A0A5K4FBS7_SCHMA Loading...

TBD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBS7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 204 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	62	Low	91.5	Very high	249 Å²	249	105.5 Å²	105.5	100%	1.227	59%	0.59	S	S	*	*				0	89.8	0	-68.6	-65.9	-157.4	0	0	108.2
2	G	87	Confident	92	Very high	76 Å²	76	102.1 Å²	102.1	78%	0.784	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-99.4	159.2	174.3	0	0	0	0	0	110.5
3	Q	88.3	Confident	92.5	Very high	140 Å²	140	104.7 Å²	104.7	65%	0.654	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-68.9	148.7	167.6	-66.9	-67.2	-13.4	0	0	109.7	I8	Q3-I8 HydrophobicContact CB-CD1 4.38Å; Q3-I8 HydrophobicContact CB-CG1 4.08Å
4	T	93.7	Very high	92.9	Very high	72 Å²	72	108.5 Å²	108.5	44%	0.442	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-69.2	147.5	172.7	61	0	0	0	0	110	D6 T7 I8	T4-D6 PolarHBondContact O-N 3.12Å; T4-T7 WeakPolarHBondContact O-CB 3.48Å; T4-T7 PolarHBondContact O-N 3.4Å; T4-T7 PolarHBondContact OG1-N 3.36Å; T4-T7 PolarHBondContact OG1-OG1 3.3Å; T4-I8 PolarHBondContact O-N 3.24Å
5	P	94.6	Very high	93.3	Very high	84 Å²	84	105.1 Å²	105.1	55%	0.545	57%	0.567	S	S	.	*	H	α-helix	trans	-51.3	-38.8	174.5	-28.8	36.1	0	0	0	113.3	T7 I8 F9	P5-T7 VanDerWaalsContact C-N 3.35Å; P5-T7 PolarHBondContact O-N 3.38Å; P5-I8 WeakPolarHBondContact O-CB 3.4Å; P5-I8 PolarHBondContact O-N 3.44Å; P5-I8 VanDerWaalsContact O-N 3.16Å; P5-F9 HydrophobicContact CB-CE2 4.27Å; P5-F9 WeakPolarHBondContact O-CD2 3.45Å; P5-F9 PolarHBondContact O-N 3.12Å
6	D	96.1	Very high	93.6	Very high	114 Å²	114	105.4 Å²	105.4	61%	0.61	57%	0.567	S	S	*	*	H	α-helix	trans	-60.1	-43.9	177.6	-56.5	-50.5	0	0	0	112.2	T4 I8 F9 D10	T4-D6 PolarHBondContact O-N 3.12Å; D6-I8 VanDerWaalsContact C-N 3.29Å; D6-I8 PolarHBondContact O-N 3.14Å; D6-F9 PolarHBondContact O-N 3.47Å; D6-D10 PolarHBondContact O-N 3.29Å
7	T	96.8	Very high	93.9	Very high	56 Å²	56	105.8 Å²	105.8	34%	0.344	56%	0.564	S	S	.	*	H	α-helix	trans	-62.1	-40.7	177.1	-55.5	0	0	0	0	111.1	T4 P5 D10 V11	T4-T7 WeakPolarHBondContact O-CB 3.48Å; T4-T7 PolarHBondContact O-N 3.4Å; T4-T7 PolarHBondContact OG1-N 3.36Å; T4-T7 PolarHBondContact OG1-OG1 3.3Å; P5-T7 VanDerWaalsContact C-N 3.35Å; P5-T7 PolarHBondContact O-N 3.38Å; T7-D10 PolarHBondContact O-N 3.34Å; T7-V11 WeakPolarHBondContact O-CG2 3.35Å; T7-V11 PolarHBondContact O-N 3.18Å; T7-V11 VanDerWaalsContact O-N 3.09Å
8	I	95.7	Very high	94.1	Very high	89 Å²	89	106.9 Å²	106.9	46%	0.456	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-46.8	177.1	-62.6	170.7	0	0	0	109.8	Q3 T4 P5 D6 D10 V11 C12	Q3-I8 HydrophobicContact CB-CD1 4.38Å; Q3-I8 HydrophobicContact CB-CG1 4.08Å; T4-I8 PolarHBondContact O-N 3.24Å; P5-I8 WeakPolarHBondContact O-CB 3.4Å; P5-I8 PolarHBondContact O-N 3.44Å; P5-I8 VanDerWaalsContact O-N 3.16Å; D6-I8 VanDerWaalsContact C-N 3.29Å; D6-I8 PolarHBondContact O-N 3.14Å; I8-D10 VanDerWaalsContact C-N 3.35Å; I8-D10 PolarHBondContact O-N 2.99Å; I8-V11 PolarHBondContact O-N 2.69Å; I8-C12 PolarHBondContact O-N 3.35Å; I8-C12 PolarHBondContact O-SG 3.37Å; I8-C12 VanDerWaalsContact O-SG 3.35Å
9	F	96.9	Very high	94.4	Very high	135 Å²	135	108.8 Å²	108.8	59%	0.592	57%	0.567	S	S	*	*	H	α-helix	trans	-62.9	-38.8	178.6	-72.6	-52.6	0	0	0	112.9	P5 D6 C12 R13	P5-F9 HydrophobicContact CB-CE2 4.27Å; P5-F9 WeakPolarHBondContact O-CD2 3.45Å; P5-F9 PolarHBondContact O-N 3.12Å; D6-F9 PolarHBondContact O-N 3.47Å; F9-C12 PolarHBondContact O-N 3.21Å; F9-R13 WeakPolarHBondContact O-CB 3.39Å; F9-R13 PolarHBondContact O-N 2.97Å
10	D	97.7	Very high	94.6	Very high	71 Å²	71	107.5 Å²	107.5	38%	0.38	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-35.3	176.6	-75.6	-21.1	0	0	0	112.9	D6 T7 I8 R13 R14	D6-D10 PolarHBondContact O-N 3.29Å; T7-D10 PolarHBondContact O-N 3.34Å; I8-D10 VanDerWaalsContact C-N 3.35Å; I8-D10 PolarHBondContact O-N 2.99Å; D10-R13 IonicContact OD1-CZ 3.63Å; D10-R13 IonicContact OD1-NH1 2.76Å; D10-R13 PolarHBondContact OD1-NH1 2.81Å; D10-R13 IonicContact OD1-NH2 3.86Å; D10-R14 WeakPolarHBondContact O-CG 3.46Å; D10-R14 PolarHBondContact O-N 3.33Å; D10-R14 VanDerWaalsContact O-N 3.15Å; D10-R14 PolarHBondContact O-NE 3.48Å
11	V	97.5	Very high	94.8	Very high	75 Å²	75	106.9 Å²	106.9	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-67.3	-46.6	172.6	172.6	0	0	0	0	110.5	T7 I8 R13 R14 A15	T7-V11 WeakPolarHBondContact O-CG2 3.35Å; T7-V11 PolarHBondContact O-N 3.18Å; T7-V11 VanDerWaalsContact O-N 3.09Å; I8-V11 PolarHBondContact O-N 2.69Å; V11-R13 PolarHBondContact O-N 3.09Å; V11-R14 PolarHBondContact O-N 3.3Å; V11-A15 WeakPolarHBondContact O-CB 3.47Å; V11-A15 PolarHBondContact O-N 2.93Å
12	C	98	Very high	96.5	Very high	64 Å²	64	99.1 Å²	99.1	43%	0.432	52%	0.521	S	S	.	.	H	α-helix	trans	-60	-43.7	177	-71.1	0	0	0	0	111.9	I8 F9 A15 I16	I8-C12 PolarHBondContact O-N 3.35Å; I8-C12 PolarHBondContact O-SG 3.37Å; I8-C12 VanDerWaalsContact O-SG 3.35Å; F9-C12 PolarHBondContact O-N 3.21Å; C12-A15 PolarHBondContact O-N 2.83Å; C12-I16 WeakPolarHBondContact O-CG1 3.44Å; C12-I16 PolarHBondContact O-N 3.43Å
13	R	98.3	Very high	97	Very high	136 Å²	136	99 Å²	99	51%	0.513	51%	0.505	S	S	.	.	H	α-helix	trans	-58.7	-51	177	-170.8	-172.3	-62.4	125.1	5.4	111.2	F9 D10 V11 A15 I16 E17	F9-R13 WeakPolarHBondContact O-CB 3.39Å; F9-R13 PolarHBondContact O-N 2.97Å; D10-R13 IonicContact OD1-CZ 3.63Å; D10-R13 IonicContact OD1-NH1 2.76Å; D10-R13 PolarHBondContact OD1-NH1 2.81Å; D10-R13 IonicContact OD1-NH2 3.86Å; V11-R13 PolarHBondContact O-N 3.09Å; R13-A15 VanDerWaalsContact C-N 3.31Å; R13-A15 PolarHBondContact O-N 3.01Å; R13-I16 PolarHBondContact O-N 3.07Å; R13-E17 WeakPolarHBondContact CG-OE1 3.24Å; R13-E17 WeakPolarHBondContact O-CG 3.39Å; R13-E17 PolarHBondContact O-N 3.47Å
14	R	98.4	Very high	97.5	Very high	158 Å²	158	94.6 Å²	94.6	60%	0.596	49%	0.493	S	S	*	.	H	α-helix	trans	-61.5	-36.9	177.8	-75	-174.8	-69.1	162.8	-4.8	113	D10 V11 F18	D10-R14 WeakPolarHBondContact O-CG 3.46Å; D10-R14 PolarHBondContact O-N 3.33Å; D10-R14 VanDerWaalsContact O-N 3.15Å; D10-R14 PolarHBondContact O-NE 3.48Å; V11-R14 PolarHBondContact O-N 3.3Å; R14-F18 VanDerWaalsContact O-CB 3.29Å; R14-F18 WeakPolarHBondContact O-CB 3.44Å; R14-F18 PolarHBondContact O-N 3.46Å
15	A	98.5	Very high	97.7	Very high	57 Å²	57	95.7 Å²	95.7	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-41.8	176.8	0	0	0	0	0	112	V11 C12 R13 F18 F19	V11-A15 WeakPolarHBondContact O-CB 3.47Å; V11-A15 PolarHBondContact O-N 2.93Å; C12-A15 PolarHBondContact O-N 2.83Å; R13-A15 VanDerWaalsContact C-N 3.31Å; R13-A15 PolarHBondContact O-N 3.01Å; A15-F18 PolarHBondContact O-N 3.36Å; A15-F19 WeakPolarHBondContact O-CB 3.31Å; A15-F19 PolarHBondContact O-N 3.2Å
