.3	Very high	96.2	Very high	12 Å²	12	66.4 Å²	66.4	6%	0.059	30%	0.302	C	S	.	.			trans	-84.9	74.4	176.2	-64	-179	80.6	0	0	110.4	C53 L86 Y89 A109 L112 R116 V117 K118	C53-M114 HydrophobicContact CB-CE 3.87Å; L86-M114 HydrophobicContact CB-CE 4.33Å; L86-M114 HydrophobicContact CB-SD 3.86Å; L86-M114 HydrophobicContact CD1-SD 3.99Å; L86-M114 HydrophobicContact CD2-SD 4.07Å; L86-M114 HydrophobicContact CG-SD 4.19Å; Y89-M114 HydrophobicContact CD1-CE 3.7Å; Y89-M114 HydrophobicContact CE1-CE 4.07Å; A109-M114 HydrophobicContact CB-CB 4.31Å; A109-M114 PolarHBondContact O-N 2.88Å; L112-M114 HydrophobicContact CB-CG 4.1Å; L112-M114 HydrophobicContact CB-SD 4.37Å; L112-M114 PolarHBondContact O-N 3.35Å; L112-M114 VanDerWaalsContact O-N 3.15Å; M114-R116 PolarHBondContact O-N 2.99Å; M114-V117 HydrophobicContact CB-CB 4.46Å; M114-V117 PolarHBondContact O-N 3.3Å; M114-K118 PolarHBondContact O-N 3.15Å
115	D	95.8	Very high	95.7	Very high	76 Å²	76	64.9 Å²	64.9	41%	0.406	30%	0.296	S	S	.	.	H	α-helix	trans	-60.8	-37.4	-164.8	-76	-33.6	0	0	0	115	K113 V117 K118 Q119	K113-D115 VanDerWaalsContact C-N 3.34Å; K113-D115 PolarHBondContact O-N 3.41Å; K113-D115 VanDerWaalsContact O-N 3.1Å; D115-V117 PolarHBondContact O-N 3.1Å; D115-K118 PolarHBondContact O-N 3.29Å; D115-K118 WeakPolarHBondContact OD1-CE 3.06Å; D115-K118 IonicContact OD1-NZ 2.76Å; D115-K118 PolarHBondContact OD1-NZ 3.29Å; D115-Q119 WeakPolarHBondContact O-CB 3.33Å; D115-Q119 VanDerWaalsContact O-CG 3.24Å; D115-Q119 WeakPolarHBondContact O-CG 3.18Å; D115-Q119 PolarHBondContact O-N 3.16Å
116	R	95.8	Very high	95.1	Very high	201 Å²	201	69.9 Å²	69.9	76%	0.758	32%	0.322	S	S	*	.	H	α-helix	trans	-60.8	-46.5	177.9	-67.5	-173.6	178.7	-146.1	0.6	111.7	M114 H120	M114-R116 PolarHBondContact O-N 2.99Å; R116-H120 WeakPolarHBondContact O-CB 3.05Å; R116-H120 PolarHBondContact O-N 2.58Å; R116-H120 VanDerWaalsContact O-N 3.08Å
117	V	96.8	Very high	94.4	Very high	3 Å²	3	71.4 Å²	71.4	2%	0.018	33%	0.332	C	S	.	.	H	α-helix	trans	-66.3	-46.7	177.6	175.1	0	0	0	0	110.4	L86 Y89 L95 A109 M114 D115 Q119 H120 L121	L86-V117 HydrophobicContact CD2-CB 4.36Å; L86-V117 HydrophobicContact CD2-CG1 3.64Å; L86-V117 HydrophobicContact CD2-CG2 4.48Å; Y89-V117 HydrophobicContact CD1-CG2 3.51Å; Y89-V117 HydrophobicContact CD2-CG2 3.98Å; Y89-V117 HydrophobicContact CE1-CG2 3.39Å; Y89-V117 HydrophobicContact CE2-CG2 3.85Å; Y89-V117 HydrophobicContact