16	I	98.3	Very high	97.9	Very high	110 Å²	110	93.3 Å²	93.3	56%	0.564	48%	0.484	S	S	*	.	H	α-helix	trans	-66.1	-44.6	176.3	-66.8	165.6	0	0	0	110.9	C12 R13 F18 F19 T20	C12-I16 WeakPolarHBondContact O-CG1 3.44Å; C12-I16 PolarHBondContact O-N 3.43Å; R13-I16 PolarHBondContact O-N 3.07Å; I16-F18 PolarHBondContact O-N 3.24Å; I16-F19 PolarHBondContact O-N 2.92Å; I16-T20 WeakPolarHBondContact O-CB 3.39Å; I16-T20 PolarHBondContact O-N 3.36Å; I16-T20 PolarHBondContact O-OG1 3.02Å
17	E	98.5	Very high	98	Very high	113 Å²	113	91.4 Å²	91.4	53%	0.528	48%	0.476	S	S	.	.	H	α-helix	trans	-59.8	-45.7	175.7	-73.2	169.2	-175.3	0	0	111.4	R13 T20 L21	R13-E17 WeakPolarHBondContact CG-OE1 3.24Å; R13-E17 WeakPolarHBondContact O-CG 3.39Å; R13-E17 PolarHBondContact O-N 3.47Å; E17-T20 PolarHBondContact O-N 2.92Å; E17-L21 WeakPolarHBondContact O-CB 3.26Å; E17-L21 PolarHBondContact O-N 3.16Å
18	F	98.4	Very high	98.1	Very high	126 Å²	126	95.7 Å²	95.7	55%	0.553	49%	0.49	S	S	*	.	H	α-helix	trans	-61.9	-45.4	176.4	179.2	-100.5	0	0	0	112.1	R14 A15 I16 T20 L21 Q22	R14-F18 VanDerWaalsContact O-CB 3.29Å; R14-F18 WeakPolarHBondContact O-CB 3.44Å; R14-F18 PolarHBondContact O-N 3.46Å; A15-F18 PolarHBondContact O-N 3.36Å; I16-F18 PolarHBondContact O-N 3.24Å; F18-T20 VanDerWaalsContact C-N 3.32Å; F18-T20 PolarHBondContact O-N 3.48Å; F18-L21 PolarHBondContact O-N 3.47Å; F18-Q22 HydrophobicContact CD1-CG 4.11Å; F18-Q22 HydrophobicContact CD2-CG 4.44Å; F18-Q22 HydrophobicContact CE1-CG 3.72Å; F18-Q22 HydrophobicContact CE2-CG 4.08Å; F18-Q22 HydrophobicContact CG-CG 4.47Å; F18-Q22 HydrophobicContact CZ-CG 3.72Å; F18-Q22 WeakPolarHBondContact O-CB 3.33Å; F18-Q22 VanDerWaalsContact O-CG 3.31Å; F18-Q22 WeakPolarHBondContact O-CG 3.38Å; F18-Q22 PolarHBondContact O-N 3.15Å
19	F	98.4	Very high	98.2	Very high	143 Å²	143	98.6 Å²	98.6	63%	0.627	50%	0.496	S	S	*	.	H	α-helix	trans	-60.7	-42.3	176.8	175.5	-100.9	0	0	0	112.1	A15 I16 Q22 T23	A15-F19 WeakPolarHBondContact O-CB 3.31Å; A15-F19 PolarHBondContact O-N 3.2Å; I16-F19 PolarHBondContact O-N 2.92Å; F19-Q22 PolarHBondContact O-N 2.93Å; F19-T23 WeakPolarHBondContact O-CB 3.4Å; F19-T23 PolarHBondContact O-N 2.72Å; F19-T23 PolarHBondContact O-OG1 2.9Å
20	T	98.5	Very high	98.3	Very high	82 Å²	82	97.2 Å²	97.2	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-45.3	177.3	-56	0	0	0	0	110.9	I16 E17 F18 T23 A24	I16-T20 WeakPolarHBondContact O-CB 3.39Å; I16-T20 PolarHBondContact O-N 3.36Å; I16-T20 PolarHBondContact O-OG1 3.02Å; E17-T20 PolarHBondContact O-N 2.92Å; F18-T20 VanDerWaalsContact C-N 3.32Å; F18-T20 PolarHBondContact O-N 3.48Å; T20-T23 PolarHBondContact O-N 3.46Å; T20-A24 PolarHBondContact O-N 3.23Å
21	L	98.5	Very high	98.4	Very high	95 Å²	95	99.4 Å²	99.4	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-61.1	-45.9	176.2	179.8	64.6	0	0	0	111.8	E17 F18 T23 A24 Q25	E17-L21 WeakPolarHBondContact O-CB 3.26Å; E17-L21 PolarHBondContact O-N 3.16Å; F18-L21 PolarHBondContact O-N 3.47Å; L21-T23 VanDerWaalsContact C-N 3.33Å; L21-T23 PolarHBondContact O-N 2.91Å; L21-A24 PolarHBondContact O-N 2.92Å; L21-Q25 HydrophobicContact CD1-CG 4.46Å; L21-Q25 WeakPolarHBondContact O-CG 3.48Å; L21-Q25 PolarHBondContact O-N 2.93Å
22	Q	98.3	Very high	98.4	Very high	86 Å²	86	102.3 Å²	102.3	40%	0.402	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-41.5	178.4	-74.8	-66.7	-0.5	0	0	112	F18 F19 Q25 G26	F18-Q22 HydrophobicContact CD1-CG 4.11Å; F18-Q22 HydrophobicContact CD2-CG 4.44Å; F18-Q22 HydrophobicContact CE1-CG 3.72Å; F18-Q22 HydrophobicContact CE2-CG 4.08Å; F18-Q22 HydrophobicContact CG-CG 4.47Å; F18-Q22 HydrophobicContact CZ-CG 3.72Å; F18-Q22 WeakPolarHBondContact O-CB 3.33Å; F18-Q22 VanDerWaalsContact O-CG 3.31Å; F18-Q22 WeakPolarHBondContact O-CG 3.38Å; F18-Q22 PolarHBondContact O-N 3.15Å; F19-Q22 PolarHBondContact O-N 2.93Å; Q22-Q25 PolarHBondContact O-N 3.1Å; Q22-G26 PolarHBondContact O-N 3.16Å
23	T	98.2	Very high	98.4	Very high	72 Å²	72	101.9 Å²	101.9	44%	0.442	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-46.2	176.1	-57.4	0	0	0	0	110.9	F19 T20 L21 Q25 G26 V27	F19-T23 WeakPolarHBondContact O-CB 3.4Å; F19-T23 PolarHBondContact O-N 2.72Å; F19-T23 PolarHBondContact O-OG1 2.9Å; T20-T23 PolarHBondContact O-N 3.46Å; L21-T23 VanDerWaalsContact C-N 3.33Å; L21-T23 PolarHBondContact O-N 2.91Å; T23-Q25 PolarHBondContact O-N 2.89Å; T23-G26 PolarHBondContact O-N 3.33Å; T23-V27 WeakPolarHBondContact O-CG2 3.39Å; T23-V27 PolarHBondContact O-N 3.22Å; T23-V27 VanDerWaalsContact O-N 3.07Å
24	A	98.4	Very high	98.5	Very high	48 Å²	48	99.7 Å²	99.7	40%	0.397	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-38.9	177.1	0	0	0	0	0	112.8	T20 L21 V27 K28	T20-A24 PolarHBondContact O-N 3.23Å; L21-A24 PolarHBondContact O-N 2.92Å; A24-V27 PolarHBondContact O-N 2.94Å; A24-K28 WeakPolarHBondContact O-CG 3.4Å; A24-K28 PolarHBondContact O-N 3.04Å; A24-K28 VanDerWaalsContact O-N 3.15Å
25	Q	98.4	Very high	98.5	Very high	96 Å²	96	98.7 Å²	98.7	45%	0.449	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-39.8	174.1	-73.7	179.3	-1.5	0	0	112	L21 Q22 T23 V27 K28 Y29	L21-Q25 HydrophobicContact CD1-CG 4.46Å; L21-Q25 WeakPolarHBondContact O-CG 3.48Å; L21-Q25 PolarHBondContact O-N 2.93Å; Q22-Q25 PolarHBondContact O-N 3.1Å; T23-Q25 PolarHBondContact O-N 2.89Å; Q25-V27 VanDerWaalsContact C-N 3.34Å; Q25-V27 PolarHBondContact O-N 3.31Å; Q25-K28 PolarHBondContact O-N 2.98Å; Q25-Y29 WeakPolarHBondContact O-CB 3.29Å; Q25-Y29 PolarHBondContact O-N 3.37Å
26	G	98.5	Very high	98.5	Very high	34 Å²	34	99.3 Å²	99.3	35%	0.351	49%	0.487	S	S	.	.	H	α-helix	trans	-59	-43.4	174.6	0	0	0	0	0	112.6	Q22 T23 Y29 L30	Q22-G26 PolarHBondContact O-N 3.16Å; T23-G26 PolarHBondContact O-N 3.33Å; G26-Y29 PolarHBondContact O-N 3.4Å; G26-L30 WeakPolarHBondContact O-CG 3.38Å; G26-L30 PolarHBondContact O-N 2.85Å; G26-L30 VanDerWaalsContact O-N 3.09Å
27	V	98.6	Very high	98.5	Very high	74 Å²	74	98.7 Å²	98.7	45%	0.448	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-50.2	175.1	174.7	0	0	0	0	111	T23 A24 Q25 Y29 L30 E31	T23-V27 WeakPolarHBondContact O-CG2 3.39Å; T23-V27 PolarHBondContact O-N 3.22Å; T23-V27 VanDerWaalsContact O-N 3.07Å; A24-V27 PolarHBondContact O-N 2.94Å; Q25-V27 VanDerWaalsContact C-N 3.34Å; Q25-V27 PolarHBondContact O-N 3.31Å; V27-Y29 VanDerWaalsContact C-N 3.27Å; V27-Y29 PolarHBondContact O-N 3Å; V27-L30 PolarHBondContact O-N 2.75Å; V27-L30 VanDerWaalsContact O-N 3.13Å; V27-E31 WeakPolarHBondContact O-CG 3.33Å; V27-E31 PolarHBondContact O-N 3.46Å
28	K	98.5	Very high	98.5	Very high	146 Å²	146	98.6 Å²	98.6	64%	0.635	48%	0.484	S	S	*	.	H	α-helix	trans	-59.6	-36.5	178.6	-71.3	-177.6	179	-174.1	0	113.1	A24 Q25 Y32	A24-K28 WeakPolarHBondContact O-CG 3.4Å; A24-K28 PolarHBondContact O-N 3.04Å; A24-K28 VanDerWaalsContact O-N 3.15Å; Q25-K28 PolarHBondContact O-N 2.98Å; K28-Y32 PolarHBondContact O-N 3.4Å
29	Y	98.6	Very high	98.5	Very high	150 Å²	150	96.8 Å²	96.8	59%	0.588	48%	0.477	S	S	*	.	H	α-helix	trans	-67.6	-41.2	177	179.8	-110.5	0	0	0	112.1	Q25 G26 V27 Y32 I33	Q25-Y29 WeakPolarHBondContact O-CB 3.29Å; Q25-Y29 PolarHBondContact O-N 3.37Å; G26-Y29 PolarHBondContact O-N 3.4Å; V27-Y29 VanDerWaalsContact C-N 3.27Å; V27-Y29 PolarHBondContact O-N 3Å; Y29-Y32 PolarHBondContact O-N 2.59Å; Y29-I33 HydrophobicContact CD1-CD1 3.76Å; Y29-I33 HydrophobicContact CE1-CD1 3.24Å; Y29-I33 HydrophobicContact CE1-CG1 4.24Å; Y29-I33 HydrophobicContact CE2-CD1 4.24Å; Y29-I33 HydrophobicContact CE2-CG1 4.43Å; Y29-I33 HydrophobicContact CG-CD1 4.46Å; Y29-I33 WeakPolarHBondContact O-CG1 3.36Å; Y29-I33 PolarHBondContact O-N 2.92Å
30	L	98.6	Very high	98.5	Very high	105 Å²	105	99 Å²	99	55%	0.55	48%	0.481	S	S	.	.	H	α-helix	trans	-65.4	-40.5	175	-69.9	171.9	0	0	0	111.8	G26 V27 Y32 I33 N34	G26-L30 WeakPolarHBondContact O-CG 3.38Å; G26-L30 PolarHBondContact O-N 2.85Å; G26-L30 VanDerWaalsContact O-N 3.09Å; V27-L30 PolarHBondContact O-N 2.75Å; V27-L30 VanDerWaalsContact O-N 3.13Å; L30-Y32 VanDerWaalsContact C-N 3.34Å; L30-Y32 PolarHBondContact O-N 3.48Å; L30-I33 PolarHBondContact O-N 3.44Å; L30-N34 WeakPolarHBondContact O-CB 3.47Å; L30-N34 PolarHBondContact O-N 2.91Å; L30-N34 PolarHBondContact O-ND2 3.5Å
31	E	98.6	Very high	98.5	Very high	118 Å²	118	102.2 Å²	102.2	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-58.3	-44.7	172.6	-71.9	172.3	174.9	0	0	111.7	V27 N34 Y35	V27-E31 WeakPolarHBondContact O-CG 3.33Å; V27-E31 PolarHBondContact O-N 3.46Å; E31-N34 PolarHBondContact O-N 3.03Å; E31-Y35 WeakPolarHBondContact O-CB 3.26Å; E31-Y35 PolarHBondContact O-N 2.9Å
32	Y	98.7	Very high	98.5	Very high	135 Å²	135	103.5 Å²	103.5	53%	0.529	49%	0.487	S	S	.	.	H	α-helix	trans	-62.2	-43.6	175.9	174.4	-96.8	0	0	0	112.7	K28 Y29 L30 Y35 K36	K28-Y32 PolarHBondContact O-N 3.4Å; Y29-Y32 PolarHBondContact O-N 2.59Å; L30-Y32 VanDerWaalsContact C-N 3.34Å; L30-Y32 PolarHBondContact O-N 3.48Å; Y32-Y35 PolarHBondContact O-N 2.97Å; Y32-K36 HydrophobicContact CD1-CG 4.45Å; Y32-K36 HydrophobicContact CE1-CG 3.94Å; Y32-K36 HydrophobicContact CE2-CG 4.08Å; Y32-K36 WeakPolarHBondContact O-CG 3.43Å; Y32-K36 PolarHBondContact O-N 2.99Å
33	I	98.5	Very high	98.5	Very high	55 Å²	55	103.6 Å²	103.6	28%	0.282	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-47.3	175.8	-71.9	169.5	0	0	0	110.3	Y29 L30 Y35 K36 L37	Y29-I33 HydrophobicContact CD1-CD1 3.76Å; Y29-I33 HydrophobicContact CE1-CD1 3.24Å; Y29-I33 HydrophobicContact CE1-CG1 4.24Å; Y29-I33 HydrophobicContact CE2-CD1 4.24Å; Y29-I33 HydrophobicContact CE2-CG1 4.43Å; Y29-I33 HydrophobicContact CG-CD1 4.46Å; Y29-I33 WeakPolarHBondContact O-CG1 3.36Å; Y29-I33 PolarHBondContact O-N 2.92Å; L30-I33 PolarHBondContact O-N 3.44Å; I33-Y35 PolarHBondContact O-N 3.23Å; I33-K36 PolarHBondContact O-N 3.42Å; I33-L37 HydrophobicContact CG2-CD1 3.8Å; I33-L37 HydrophobicContact CG2-CG 4.27Å; I33-L37 WeakPolarHBondContact O-CG 3.44Å; I33-L37 PolarHBondContact O-N 3.45Å
34	N	98.7	Very high	98.5	Very high	91 Å²	91	105.2 Å²	105.2	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-60	-46.6	179.1	-74.9	-20.5	0	0	0	111.2	L30 E31 K36 L37 E38	L30-N34 WeakPolarHBondContact O-CB 3.47Å; L30-N34 PolarHBondContact O-N 2.91Å; L30-N34 PolarHBondContact O-ND2 3.5Å; E31-N34 PolarHBondContact O-N 3.03Å; N34-K36 VanDerWaalsContact C-N 3.31Å; N34-K36 PolarHBondContact O-N 3.07Å; N34-L37 PolarHBondContact O-N 2.66Å; N34-L37 VanDerWaalsContact O-N 3.14Å; N34-E38 WeakPolarHBondContact O-CG 3.41Å; N34-E38 PolarHBondContact O-N 2.93Å
35	Y	98.5	Very high	98.5	Very high	136 Å²	136	106.4 Å²	106.4	53%	0.533	49%	0.491	S	S	.	.	H	α-helix	trans	-54.9	-45.5	174	171	-100.3	0	0	0	112.2	E31 Y32 I33 E38 E39	E31-Y35 WeakPolarHBondContact O-CB 3.26Å; E31-Y35 PolarHBondContact O-N 2.9Å; Y32-Y35 PolarHBondContact O-N 2.97Å; I33-Y35 PolarHBondContact O-N 3.23Å; Y35-E38 PolarHBondContact O-N 3.31Å; Y35-E39 WeakPolarHBondContact O-CB 3.29Å; Y35-E39 PolarHBondContact O-N 3.18Å
36	K	98.6	Very high	98.5	Very high	70 Å²	70	107.2 Å²	107.2	30%	0.304	50%	0.497	S	S	.	.	H	α-helix	trans	-69	-32.1	177.8	-72.7	-60.3	178.1	-170.2	0	113.8	Y32 I33 N34 E39 R40	Y32-K36 HydrophobicContact CD1-CG 4.45Å; Y32-K36 HydrophobicContact CE1-CG 3.94Å; Y32-K36 HydrophobicContact CE2-CG 4.08Å; Y32-K36 WeakPolarHBondContact O-CG 3.43Å; Y32-K36 PolarHBondContact O-N 2.99Å; I33-K36 PolarHBondContact O-N 3.42Å; N34-K36 VanDerWaalsContact C-N 3.31Å; N34-K36 PolarHBondContact O-N 3.07Å; K36-E39 VanDerWaalsContact CD-OE2 3.26Å; K36-E39 WeakPolarHBondContact CD-OE2 3.29Å; K36-E39 IonicContact NZ-OE2 2.74Å; K36-E39 PolarHBondContact NZ-OE2 3.48Å; K36-R40 WeakPolarHBondContact O-CG 3.48Å; K36-R40 PolarHBondContact O-N 2.96Å
37	L	98.6	Very high	98.5	Very high	98 Å²	98	111.1 Å²	111.1	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-43.6	173.6	-74.4	171.3	0	0	0	111.3	I33 N34 R40 Y41	I33-L37 HydrophobicContact CG2-CD1 3.8Å; I33-L37 HydrophobicContact CG2-CG 4.27Å; I33-L37 WeakPolarHBondContact O-CG 3.44Å; I33-L37 PolarHBondContact O-N 3.45Å; N34-L37 PolarHBondContact O-N 2.66Å; N34-L37 VanDerWaalsContact O-N 3.14Å; L37-R40 PolarHBondContact O-N 3.47Å; L37-Y41 WeakPolarHBondContact O-CB 3.33Å; L37-Y41 PolarHBondContact O-N 3.49Å
38	E	98.6	Very high	98.5	Very high	110 Å²	110	110.7 Å²	110.7	51%	0.514	51%	0.506	S	S	.	.	H	α-helix	trans	-62.4	-42.6	175.5	-73.5	-177.3	-172.9	0	0	112.2	N34 Y35 R40 Y41 K42	N34-E38 WeakPolarHBondContact O-CG 3.41Å; N34-E38 PolarHBondContact O-N 2.93Å; Y35-E38 PolarHBondContact O-N 3.31Å; E38-R40 VanDerWaalsContact C-N 3.34Å; E38-R40 PolarHBondContact O-N 3.43Å; E38-Y41 PolarHBondContact O-N 2.93Å; E38-K42 WeakPolarHBondContact O-CB 3.45Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.05Å
39	E	98.3	Very high	98.5	Very high	89 Å²	89	109.7 Å²	109.7	42%	0.416	50%	0.502	S	S	.	.	H	α-helix	trans	-58.3	-45.9	175.3	-173.3	-177.7	-167.7	0	0	111.2	Y35 K36 N43	Y35-E39 WeakPolarHBondContact O-CB 3.29Å; Y35-E39 PolarHBondContact O-N 3.18Å; K36-E39 VanDerWaalsContact CD-OE2 3.26Å; K36-E39 WeakPolarHBondContact CD-OE2 3.29Å; K36-E39 IonicContact NZ-OE2 2.74Å; K36-E39 PolarHBondContact NZ-OE2 3.48Å; E39-N43 PolarHBondContact O-N 3.08Å
40	R	98.3	Very high	98.4	Very high	190 Å²	190	105.6 Å²	105.6	72%	0.717	50%	0.495	S	S	*	.	H	α-helix	trans	-64.7	-42.8	176.1	-75.5	-178.3	178.9	-175.5	1.6	112.6	K36 L37 E38 N43 M44	K36-R40 WeakPolarHBondContact O-CG 3.48Å; K36-R40 PolarHBondContact O-N 2.96Å; L37-R40 PolarHBondContact O-N 3.47Å; E38-R40 VanDerWaalsContact C-N 3.34Å; E38-R40 PolarHBondContact O-N 3.43Å; R40-N43 PolarHBondContact O-N 2.98Å; R40-M44 WeakPolarHBondContact O-CB 3.49Å; R40-M44 PolarHBondContact O-N 3.29Å
41	Y	98.5	Very high	98.4	Very high	149 Å²	149	105.6 Å²	105.6	58%	0.584	50%	0.495	S	S	*	.	H	α-helix	trans	-61.2	-47.2	178	179.9	-91.6	0	0	0	111.1	L37 E38 N43 M44 E45	L37-Y41 WeakPolarHBondContact O-CB 3.33Å; L37-Y41 PolarHBondContact O-N 3.49Å; E38-Y41 PolarHBondContact O-N 2.93Å; Y41-N43 PolarHBondContact O-N 3.48Å; Y41-M44 HydrophobicContact CD2-CE 4.19Å; Y41-M44 HydrophobicContact CE2-CE 4.48Å; Y41-M44 PolarHBondContact O-N 3.06Å; Y41-E45 WeakPolarHBondContact O-CB 3.44Å; Y41-E45 PolarHBondContact O-N 2.84Å