CG-CG2 3.81Å; L95-V117 HydrophobicContact CD1-CG1 3.72Å; L95-V117 HydrophobicContact CD1-CG2 4.38Å; L95-V117 HydrophobicContact CD2-CG1 3.75Å; L95-V117 HydrophobicContact CG-CG1 4.4Å; A109-V117 HydrophobicContact CB-CB 4.27Å; A109-V117 HydrophobicContact CB-CG1 3.95Å; M114-V117 HydrophobicContact CB-CB 4.46Å; M114-V117 PolarHBondContact O-N 3.3Å; D115-V117 PolarHBondContact O-N 3.1Å; V117-Q119 VanDerWaalsContact C-N 3.33Å; V117-Q119 PolarHBondContact O-N 3.02Å; V117-H120 PolarHBondContact O-N 3.46Å; V117-L121 HydrophobicContact CG1-CD1 3.74Å; V117-L121 HydrophobicContact CG1-CG 4.26Å; V117-L121 WeakPolarHBondContact O-CG 3.42Å; V117-L121 PolarHBondContact O-N 2.83Å
118	K	96.8	Very high	93.3	Very high	55 Å²	55	70.3 Å²	70.3	24%	0.239	32%	0.324	C	S	.	.	H	α-helix	trans	-55.2	-46.8	177.5	-175.3	-167	75.5	-167.3	0	111.9	Y106 A109 K110 M114 D115 L122	Y106-K118 HydrophobicContact CD2-CG 4.07Å; Y106-K118 HydrophobicContact CE2-CG 3.55Å; A109-K118 HydrophobicContact CB-CB 4.27Å; K110-K118 HydrophobicContact CB-CD 4.19Å; K110-K118 HydrophobicContact CB-CG 4.46Å; K110-K118 HydrophobicContact CG-CD 4.35Å; M114-K118 PolarHBondContact O-N 3.15Å; D115-K118 PolarHBondContact O-N 3.29Å; D115-K118 WeakPolarHBondContact OD1-CE 3.06Å; D115-K118 IonicContact OD1-NZ 2.76Å; D115-K118 PolarHBondContact OD1-NZ 3.29Å; K118-L122 WeakPolarHBondContact O-CB 3.33Å; K118-L122 PolarHBondContact O-N 3.08Å
119	Q	95.3	Very high	91.3	Very high	126 Å²	126	75 Å²	75	59%	0.589	35%	0.353	S	S	*	.	H	α-helix	trans	-65.3	-43.6	179	-74.9	172.6	-3.8	0	0	111.8	D115 V117 L122 Y123	D115-Q119 WeakPolarHBondContact O-CB 3.33Å; D115-Q119 VanDerWaalsContact O-CG 3.24Å; D115-Q119 WeakPolarHBondContact O-CG 3.18Å; D115-Q119 PolarHBondContact O-N 3.16Å; V117-Q119 VanDerWaalsContact C-N 3.33Å; V117-Q119 PolarHBondContact O-N 3.02Å; Q119-L122 PolarHBondContact O-N 3.41Å; Q119-Y123 PolarHBondContact O-N 3.48Å
120	H	95.3	Very high	89.2	Confident	117 Å²	117	78.8 Å²	78.8	54%	0.542	38%	0.379	S	S	.	.	H	α-helix	trans	-61.5	-45.2	177.5	-171.8	77	0	0	0	112	R116 V117 Y123 F124	R116-H120 WeakPolarHBondContact O-CB 3.05Å; R116-H120 PolarHBondContact O-N 2.58Å; R116-H120 VanDerWaalsContact O-N 3.08Å; V117-H120 PolarHBondContact O-N 3.46Å; H120-Y123 PolarHBondContact O-N 2.76Å; H120-F124 WeakPolarHBondContact O-CB 3.31Å; H120-F124 PolarHBondContact O-N 3.3Å