42	K	98.5	Very high	98.4	Very high	121 Å²	121	105 Å²	105	53%	0.526	50%	0.495	S	S	.	.	H	α-helix	trans	-59.5	-44.2	176.4	-74.3	172.8	179.9	169.1	0	112	E38 E45 I46	E38-K42 WeakPolarHBondContact O-CB 3.45Å; E38-K42 WeakPolarHBondContact O-CG 3.49Å; E38-K42 PolarHBondContact O-N 3.05Å; K42-E45 PolarHBondContact O-N 3.46Å; K42-I46 VanDerWaalsContact O-CG1 3.29Å; K42-I46 WeakPolarHBondContact O-CG1 3.33Å; K42-I46 PolarHBondContact O-N 3.17Å
43	N	98.1	Very high	98.4	Very high	88 Å²	88	101 Å²	101	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-43.5	177.1	-171.9	11.6	0	0	0	111.8	E39 R40 Y41 I46 Q47	E39-N43 PolarHBondContact O-N 3.08Å; R40-N43 PolarHBondContact O-N 2.98Å; Y41-N43 PolarHBondContact O-N 3.48Å; N43-I46 PolarHBondContact O-N 3.05Å; N43-Q47 WeakPolarHBondContact O-CG 3.35Å; N43-Q47 PolarHBondContact O-N 3.38Å; N43-Q47 PolarHBondContact OD1-NE2 3.38Å
44	M	98.4	Very high	98.4	Very high	106 Å²	106	102.5 Å²	102.5	52%	0.522	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-42.2	175.7	-173.6	179.2	68.9	0	0	111.8	R40 Y41 I46 Q47 C48	R40-M44 WeakPolarHBondContact O-CB 3.49Å; R40-M44 PolarHBondContact O-N 3.29Å; Y41-M44 HydrophobicContact CD2-CE 4.19Å; Y41-M44 HydrophobicContact CE2-CE 4.48Å; Y41-M44 PolarHBondContact O-N 3.06Å; M44-I46 VanDerWaalsContact C-N 3.34Å; M44-I46 PolarHBondContact O-N 3.17Å; M44-Q47 PolarHBondContact O-N 2.94Å; M44-C48 WeakPolarHBondContact O-CB 3.41Å; M44-C48 PolarHBondContact O-N 2.99Å; M44-C48 PolarHBondContact O-SG 2.88Å; M44-C48 VanDerWaalsContact O-SG 3.34Å
45	E	98.5	Very high	98.4	Very high	74 Å²	74	102.2 Å²	102.2	35%	0.346	49%	0.494	S	S	.	.	H	α-helix	trans	-59.4	-44.1	176.2	-172.5	-174.1	167.8	0	0	111.6	Y41 K42 C48 K49	Y41-E45 WeakPolarHBondContact O-CB 3.44Å; Y41-E45 PolarHBondContact O-N 2.84Å; K42-E45 PolarHBondContact O-N 3.46Å; E45-C48 PolarHBondContact O-N 2.83Å; E45-K49 HydrophobicContact CG-CD 4.41Å; E45-K49 WeakPolarHBondContact O-CG 3.28Å; E45-K49 PolarHBondContact O-N 3.32Å; E45-K49 WeakPolarHBondContact OE1-CE 3.33Å; E45-K49 IonicContact OE1-NZ 2.66Å; E45-K49 PolarHBondContact OE1-NZ 3.23Å
46	I	98.3	Very high	98.4	Very high	113 Å²	113	101.4 Å²	101.4	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-60.8	-46.1	175.6	-67.8	163.9	0	0	0	110.8	K42 N43 M44 K49 S50	K42-I46 VanDerWaalsContact O-CG1 3.29Å; K42-I46 WeakPolarHBondContact O-CG1 3.33Å; K42-I46 PolarHBondContact O-N 3.17Å; N43-I46 PolarHBondContact O-N 3.05Å; M44-I46 VanDerWaalsContact C-N 3.34Å; M44-I46 PolarHBondContact O-N 3.17Å; I46-K49 PolarHBondContact O-N 3.46Å; I46-S50 WeakPolarHBondContact O-CB 3.45Å; I46-S50 PolarHBondContact O-N 3.01Å
47	Q	98	Very high	98.4	Very high	116 Å²	116	103.8 Å²	103.8	54%	0.542	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-42.9	178.2	-70.9	174.6	39.4	0	0	112	N43 M44 S50 L51	N43-Q47 WeakPolarHBondContact O-CG 3.35Å; N43-Q47 PolarHBondContact O-N 3.38Å; N43-Q47 PolarHBondContact OD1-NE2 3.38Å; M44-Q47 PolarHBondContact O-N 2.94Å; Q47-S50 PolarHBondContact O-N 3.36Å; Q47-L51 WeakPolarHBondContact O-CB 3.41Å; Q47-L51 PolarHBondContact O-N 2.89Å
48	C	98.3	Very high	98.4	Very high	65 Å²	65	105.4 Å²	105.4	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-62.5	-44.6	175.8	-72.1	0	0	0	0	111.9	M44 E45 L51 L52	M44-C48 WeakPolarHBondContact O-CB 3.41Å; M44-C48 PolarHBondContact O-N 2.99Å; M44-C48 PolarHBondContact O-SG 2.88Å; M44-C48 VanDerWaalsContact O-SG 3.34Å; E45-C48 PolarHBondContact O-N 2.83Å; C48-L51 PolarHBondContact O-N 3.49Å; C48-L52 WeakPolarHBondContact O-CB 3.35Å; C48-L52 WeakPolarHBondContact O-CG 3.31Å; C48-L52 PolarHBondContact O-N 3.4Å
49	K	98.4	Very high	98.4	Very high	124 Å²	124	105.3 Å²	105.3	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-62	-42.8	176.4	-74.6	177.5	-176.9	171.2	0	112	E45 I46 L52 S53	E45-K49 HydrophobicContact CG-CD 4.41Å; E45-K49 WeakPolarHBondContact O-CG 3.28Å; E45-K49 PolarHBondContact O-N 3.32Å; E45-K49 WeakPolarHBondContact OE1-CE 3.33Å; E45-K49 IonicContact OE1-NZ 2.66Å; E45-K49 PolarHBondContact OE1-NZ 3.23Å; I46-K49 PolarHBondContact O-N 3.46Å; K49-L52 PolarHBondContact O-N 2.77Å; K49-S53 WeakPolarHBondContact O-CB 3.31Å; K49-S53 PolarHBondContact O-N 2.84Å
50	S	98.2	Very high	98.4	Very high	64 Å²	64	105.8 Å²	105.8	45%	0.448	52%	0.517	S	S	.	.	H	α-helix	trans	-62.7	-44.8	175.4	177.7	0	0	0	0	111.9	I46 Q47 S53 N54	I46-S50 WeakPolarHBondContact O-CB 3.45Å; I46-S50 PolarHBondContact O-N 3.01Å; Q47-S50 PolarHBondContact O-N 3.36Å; S50-S53 PolarHBondContact O-N 3.25Å; S50-N54 VanDerWaalsContact O-CG 3.24Å; S50-N54 PolarHBondContact O-N 2.85Å; S50-N54 PolarHBondContact O-ND2 3.45Å
51	L	98.5	Very high	98.4	Very high	105 Å²	105	103 Å²	103	55%	0.55	51%	0.51	S	S	.	.	H	α-helix	trans	-62.3	-44.4	177.5	-178.6	63.2	0	0	0	111.9	Q47 C48 N54 L55	Q47-L51 WeakPolarHBondContact O-CB 3.41Å; Q47-L51 PolarHBondContact O-N 2.89Å; C48-L51 PolarHBondContact O-N 3.49Å; L51-N54 PolarHBondContact O-N 2.99Å; L51-L55 HydrophobicContact CD1-CD1 4.44Å; L51-L55 HydrophobicContact CD1-CG 4.48Å; L51-L55 HydrophobicContact CG-CD1 4.2Å; L51-L55 WeakPolarHBondContact O-CG 3.44Å; L51-L55 PolarHBondContact O-N 3.05Å
52	L	98.4	Very high	98.4	Very high	105 Å²	105	100.2 Å²	100.2	55%	0.55	51%	0.505	S	S	.	.	H	α-helix	trans	-59.8	-48.6	176.2	-75.9	171.7	0	0	0	111.3	C48 K49 N54 L55 E56	C48-L52 WeakPolarHBondContact O-CB 3.35Å; C48-L52 WeakPolarHBondContact O-CG 3.31Å; C48-L52 PolarHBondContact O-N 3.4Å; K49-L52 PolarHBondContact O-N 2.77Å; L52-N54 VanDerWaalsContact C-N 3.33Å; L52-N54 PolarHBondContact O-N 2.71Å; L52-L55 PolarHBondContact O-N 2.93Å; L52-L55 VanDerWaalsContact O-N 3.12Å; L52-E56 WeakPolarHBondContact O-CG 3.11Å; L52-E56 PolarHBondContact O-N 3.42Å
53	S	98.3	Very high	98.4	Very high	51 Å²	51	98.6 Å²	98.6	36%	0.357	50%	0.499	S	S	.	.	H	α-helix	trans	-59.4	-42.7	178.3	-175.2	0	0	0	0	112.4	K49 S50 L55 E56 Q57	K49-S53 WeakPolarHBondContact O-CB 3.31Å; K49-S53 PolarHBondContact O-N 2.84Å; S50-S53 PolarHBondContact O-N 3.25Å; S53-L55 VanDerWaalsContact C-N 3.34Å; S53-L55 PolarHBondContact O-N 3.43Å; S53-E56 PolarHBondContact O-N 3.02Å; S53-Q57 WeakPolarHBondContact O-CG 3.39Å; S53-Q57 PolarHBondContact O-N 2.91Å
54	N	98.3	Very high	98.4	Very high	87 Å²	87	99.6 Å²	99.6	47%	0.465	51%	0.505	S	S	.	.	H	α-helix	trans	-63.5	-39	176	-70.8	-26	0	0	0	112.4	S50 L51 L52 K58	S50-N54 VanDerWaalsContact O-CG 3.24Å; S50-N54 PolarHBondContact O-N 2.85Å; S50-N54 PolarHBondContact O-ND2 3.45Å; L51-N54 PolarHBondContact O-N 2.99Å; L52-N54 VanDerWaalsContact C-N 3.33Å; L52-N54 PolarHBondContact O-N 2.71Å; N54-K58 WeakPolarHBondContact O-CB 3.47Å; N54-K58 PolarHBondContact O-N 3.29Å
55	L	98.4	Very high	98.4	Very high	86 Å²	86	98.6 Å²	98.6	45%	0.45	50%	0.499	S	S	.	.	H	α-helix	trans	-69.1	-41.9	177.4	-73.2	173.4	0	0	0	111.8	L51 L52 S53 K58 I59	L51-L55 HydrophobicContact CD1-CD1 4.44Å; L51-L55 HydrophobicContact CD1-CG 4.48Å; L51-L55 HydrophobicContact CG-CD1 4.2Å; L51-L55 WeakPolarHBondContact O-CG 3.44Å; L51-L55 PolarHBondContact O-N 3.05Å; L52-L55 PolarHBondContact O-N 2.93Å; L52-L55 VanDerWaalsContact O-N 3.12Å; S53-L55 VanDerWaalsContact C-N 3.34Å; S53-L55 PolarHBondContact O-N 3.43Å; L55-K58 PolarHBondContact O-N 3.44Å; L55-I59 VanDerWaalsContact O-CG1 3.31Å; L55-I59 WeakPolarHBondContact O-CG1 3.39Å; L55-I59 PolarHBondContact O-N 2.85Å
56	E	98.5	Very high	98.4	Very high	118 Å²	118	99.4 Å²	99.4	55%	0.551	50%	0.501	S	S	*	.	H	α-helix	trans	-59.9	-45.2	174.4	-72.5	172.2	166.8	0	0	111.4	L52 S53 K58 I59 N60	L52-E56 WeakPolarHBondContact O-CG 3.11Å; L52-E56 PolarHBondContact O-N 3.42Å; S53-E56 PolarHBondContact O-N 3.02Å; E56-K58 VanDerWaalsContact C-N 3.33Å; E56-K58 PolarHBondContact O-N 3.24Å; E56-I59 PolarHBondContact O-N 3.43Å; E56-N60 VanDerWaalsContact O-CG 3.32Å; E56-N60 PolarHBondContact O-N 2.95Å; E56-N60 PolarHBondContact O-ND2 3.43Å
57	Q	98.3	Very high	98.4	Very high	121 Å²	121	97.4 Å²	97.4	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-59.8	-42.5	174	-73.5	178.3	-5.7	0	0	112.1	S53 N60 K61	S53-Q57 WeakPolarHBondContact O-CG 3.39Å; S53-Q57 PolarHBondContact O-N 2.91Å; Q57-N60 PolarHBondContact O-N 3.43Å; Q57-K61 WeakPolarHBondContact O-CB 3.38Å; Q57-K61 PolarHBondContact O-N 2.95Å
58	K	98.5	Very high	98.4	Very high	131 Å²	131	94.7 Å²	94.7	57%	0.57	49%	0.489	S	S	*	.	H	α-helix	trans	-66	-40.4	177.9	-172.5	174.1	-178.7	178.2	0	112.1	N54 L55 E56 K61 L62	N54-K58 WeakPolarHBondContact O-CB 3.47Å; N54-K58 PolarHBondContact O-N 3.29Å; L55-K58 PolarHBondContact O-N 3.44Å; E56-K58 VanDerWaalsContact C-N 3.33Å; E56-K58 PolarHBondContact O-N 3.24Å; K58-K61 PolarHBondContact O-N 3.38Å; K58-L62 HydrophobicContact CG-CD1 4.12Å; K58-L62 WeakPolarHBondContact O-CB 3.48Å; K58-L62 WeakPolarHBondContact O-CG 3.36Å; K58-L62 PolarHBondContact O-N 2.86Å
59	I	98.4	Very high	98.4	Very high	109 Å²	109	96.3 Å²	96.3	56%	0.559	49%	0.492	S	S	*	.	H	α-helix	trans	-61	-49	175.2	-72.8	166.6	0	0	0	109.9	L55 E56 K61 L62 Q63	L55-I59 VanDerWaalsContact O-CG1 3.31Å; L55-I59 WeakPolarHBondContact O-CG1 3.39Å; L55-I59 PolarHBondContact O-N 2.85Å; E56-I59 PolarHBondContact O-N 3.43Å; I59-K61 VanDerWaalsContact C-N 3.31Å; I59-K61 PolarHBondContact O-N 3.45Å; I59-L62 PolarHBondContact O-N 2.99Å; I59-Q63 WeakPolarHBondContact O-CB 3.33Å; I59-Q63 PolarHBondContact O-N 3.12Å
60	N	98.4	Very high	98.4	Very high	99 Å²	99	95 Å²	95	53%	0.529	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-41.2	178.6	-70.2	-22.4	0	0	0	111.9	E56 Q57 Q63 N64	E56-N60 VanDerWaalsContact O-CG 3.32Å; E56-N60 PolarHBondContact O-N 2.95Å; E56-N60 PolarHBondContact O-ND2 3.43Å; Q57-N60 PolarHBondContact O-N 3.43Å; N60-Q63 PolarHBondContact O-N 3.43Å; N60-N64 PolarHBondContact O-N 3.38Å; N60-N64 PolarHBondContact O-ND2 3.02Å
61	K	98.5	Very high	98.4	Very high	131 Å²	131	98.1 Å²	98.1	57%	0.57	49%	0.494	S	S	*	.	H	α-helix	trans	-62.1	-48.5	175.8	-168.5	-172.7	-177.1	-153	0	111.9	Q57 K58 I59 Q63 N64 E65	Q57-K61 WeakPolarHBondContact O-CB 3.38Å; Q57-K61 PolarHBondContact O-N 2.95Å; K58-K61 PolarHBondContact O-N 3.38Å; I59-K61 VanDerWaalsContact C-N 3.31Å; I59-K61 PolarHBondContact O-N 3.45Å; K61-Q63 VanDerWaalsContact C-N 3.31Å; K61-Q63 PolarHBondContact O-N 3.2Å; K61-N64 PolarHBondContact O-N 2.96Å; K61-E65 WeakPolarHBondContact CE-OE1 3.35Å; K61-E65 IonicContact NZ-OE1 3.44Å; K61-E65 PolarHBondContact NZ-OE1 3.3Å; K61-E65 WeakPolarHBondContact O-CG 3.48Å; K61-E65 PolarHBondContact O-N 3.45Å
62	L	98.5	Very high	98.4	Very high	91 Å²	91	98.6 Å²	98.6	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-35.2	179.1	-73.7	171.6	0	0	0	112.3	K58 I59 E65 K66	K58-L62 HydrophobicContact CG-CD1 4.12Å; K58-L62 WeakPolarHBondContact O-CB 3.48Å; K58-L62 WeakPolarHBondContact O-CG 3.36Å; K58-L62 PolarHBondContact O-N 2.86Å; I59-L62 PolarHBondContact O-N 2.99Å; L62-E65 PolarHBondContact O-N 3.39Å; L62-K66 VanDerWaalsContact O-CB 3.31Å; L62-K66 WeakPolarHBondContact O-CB 3.38Å; L62-K66 PolarHBondContact O-N 3.38Å
63	Q	98.5	Very high	98.4	Very high	86 Å²	86	96 Å²	96	40%	0.402	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-45.5	174.9	-173.1	62	41.3	0	0	110.9	I59 N60 K61 E65 K66 D67	I59-Q63 WeakPolarHBondContact O-CB 3.33Å; I59-Q63 PolarHBondContact O-N 3.12Å; N60-Q63 PolarHBondContact O-N 3.43Å; K61-Q63 VanDerWaalsContact C-N 3.31Å; K61-Q63 PolarHBondContact O-N 3.2Å; Q63-E65 VanDerWaalsContact C-N 3.34Å; Q63-E65 PolarHBondContact O-N 3.02Å; Q63-K66 WeakPolarHBondContact O-CB 3.48Å; Q63-K66 PolarHBondContact O-N 3Å; Q63-D67 PolarHBondContact NE2-OD1 3.12Å; Q63-D67 PolarHBondContact O-N 2.96Å
64	N	98.3	Very high	98.4	Very high	110 Å²	110	99.3 Å²	99.3	59%	0.588	49%	0.493	S	S	*	.	H	α-helix	trans	-62.5	-40.7	175.5	-66.5	-17.4	0	0	0	112.1	N60 K61 A68	N60-N64 PolarHBondContact O-N 3.38Å; N60-N64 PolarHBondContact O-ND2 3.02Å; K61-N64 PolarHBondContact O-N 2.96Å; N64-A68 WeakPolarHBondContact O-CB 3.45Å; N64-A68 PolarHBondContact O-N 3.46Å
65	E	98.5	Very high	98.3	Very high	85 Å²	85	99.1 Å²	99.1	40%	0.397	49%	0.489	S	S	.	.	H	α-helix	trans	-63.8	-42.8	175.2	-73.9	173.3	-170.3	0	0	111.3	K61 L62 Q63 A68 I69	K61-E65 WeakPolarHBondContact CE-OE1 3.35Å; K61-E65 IonicContact NZ-OE1 3.44Å; K61-E65 PolarHBondContact NZ-OE1 3.3Å; K61-E65 WeakPolarHBondContact O-CG 3.48Å; K61-E65 PolarHBondContact O-N 3.45Å; L62-E65 PolarHBondContact O-N 3.39Å; Q63-E65 VanDerWaalsContact C-N 3.34Å; Q63-E65 PolarHBondContact O-N 3.02Å; E65-A68 PolarHBondContact O-N 3.38Å; E65-I69 VanDerWaalsContact O-CG1 3.28Å; E65-I69 WeakPolarHBondContact O-CG1 3.44Å; E65-I69 PolarHBondContact O-N 3.37Å
66	K	98.5	Very high	98.3	Very high	90 Å²	90	99.6 Å²	99.6	39%	0.391	49%	0.492	S	S	.	.	H	α-helix	trans	-57.8	-51.5	174.5	175.3	-169.3	174.3	-71.5	0	111.3	L62 Q63 A68 I69 E70	L62-K66 VanDerWaalsContact O-CB 3.31Å; L62-K66 WeakPolarHBondContact O-CB 3.38Å; L62-K66 PolarHBondContact O-N 3.38Å; Q63-K66 WeakPolarHBondContact O-CB 3.48Å; Q63-K66 PolarHBondContact O-N 3Å; K66-A68 VanDerWaalsContact C-N 3.3Å; K66-A68 PolarHBondContact O-N 3Å; K66-I69 PolarHBondContact O-N 3.25Å; K66-E70 WeakPolarHBondContact CE-OE1 3.46Å; K66-E70 IonicContact NZ-OE1 2.71Å; K66-E70 PolarHBondContact NZ-OE1 2.89Å; K66-E70 IonicContact NZ-OE2 2.77Å; K66-E70 PolarHBondContact NZ-OE2 3.4Å; K66-E70 WeakPolarHBondContact O-CG 3.37Å; K66-E70 PolarHBondContact O-N 3.34Å
67	D	98.4	Very high	98.3	Very high	71 Å²	71	101.8 Å²	101.8	38%	0.38	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-35.8	-176.3	-62.8	-15	0	0	0	111.1	Q63 E70 K71	Q63-D67 PolarHBondContact NE2-OD1 3.12Å; Q63-D67 PolarHBondContact O-N 2.96Å; D67-E70 PolarHBondContact O-N 3.38Å; D67-K71 WeakPolarHBondContact O-CB 3.22Å; D67-K71 PolarHBondContact O-N 2.87Å