121	L	94.8	Very high	86.8	Confident	7 Å²	7	77.8 Å²	77.8	4%	0.037	38%	0.384	C	S	.	.	H	α-helix	trans	-67.6	-36.9	177.5	-67.9	173.7	0	0	0	112.6	L95 V102 V105 Y106 V117 F124 C125	L95-L121 HydrophobicContact CD2-CD1 4.31Å; L95-L121 HydrophobicContact CD2-CD2 3.77Å; L95-L121 HydrophobicContact CD2-CG 3.96Å; V102-L121 HydrophobicContact CG1-CD2 4.2Å; V105-L121 HydrophobicContact CB-CD1 3.94Å; V105-L121 HydrophobicContact CG1-CD1 3.62Å; Y106-L121 HydrophobicContact CD2-CB 4.08Å; V117-L121 HydrophobicContact CG1-CD1 3.74Å; V117-L121 HydrophobicContact CG1-CG 4.26Å; V117-L121 WeakPolarHBondContact O-CG 3.42Å; V117-L121 PolarHBondContact O-N 2.83Å; L121-F124 PolarHBondContact O-N 3.28Å; L121-C125 WeakPolarHBondContact O-CB 3.1Å; L121-C125 PolarHBondContact O-N 3.26Å; L121-C125 PolarHBondContact O-SG 3.44Å
122	L	92.3	Very high	84.2	Confident	77 Å²	77	79.3 Å²	79.3	40%	0.403	40%	0.404	S	S	.	.	H	α-helix	trans	-61.9	-47.1	174	-179.6	61.9	0	0	0	111.2	Y106 K118 Q119 F124 C125 L126	Y106-L122 HydrophobicContact CE2-CB 4.12Å; K118-L122 WeakPolarHBondContact O-CB 3.33Å; K118-L122 PolarHBondContact O-N 3.08Å; Q119-L122 PolarHBondContact O-N 3.41Å; L122-F124 PolarHBondContact O-N 3.06Å; L122-C125 PolarHBondContact O-N 3.22Å; L122-L126 HydrophobicContact CD1-CD1 4.19Å; L122-L126 HydrophobicContact CD1-CG 4.32Å; L122-L126 HydrophobicContact CG-CD1 4.09Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 3.02Å
123	Y	90.9	Very high	81.4	Confident	141 Å²	141	83.5 Å²	83.5	55%	0.553	43%	0.434	S	S	*	.	H	α-helix	trans	-58.2	-48.9	175.3	175.3	-92.7	0	0	0	111.1	Q119 H120 C125 L126 H127	Q119-Y123 PolarHBondContact O-N 3.48Å; H120-Y123 PolarHBondContact O-N 2.76Å; Y123-C125 PolarHBondContact O-N 3.47Å; Y123-L126 PolarHBondContact O-N 3.14Å; Y123-H127 AromaticContact CD2-CE1 3.36Å; Y123-H127 WeakPolarHBondContact CD2-CE1 3.35Å; Y123-H127 AromaticContact CD2-ND1 3.57Å; Y123-H127 AromaticContact CE2-CE1 3.13Å; Y123-H127 WeakPolarHBondContact CE2-CE1 3.01Å; Y123-H127 AromaticContact CE2-ND1 3.49Å; Y123-H127 WeakPolarHBondContact CE2-ND1 3.07Å; Y123-H127 AromaticContact CE2-NE2 3.61Å; Y123-H127 AromaticContact CG-ND1 3.96Å; Y123-H127 AromaticContact CZ-CE1 3.82Å; Y123-H127 AromaticContact CZ-ND1 3.81Å; Y123-H127 PolarHBondContact O-N 3.25Å; Y123-H127 PolarHBondContact O-ND1 2.86Å