68	A	98.3	Very high	98.3	Very high	60 Å²	60	101 Å²	101	50%	0.496	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-44.3	173.6	0	0	0	0	0	112.4	N64 E65 K66 K71 E72	N64-A68 WeakPolarHBondContact O-CB 3.45Å; N64-A68 PolarHBondContact O-N 3.46Å; E65-A68 PolarHBondContact O-N 3.38Å; K66-A68 VanDerWaalsContact C-N 3.3Å; K66-A68 PolarHBondContact O-N 3Å; A68-K71 PolarHBondContact O-N 2.91Å; A68-E72 PolarHBondContact O-N 3.46Å
69	I	98.3	Very high	98.3	Very high	99 Å²	99	100.9 Å²	100.9	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-40.8	176.9	-68.9	166.1	0	0	0	111	E65 K66 K71 E72 C73	E65-I69 VanDerWaalsContact O-CG1 3.28Å; E65-I69 WeakPolarHBondContact O-CG1 3.44Å; E65-I69 PolarHBondContact O-N 3.37Å; K66-I69 PolarHBondContact O-N 3.25Å; I69-K71 VanDerWaalsContact C-N 3.31Å; I69-K71 PolarHBondContact O-N 2.99Å; I69-E72 PolarHBondContact O-N 3.41Å; I69-C73 WeakPolarHBondContact O-CB 3.29Å; I69-C73 PolarHBondContact O-N 2.93Å; I69-C73 PolarHBondContact O-SG 3Å
70	E	98.4	Very high	98.3	Very high	97 Å²	97	101.1 Å²	101.1	45%	0.453	50%	0.496	S	S	.	.	H	α-helix	trans	-60.2	-42.8	176.4	-78.1	176.9	159.6	0	0	111.3	K66 D67 C73 E74	K66-E70 WeakPolarHBondContact CE-OE1 3.46Å; K66-E70 IonicContact NZ-OE1 2.71Å; K66-E70 PolarHBondContact NZ-OE1 2.89Å; K66-E70 IonicContact NZ-OE2 2.77Å; K66-E70 PolarHBondContact NZ-OE2 3.4Å; K66-E70 WeakPolarHBondContact O-CG 3.37Å; K66-E70 PolarHBondContact O-N 3.34Å; D67-E70 PolarHBondContact O-N 3.38Å; E70-C73 WeakPolarHBondContact O-CB 3.39Å; E70-C73 PolarHBondContact O-N 3.32Å; E70-E74 PolarHBondContact O-N 3.01Å
71	K	98.3	Very high	98.3	Very high	129 Å²	129	101.2 Å²	101.2	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-63.6	-46.5	174.6	-173.1	-177	176.6	-171	0	112.5	D67 A68 I69 C73 E74 E75	D67-K71 WeakPolarHBondContact O-CB 3.22Å; D67-K71 PolarHBondContact O-N 2.87Å; A68-K71 PolarHBondContact O-N 2.91Å; I69-K71 VanDerWaalsContact C-N 3.31Å; I69-K71 PolarHBondContact O-N 2.99Å; K71-C73 VanDerWaalsContact C-N 3.28Å; K71-C73 PolarHBondContact O-N 3.37Å; K71-E74 PolarHBondContact O-N 2.9Å; K71-E74 VanDerWaalsContact O-N 3.17Å; K71-E75 WeakPolarHBondContact CE-OE1 3.45Å; K71-E75 WeakPolarHBondContact O-CG 3.37Å; K71-E75 PolarHBondContact O-N 2.94Å
72	E	98.3	Very high	98.3	Very high	115 Å²	115	97.9 Å²	97.9	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-59.5	-40.6	176.3	-174.5	-178.3	-179.7	0	0	111.5	A68 I69 E74 E75 L76	A68-E72 PolarHBondContact O-N 3.46Å; I69-E72 PolarHBondContact O-N 3.41Å; E72-E74 VanDerWaalsContact C-N 3.34Å; E72-E74 PolarHBondContact O-N 3.39Å; E72-E75 PolarHBondContact O-N 3.34Å; E72-L76 HydrophobicContact CG-CD1 4.2Å; E72-L76 WeakPolarHBondContact O-CB 3.35Å; E72-L76 WeakPolarHBondContact O-CG 3.46Å; E72-L76 PolarHBondContact O-N 3.26Å
73	C	98	Very high	98.2	Very high	50 Å²	50	97.1 Å²	97.1	34%	0.338	50%	0.499	S	S	.	.	H	α-helix	trans	-63	-38.9	176.2	-72	0	0	0	0	112.4	I69 E70 K71 R77	I69-C73 WeakPolarHBondContact O-CB 3.29Å; I69-C73 PolarHBondContact O-N 2.93Å; I69-C73 PolarHBondContact O-SG 3Å; E70-C73 WeakPolarHBondContact O-CB 3.39Å; E70-C73 PolarHBondContact O-N 3.32Å; K71-C73 VanDerWaalsContact C-N 3.28Å; K71-C73 PolarHBondContact O-N 3.37Å; C73-R77 VanDerWaalsContact O-CG 3.29Å; C73-R77 WeakPolarHBondContact O-CG 3.17Å; C73-R77 PolarHBondContact O-N 3.24Å
74	E	98.1	Very high	98.2	Very high	120 Å²	120	96.6 Å²	96.6	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-65.3	-48.2	175.1	-169.5	169.8	-160.8	0	0	111.3	E70 K71 E72 L76 R77 D78	E70-E74 PolarHBondContact O-N 3.01Å; K71-E74 PolarHBondContact O-N 2.9Å; K71-E74 VanDerWaalsContact O-N 3.17Å; E72-E74 VanDerWaalsContact C-N 3.34Å; E72-E74 PolarHBondContact O-N 3.39Å; E74-L76 VanDerWaalsContact C-N 3.29Å; E74-L76 PolarHBondContact O-N 3.03Å; E74-R77 WeakPolarHBondContact O-CB 3.26Å; E74-R77 PolarHBondContact O-N 3.44Å; E74-R77 VanDerWaalsContact O-N 3.08Å; E74-D78 PolarHBondContact O-N 3.45Å
75	E	97.9	Very high	98.2	Very high	84 Å²	84	97.7 Å²	97.7	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-38.2	176.6	-69.8	179.4	-166	0	0	112.7	K71 E72 K79	K71-E75 WeakPolarHBondContact CE-OE1 3.45Å; K71-E75 WeakPolarHBondContact O-CG 3.37Å; K71-E75 PolarHBondContact O-N 2.94Å; E72-E75 PolarHBondContact O-N 3.34Å; E75-K79 VanDerWaalsContact O-CG 3.29Å; E75-K79 WeakPolarHBondContact O-CG 3.44Å; E75-K79 PolarHBondContact O-N 2.95Å
76	L	98.2	Very high	98.1	Very high	95 Å²	95	100.1 Å²	100.1	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-69.1	-37.1	175.9	-74.9	173.2	0	0	0	112.3	E72 E74 K79 L80	E72-L76 HydrophobicContact CG-CD1 4.2Å; E72-L76 WeakPolarHBondContact O-CB 3.35Å; E72-L76 WeakPolarHBondContact O-CG 3.46Å; E72-L76 PolarHBondContact O-N 3.26Å; E74-L76 VanDerWaalsContact C-N 3.29Å; E74-L76 PolarHBondContact O-N 3.03Å; L76-K79 PolarHBondContact O-N 3.38Å; L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 PolarHBondContact O-N 3.06Å
77	R	98.3	Very high	98.1	Very high	164 Å²	164	100.3 Å²	100.3	62%	0.619	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-43.8	173.7	-75.8	174.2	-171	136.7	2.2	111.1	C73 E74 K79 L80 V81	C73-R77 VanDerWaalsContact O-CG 3.29Å; C73-R77 WeakPolarHBondContact O-CG 3.17Å; C73-R77 PolarHBondContact O-N 3.24Å; E74-R77 WeakPolarHBondContact O-CB 3.26Å; E74-R77 PolarHBondContact O-N 3.44Å; E74-R77 VanDerWaalsContact O-N 3.08Å; R77-K79 PolarHBondContact O-N 2.85Å; R77-L80 WeakPolarHBondContact O-CB 3.5Å; R77-L80 PolarHBondContact O-N 3.34Å; R77-V81 WeakPolarHBondContact O-CG2 3.48Å; R77-V81 PolarHBondContact O-N 3.41Å
78	D	98.1	Very high	98	Very high	106 Å²	106	100.1 Å²	100.1	57%	0.567	52%	0.521	S	S	*	.	H	α-helix	trans	-62	-44.7	177.5	-72.4	-14.7	0	0	0	111.7	E74 L80 V81 A82	E74-D78 PolarHBondContact O-N 3.45Å; D78-L80 VanDerWaalsContact C-N 3.32Å; D78-L80 PolarHBondContact O-N 3.23Å; D78-V81 PolarHBondContact O-N 3.11Å; D78-A82 WeakPolarHBondContact O-CB 3.47Å; D78-A82 PolarHBondContact O-N 3.04Å
79	K	98.2	Very high	98	Very high	127 Å²	127	102.4 Å²	102.4	55%	0.552	52%	0.522	S	S	*	.	H	α-helix	trans	-60.5	-40.6	174.2	-73.6	167.6	-174.5	162.5	0	111.9	E75 L76 R77 A82 S83	E75-K79 VanDerWaalsContact O-CG 3.29Å; E75-K79 WeakPolarHBondContact O-CG 3.44Å; E75-K79 PolarHBondContact O-N 2.95Å; L76-K79 PolarHBondContact O-N 3.38Å; R77-K79 PolarHBondContact O-N 2.85Å; K79-A82 PolarHBondContact O-N 2.66Å; K79-S83 WeakPolarHBondContact O-CB 3.46Å; K79-S83 PolarHBondContact O-N 2.87Å
80	L	98.2	Very high	98	Very high	114 Å²	114	102 Å²	102	60%	0.597	52%	0.52	S	S	*	.	H	α-helix	trans	-64	-44.9	177.3	179.2	63.8	0	0	0	111.5	L76 R77 D78 S83 T84	L76-L80 WeakPolarHBondContact O-CB 3.45Å; L76-L80 PolarHBondContact O-N 3.06Å; R77-L80 WeakPolarHBondContact O-CB 3.5Å; R77-L80 PolarHBondContact O-N 3.34Å; D78-L80 VanDerWaalsContact C-N 3.32Å; D78-L80 PolarHBondContact O-N 3.23Å; L80-S83 PolarHBondContact O-N 3.34Å; L80-T84 WeakPolarHBondContact O-CB 3.45Å; L80-T84 PolarHBondContact O-N 3.02Å; L80-T84 PolarHBondContact O-OG1 2.97Å
81	V	98.3	Very high	97.9	Very high	101 Å²	101	102.6 Å²	102.6	61%	0.612	52%	0.523	S	S	*	.	H	α-helix	trans	-60.9	-47.7	176.2	171.7	0	0	0	0	110.7	R77 D78 S83 T84 H85	R77-V81 WeakPolarHBondContact O-CG2 3.48Å; R77-V81 PolarHBondContact O-N 3.41Å; D78-V81 PolarHBondContact O-N 3.11Å; V81-S83 PolarHBondContact O-N 3.18Å; V81-T84 PolarHBondContact O-N 3.17Å; V81-H85 PolarHBondContact O-N 3.41Å
82	A	98	Very high	97.8	Very high	62 Å²	62	97.8 Å²	97.8	51%	0.512	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-42.4	178.2	0	0	0	0	0	112.5	D78 K79 H85 K86	D78-A82 WeakPolarHBondContact O-CB 3.47Å; D78-A82 PolarHBondContact O-N 3.04Å; K79-A82 PolarHBondContact O-N 2.66Å; A82-H85 PolarHBondContact O-N 2.89Å; A82-K86 WeakPolarHBondContact O-CB 3.42Å; A82-K86 PolarHBondContact O-N 3.48Å
83	S	97.6	Very high	97.7	Very high	74 Å²	74	94.5 Å²	94.5	52%	0.517	50%	0.496	S	S	.	.	H	α-helix	trans	-65.3	-38.5	175.9	-172	0	0	0	0	112.2	K79 L80 V81 K86 L87	K79-S83 WeakPolarHBondContact O-CB 3.46Å; K79-S83 PolarHBondContact O-N 2.87Å; L80-S83 PolarHBondContact O-N 3.34Å; V81-S83 PolarHBondContact O-N 3.18Å; S83-K86 PolarHBondContact O-N 3.3Å; S83-L87 WeakPolarHBondContact O-CB 3.31Å; S83-L87 PolarHBondContact O-N 2.89Å
84	T	98	Very high	97.6	Very high	75 Å²	75	96.6 Å²	96.6	46%	0.46	50%	0.503	S	S	.	.	H	α-helix	trans	-64.9	-45.9	176.9	-56.5	0	0	0	0	111	L80 V81 K86 L87 S88	L80-T84 WeakPolarHBondContact O-CB 3.45Å; L80-T84 PolarHBondContact O-N 3.02Å; L80-T84 PolarHBondContact O-OG1 2.97Å; V81-T84 PolarHBondContact O-N 3.17Å; T84-K86 VanDerWaalsContact C-N 3.34Å; T84-K86 PolarHBondContact O-N 3.46Å; T84-L87 PolarHBondContact O-N 3.14Å; T84-S88 PolarHBondContact O-N 3.3Å; T84-S88 PolarHBondContact O-OG 3.42Å
85	H	97.6	Very high	97.5	Very high	134 Å²	134	94.1 Å²	94.1	62%	0.62	50%	0.499	S	S	*	.	H	α-helix	trans	-59.1	-44.8	175.1	179.7	-84.5	0	0	0	111.9	V81 A82 L87 S88 Q89	V81-H85 PolarHBondContact O-N 3.41Å; A82-H85 PolarHBondContact O-N 2.89Å; H85-L87 VanDerWaalsContact C-N 3.33Å; H85-L87 PolarHBondContact O-N 3.34Å; H85-S88 PolarHBondContact O-N 2.74Å; H85-Q89 PolarHBondContact O-N 3.23Å
86	K	98.1	Very high	97.3	Very high	136 Å²	136	97.2 Å²	97.2	59%	0.591	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-40	176.8	-174.2	175.3	-178.7	178.6	0	112.2	A82 S83 T84 Q89 L90	A82-K86 WeakPolarHBondContact O-CB 3.42Å; A82-K86 PolarHBondContact O-N 3.48Å; S83-K86 PolarHBondContact O-N 3.3Å; T84-K86 VanDerWaalsContact C-N 3.34Å; T84-K86 PolarHBondContact O-N 3.46Å; K86-Q89 PolarHBondContact O-N 2.99Å; K86-L90 HydrophobicContact CG-CD1 4.38Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 3.32Å
87	L	97.6	Very high	97.1	Very high	93 Å²	93	98.5 Å²	98.5	49%	0.487	51%	0.513	S	S	.	.	H	α-helix	trans	-63.3	-48.5	176.7	-173.9	152.7	0	0	0	110.8	S83 T84 H85 Q89 L90 E91	S83-L87 WeakPolarHBondContact O-CB 3.31Å; S83-L87 PolarHBondContact O-N 2.89Å; T84-L87 PolarHBondContact O-N 3.14Å; H85-L87 VanDerWaalsContact C-N 3.33Å; H85-L87 PolarHBondContact O-N 3.34Å; L87-Q89 VanDerWaalsContact C-N 3.29Å; L87-Q89 PolarHBondContact O-N 2.98Å; L87-L90 PolarHBondContact O-N 2.91Å; L87-L90 VanDerWaalsContact O-N 3.16Å; L87-E91 HydrophobicContact CD2-CG 3.99Å; L87-E91 VanDerWaalsContact CD2-OE1 3.31Å; L87-E91 WeakPolarHBondContact CD2-OE1 3.35Å; L87-E91 WeakPolarHBondContact CD2-OE2 3.46Å; L87-E91 WeakPolarHBondContact O-CG 3.45Å; L87-E91 PolarHBondContact O-N 3.29Å
88	S	97	Very high	96.7	Very high	67 Å²	67	95.1 Å²	95.1	47%	0.469	51%	0.507	S	S	.	.	H	α-helix	trans	-59.2	-38.1	175.7	-63.8	0	0	0	0	113.2	T84 H85 G92	T84-S88 PolarHBondContact O-N 3.3Å; T84-S88 PolarHBondContact O-OG 3.42Å; H85-S88 PolarHBondContact O-N 2.74Å; S88-G92 PolarHBondContact O-N 3.47Å
89	Q	97.3	Very high	96.2	Very high	109 Å²	109	95.8 Å²	95.8	51%	0.509	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-49.3	174.4	-175.2	-179.3	5.3	0	0	111.4	H85 K86 L87 E91 G92 D93	H85-Q89 PolarHBondContact O-N 3.23Å; K86-Q89 PolarHBondContact O-N 2.99Å; L87-Q89 VanDerWaalsContact C-N 3.29Å; L87-Q89 PolarHBondContact O-N 2.98Å; Q89-E91 PolarHBondContact O-N 3.42Å; Q89-G92 PolarHBondContact O-N 3.03Å; Q89-G92 VanDerWaalsContact O-N 3.16Å; Q89-D93 VanDerWaalsContact O-CG 3.23Å; Q89-D93 PolarHBondContact O-N 3.46Å; Q89-D93 VanDerWaalsContact O-OD1 3.07Å
90	L	97.4	Very high	95.5	Very high	90 Å²	90	92.5 Å²	92.5	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-39.7	179	-71	172.3	0	0	0	112.4	K86 L87 G92 D93 I94	K86-L90 HydrophobicContact CG-CD1 4.38Å; K86-L90 WeakPolarHBondContact O-CG 3.42Å; K86-L90 PolarHBondContact O-N 3.32Å; L87-L90 PolarHBondContact O-N 2.91Å; L87-L90 VanDerWaalsContact O-N 3.16Å; L90-G92 VanDerWaalsContact C-N 3.31Å; L90-G92 PolarHBondContact O-N 2.89Å; L90-D93 PolarHBondContact O-N 3.33Å; L90-I94 WeakPolarHBondContact O-CB 3.45Å; L90-I94 VanDerWaalsContact O-CG1 3.26Å; L90-I94 WeakPolarHBondContact O-CG1 3.48Å; L90-I94 PolarHBondContact O-N 2.91Å
91	E	96.9	Very high	94.7	Very high	110 Å²	110	94.6 Å²	94.6	51%	0.514	51%	0.508	S	S	.	.	H	α-helix	trans	-61.1	-40.5	173.5	-72.3	178.1	149	0	0	111.9	L87 Q89 S95	L87-E91 HydrophobicContact CD2-CG 3.99Å; L87-E91 VanDerWaalsContact CD2-OE1 3.31Å; L87-E91 WeakPolarHBondContact CD2-OE1 3.35Å; L87-E91 WeakPolarHBondContact CD2-OE2 3.46Å; L87-E91 WeakPolarHBondContact O-CG 3.45Å; L87-E91 PolarHBondContact O-N 3.29Å; Q89-E91 PolarHBondContact O-N 3.42Å; E91-S95 WeakPolarHBondContact O-CB 3.48Å; E91-S95 PolarHBondContact O-N 2.9Å; E91-S95 PolarHBondContact O-OG 3.47Å
92	G	97.1	Very high	93.4	Very high	27 Å²	27	98.8 Å²	98.8	28%	0.278	51%	0.513	S	S	.	.	H	α-helix	trans	-62.5	-43.3	173.1	0	0	0	0	0	112.4	S88 Q89 L90 S95 R96	S88-G92 PolarHBondContact O-N 3.47Å; Q89-G92 PolarHBondContact O-N 3.03Å; Q89-G92 VanDerWaalsContact O-N 3.16Å; L90-G92 VanDerWaalsContact C-N 3.31Å; L90-G92 PolarHBondContact O-N 2.89Å; G92-S95 PolarHBondContact O-N 3.21Å; G92-R96 WeakPolarHBondContact O-CG 3.29Å; G92-R96 PolarHBondContact O-N 3.34Å; G92-R96 PolarHBondContact O-NH1 3.37Å; G92-R96 VanDerWaalsContact O-NH1 3.15Å
93	D	96.5	Very high	92	Very high	47 Å²	47	98.8 Å²	98.8	25%	0.251	51%	0.509	S	S	.	.	H	α-helix	trans	-65.8	-44.2	179.4	-65	1.4	0	0	0	111.4	Q89 L90 S95 R96 L97	Q89-D93 VanDerWaalsContact O-CG 3.23Å; Q89-D93 PolarHBondContact O-N 3.46Å; Q89-D93 VanDerWaalsContact O-OD1 3.07Å; L90-D93 PolarHBondContact O-N 3.33Å; D93-S95 VanDerWaalsContact C-N 3.31Å; D93-S95 PolarHBondContact O-N 2.96Å; D93-R96 PolarHBondContact O-N 3.13Å; D93-R96 IonicContact OD1-CZ 3.15Å; D93-R96 IonicContact OD1-NH1 2.93Å; D93-R96 PolarHBondContact OD1-NH1 3.15Å; D93-R96 IonicContact OD1-NH2 2.59Å; D93-R96 PolarHBondContact OD1-NH2 2.96Å; D93-L97 WeakPolarHBondContact O-CG 3.43Å; D93-L97 PolarHBondContact O-N 3.44Å