124	F	89.3	Confident	78.5	Confident	85 Å²	85	86.8 Å²	86.8	37%	0.373	46%	0.455	S	S	.	.	H	α-helix	trans	-56.4	-50.3	177.4	176.6	-94.8	0	0	0	111.6	V102 H120 L121 L122 L126 H127 S128	V102-F124 HydrophobicContact CG1-CD1 4.06Å; V102-F124 HydrophobicContact CG1-CE1 4.24Å; V102-F124 HydrophobicContact CG2-CE1 4.16Å; H120-F124 WeakPolarHBondContact O-CB 3.31Å; H120-F124 PolarHBondContact O-N 3.3Å; L121-F124 PolarHBondContact O-N 3.28Å; L122-F124 PolarHBondContact O-N 3.06Å; F124-L126 PolarHBondContact O-N 3.35Å; F124-H127 PolarHBondContact O-N 3.25Å; F124-S128 VanDerWaalsContact O-CB 3.3Å; F124-S128 WeakPolarHBondContact O-CB 3.4Å; F124-S128 PolarHBondContact O-N 2.98Å; F124-S128 PolarHBondContact O-OG 3.09Å
125	C	86.3	Confident	75.5	Confident	37 Å²	37	97.3 Å²	97.3	25%	0.25	51%	0.51	C	S	.	.	H	α-helix	trans	-60.2	-41.3	-179.9	-73.9	0	0	0	0	112.9	L121 L122 Y123 H127 S128 T129	L121-C125 WeakPolarHBondContact O-CB 3.1Å; L121-C125 PolarHBondContact O-N 3.26Å; L121-C125 PolarHBondContact O-SG 3.44Å; L122-C125 PolarHBondContact O-N 3.22Å; Y123-C125 PolarHBondContact O-N 3.47Å; C125-H127 VanDerWaalsContact C-N 3.33Å; C125-H127 PolarHBondContact O-N 3.48Å; C125-S128 WeakPolarHBondContact CA-OG 3.19Å; C125-S128 PolarHBondContact O-OG 3.35Å; C125-T129 WeakPolarHBondContact O-CG2 3.41Å; C125-T129 PolarHBondContact O-N 3.29Å; C125-T129 PolarHBondContact O-OG1 3.41Å; C125-T129 VanDerWaalsContact O-OG1 3.13Å
126	L	86.1	Confident	74.5	Confident	105 Å²	105	98.4 Å²	98.4	55%	0.55	52%	0.515	S	S	.	.	H	α-helix	trans	-67.2	-32.6	-179.7	-71.4	170.7	0	0	0	113.1	L122 Y123 F124 T129	L122-L126 HydrophobicContact CD1-CD1 4.19Å; L122-L126 HydrophobicContact CD1-CG 4.32Å; L122-L126 HydrophobicContact CG-CD1 4.09Å; L122-L126 VanDerWaalsContact O-CG 3.31Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 3.02Å; Y123-L126 PolarHBondContact O-N 3.14Å; F124-L126 PolarHBondContact O-N 3.35Å; L126-T129 PolarHBondContact O-OG1 3.24Å; L126-T129 VanDerWaalsContact O-OG1 3.14Å
127	H	84.5	Confident	73.4	Confident	102 Å²	102	92.9 Å²	92.9	47%	0.472	50%	0.502	S	S	.	.	H	α-helix	trans	-96.6	-21.9	-176.1	-63.8	78.9	0	0	0	113.1	Y123 F124 C125	Y123-H127 AromaticContact CD2-CE1 3.36Å; Y123-H127 WeakPolarHBondContact CD2-CE1 3.35Å; Y123-H127 AromaticContact CD2-ND1 3.57Å; Y123-H127 AromaticContact CE2-CE1 3.13Å; Y123-H127 WeakPolarHBondContact CE2-CE1 3.01Å; Y123-H127 AromaticContact CE2-ND1 3.49Å; Y123-H127 WeakPolarHBondContact CE2-ND1 3.07Å; Y123-H127 AromaticContact CE2-NE2 3.61Å; Y123-H127 AromaticContact CG-ND1 3.96Å; Y123-H127 AromaticContact CZ-CE1 3.82Å; Y123-H127 AromaticContact CZ-ND1 3.81Å; Y123-H127 PolarHBondContact O-N 3.25Å; Y123-H127 PolarHBondContact O-ND1 2.86Å; F124-H127 PolarHBondContact O-N 3.25Å; C125-H127 VanDerWaalsContact C-N 3.33Å; C125-H127 PolarHBondContact O-N 3.48Å
128	S	72.3	Confident	72.1	Confident	41 Å²	41	97.9 Å²	97.9	29%	0.287	53%	0.529	S	S	.	.	H	α-helix	trans	-78.8	-26	174.6	49.5	0	0	0	0	112.7	F124 C125 S130 T131	F124-S128 VanDerWaalsContact O-CB 3.3Å; F124-S128 WeakPolarHBondContact O-CB 3.4Å; F124-S128 PolarHBondContact O-N 2.98Å; F124-S128 PolarHBondContact O-OG 3.09Å; C125-S128 WeakPolarHBondContact CA-OG 3.19Å; C125-S128 PolarHBondContact O-OG 3.35Å; S128-S130 PolarHBondContact O-N 3.29Å; S128-T131 PolarHBondContact O-N 3Å; S128-T131 PolarHBondContact O-OG1 3.06Å; S128-T131 VanDerWaalsContact O-OG1 3.13Å
129	T	57.2	Low	70.7	Confident	98 Å²	98	100.5 Å²	100.5	60%	0.601	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.7	173.4	46.4	0	0	0	0	114.6	C125 L126 T131	C125-T129 WeakPolarHBondContact O-CG2 3.41Å; C125-T129 PolarHBondContact O-N 3.29Å; C125-T129 PolarHBondContact O-OG1 3.41Å; C125-T129 VanDerWaalsContact O-OG1 3.13Å; L126-T129 PolarHBondContact O-OG1 3.24Å; L126-T129 VanDerWaalsContact O-OG1 3.14Å; T129-T131 VanDerWaalsContact C-N 3.35Å
130	S	54.3	Low	69.1	Low	79 Å²	79	98.9 Å²	98.9	55%	0.552	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.9	178.7	-59.1	0	0	0	0	114.5	S128	S128-S130 PolarHBondContact O-N 3.29Å
131	T	47.2	Very low	67.4	Low	110 Å²	110	97.7 Å²	97.7	68%	0.675	54%	0.544	S	S	*	.	S	Bend	trans	-109.4	-7	-177.1	48	0	0	0	0	114.7	S128 T129	S128-T131 PolarHBondContact O-N 3Å; S128-T131 PolarHBondContact O-OG1 3.06Å; S128-T131 VanDerWaalsContact O-OG1 3.13Å; T129-T131 VanDerWaalsContact C-N 3.35Å
132	S	44.1	Very low	65.4	Low	105 Å²	105	104.1 Å²	104.1	73%	0.734	58%	0.58	S	S	*	*	S	Bend	trans	-94.9	1.9	178.1	-71.7	0	0	0	0	115.1
133	S	38.1	Very low	63.4	Low	93 Å²	93	106.2 Å²	106.2	65%	0.65	59%	0.593	S	S	*	*	S	Bend	trans	-107.2	13.3	177.9	39.4	0	0	0	0	114.2
134	L	37	Very low	61.1	Low	152 Å²	152	103.3 Å²	103.3	80%	0.796	60%	0.597	S	S	*	*			trans	-128.4	27	179.3	-72.1	175.4	0	0	0	114.6
135	L	36.6	Very low	58.5	Low	233 Å²	233	105 Å²	105	100%	1.22	62%	0.617	S	S	*	*			trans	-135	0	159.4	-69.9	176.2	0	0	0	108.6

Retrieved 135 of 135 residues in 44.8 ms (Link to these results)

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