94	I	96	Very high	90.2	Very high	94 Å²	94	99.5 Å²	99.5	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-58.9	-44	174.2	-71.3	166.6	0	0	0	110.6	L90 R96 L97 N98	L90-I94 WeakPolarHBondContact O-CB 3.45Å; L90-I94 VanDerWaalsContact O-CG1 3.26Å; L90-I94 WeakPolarHBondContact O-CG1 3.48Å; L90-I94 PolarHBondContact O-N 2.91Å; I94-R96 PolarHBondContact O-N 3.09Å; I94-L97 PolarHBondContact O-N 3.07Å; I94-N98 WeakPolarHBondContact CG2-ND2 3.39Å; I94-N98 WeakPolarHBondContact O-CB 3.47Å; I94-N98 PolarHBondContact O-N 2.85Å; I94-N98 PolarHBondContact O-ND2 3.34Å
95	S	94.4	Very high	88.3	Confident	67 Å²	67	99.4 Å²	99.4	47%	0.469	51%	0.509	S	S	.	.	H	α-helix	trans	-62	-42.3	178.2	-60.7	0	0	0	0	111.8	E91 G92 D93 N98 L99	E91-S95 WeakPolarHBondContact O-CB 3.48Å; E91-S95 PolarHBondContact O-N 2.9Å; E91-S95 PolarHBondContact O-OG 3.47Å; G92-S95 PolarHBondContact O-N 3.21Å; D93-S95 VanDerWaalsContact C-N 3.31Å; D93-S95 PolarHBondContact O-N 2.96Å; S95-N98 PolarHBondContact O-N 3.31Å; S95-L99 WeakPolarHBondContact O-CG 3.43Å; S95-L99 PolarHBondContact O-N 2.95Å; S95-L99 VanDerWaalsContact O-N 3.12Å
96	R	94.3	Very high	86.3	Confident	150 Å²	150	99.8 Å²	99.8	57%	0.566	52%	0.516	S	S	*	.	H	α-helix	trans	-66	-43.1	175.8	-67.3	-168.6	-49.6	-82.9	11.7	112.5	G92 D93 I94 N98 L99 S100	G92-R96 WeakPolarHBondContact O-CG 3.29Å; G92-R96 PolarHBondContact O-N 3.34Å; G92-R96 PolarHBondContact O-NH1 3.37Å; G92-R96 VanDerWaalsContact O-NH1 3.15Å; D93-R96 PolarHBondContact O-N 3.13Å; D93-R96 IonicContact OD1-CZ 3.15Å; D93-R96 IonicContact OD1-NH1 2.93Å; D93-R96 PolarHBondContact OD1-NH1 3.15Å; D93-R96 IonicContact OD1-NH2 2.59Å; D93-R96 PolarHBondContact OD1-NH2 2.96Å; I94-R96 PolarHBondContact O-N 3.09Å; R96-N98 VanDerWaalsContact C-N 3.35Å; R96-N98 PolarHBondContact O-N 3.28Å; R96-L99 PolarHBondContact O-N 3.47Å; R96-S100 PolarHBondContact O-N 2.89Å
97	L	93.6	Very high	84.1	Confident	121 Å²	121	103.7 Å²	103.7	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-61.4	-42.2	176	-74.8	170	0	0	0	111.8	D93 I94 L99 S100 K101	D93-L97 WeakPolarHBondContact O-CG 3.43Å; D93-L97 PolarHBondContact O-N 3.44Å; I94-L97 PolarHBondContact O-N 3.07Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 3.36Å; L97-S100 PolarHBondContact O-N 3.32Å; L97-K101 WeakPolarHBondContact O-CB 3.33Å; L97-K101 PolarHBondContact O-N 2.92Å
98	N	91	Very high	81.8	Confident	93 Å²	93	104.2 Å²	104.2	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-65.1	-35.9	177.2	-77.8	-34.6	0	0	0	112.8	I94 S95 R96 R102	I94-N98 WeakPolarHBondContact CG2-ND2 3.39Å; I94-N98 WeakPolarHBondContact O-CB 3.47Å; I94-N98 PolarHBondContact O-N 2.85Å; I94-N98 PolarHBondContact O-ND2 3.34Å; S95-N98 PolarHBondContact O-N 3.31Å; R96-N98 VanDerWaalsContact C-N 3.35Å; R96-N98 PolarHBondContact O-N 3.28Å; N98-R102 WeakPolarHBondContact O-CG 3.42Å; N98-R102 PolarHBondContact O-N 2.93Å
99	L	86.7	Confident	79.2	Confident	121 Å²	121	106.1 Å²	106.1	63%	0.634	55%	0.546	S	S	*	.	H	α-helix	trans	-68.2	-43.6	173.3	-70.1	169.4	0	0	0	111.8	S95 R96 L97 K101 R102 S103	S95-L99 WeakPolarHBondContact O-CG 3.43Å; S95-L99 PolarHBondContact O-N 2.95Å; S95-L99 VanDerWaalsContact O-N 3.12Å; R96-L99 PolarHBondContact O-N 3.47Å; L97-L99 VanDerWaalsContact C-N 3.34Å; L97-L99 PolarHBondContact O-N 3.36Å; L99-K101 PolarHBondContact O-N 3.4Å; L99-R102 PolarHBondContact O-N 3.45Å; L99-S103 PolarHBondContact O-N 2.99Å; L99-S103 VanDerWaalsContact O-N 3.09Å
100	S	84.5	Confident	76.7	Confident	57 Å²	57	110.5 Å²	110.5	40%	0.399	56%	0.564	S	S	.	*	H	α-helix	trans	-61.7	-42.5	176.7	-167	0	0	0	0	112.2	R96 L97 R102 S103 D104	R96-S100 PolarHBondContact O-N 2.89Å; L97-S100 PolarHBondContact O-N 3.32Å; S100-R102 PolarHBondContact O-N 3.45Å; S100-S103 WeakPolarHBondContact CA-OG 3.46Å; S100-S103 PolarHBondContact O-N 3.29Å; S100-S103 PolarHBondContact O-OG 2.97Å; S100-D104 PolarHBondContact O-N 3.29Å
101	K	81.1	Confident	74.1	Confident	158 Å²	158	111.8 Å²	111.8	69%	0.687	58%	0.58	S	S	*	*	H	α-helix	trans	-61.7	-32.9	177.4	-172.5	177	178.9	-179.9	0	112.3	L97 L99 S105	L97-K101 WeakPolarHBondContact O-CB 3.33Å; L97-K101 PolarHBondContact O-N 2.92Å; L99-K101 PolarHBondContact O-N 3.4Å; K101-S105 PolarHBondContact O-N 3.36Å
102	R	71.1	Confident	71.5	Confident	190 Å²	190	113.2 Å²	113.2	72%	0.717	59%	0.591	S	S	*	*	H	α-helix	trans	-72.2	-41.8	174.4	-73.9	-179.5	169.9	-151.3	-2.4	111.9	N98 L99 S100 D104 S105 D106	N98-R102 WeakPolarHBondContact O-CG 3.42Å; N98-R102 PolarHBondContact O-N 2.93Å; L99-R102 PolarHBondContact O-N 3.45Å; S100-R102 PolarHBondContact O-N 3.45Å; R102-D104 VanDerWaalsContact C-N 3.32Å; R102-D104 PolarHBondContact O-N 2.9Å; R102-S105 PolarHBondContact O-N 3.46Å; R102-D106 PolarHBondContact O-N 3.37Å
103	S	67.2	Low	69.2	Low	62 Å²	62	119.5 Å²	119.5	43%	0.434	61%	0.613	S	S	.	*	H	α-helix	trans	-66.7	-31.8	177.4	54.9	0	0	0	0	113.6	L99 S100	L99-S103 PolarHBondContact O-N 2.99Å; L99-S103 VanDerWaalsContact O-N 3.09Å; S100-S103 WeakPolarHBondContact CA-OG 3.46Å; S100-S103 PolarHBondContact O-N 3.29Å; S100-S103 PolarHBondContact O-OG 2.97Å
104	D	60.2	Low	66.8	Low	88 Å²	88	122.8 Å²	122.8	47%	0.471	63%	0.63	S	S	.	*	H	α-helix	trans	-75.3	-32.3	176.1	-69.3	-30.2	0	0	0	112	S100 R102 D106 R107 T108	S100-D104 PolarHBondContact O-N 3.29Å; R102-D104 VanDerWaalsContact C-N 3.32Å; R102-D104 PolarHBondContact O-N 2.9Å; D104-D106 VanDerWaalsContact C-N 3.25Å; D104-D106 PolarHBondContact O-N 2.95Å; D104-R107 PolarHBondContact O-N 3.21Å; D104-R107 VanDerWaalsContact O-N 3.14Å; D104-T108 PolarHBondContact O-N 3.03Å; D104-T108 VanDerWaalsContact O-N 3.12Å; D104-T108 PolarHBondContact O-OG1 3.47Å
105	S	58.4	Low	64.6	Low	74 Å²	74	127.2 Å²	127.2	52%	0.517	65%	0.648	S	S	.	*	H	α-helix	trans	-63.3	-30.1	174.9	-169.6	0	0	0	0	112.8	K101 R102 R107	K101-S105 PolarHBondContact O-N 3.36Å; R102-S105 PolarHBondContact O-N 3.46Å; S105-R107 VanDerWaalsContact C-N 3.35Å
106	D	55	Low	62.4	Low	141 Å²	141	131 Å²	131	75%	0.754	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-12.6	177.1	-70.9	-21.3	0	0	0	113	R102 D104	R102-D106 PolarHBondContact O-N 3.37Å; D104-D106 VanDerWaalsContact C-N 3.25Å; D104-D106 PolarHBondContact O-N 2.95Å
107	R	53.4	Low	60.1	Low	219 Å²	219	134.5 Å²	134.5	83%	0.826	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-9.7	177.2	-74.9	-173.6	165.4	-167.4	-3.7	114.2	D104 S105	D104-R107 PolarHBondContact O-N 3.21Å; D104-R107 VanDerWaalsContact O-N 3.14Å; S105-R107 VanDerWaalsContact C-N 3.35Å
108	T	49.2	Very low	57.9	Low	104 Å²	104	133.7 Å²	133.7	64%	0.638	68%	0.679	S	S	*	*			trans	-115.8	56.4	-176.6	51.1	0	0	0	0	112.1	D104	D104-T108 PolarHBondContact O-N 3.03Å; D104-T108 VanDerWaalsContact O-N 3.12Å; D104-T108 PolarHBondContact O-OG1 3.47Å
109	C	41.7	Very low	55.8	Low	106 Å²	106	134.8 Å²	134.8	72%	0.716	69%	0.689	S	S	*	*	S	Bend	trans	-95.6	13.3	162.9	-74.5	0	0	0	0	113.6
110	F	45.8	Very low	53.6	Low	202 Å²	202	138.7 Å²	138.7	89%	0.886	70%	0.704	S	S	*	*	S	Bend	trans	-139	71.1	176.8	-63.5	-78	0	0	0	111.2
111	S	41.7	Very low	51.7	Low	116 Å²	116	140.6 Å²	140.6	81%	0.811	72%	0.717	S	S	*	*			trans	-171.8	109.8	147.9	-163.6	0	0	0	0	110.2
112	D	42.6	Very low	50.1	Low	140 Å²	140	138.6 Å²	138.6	75%	0.749	72%	0.718	S	S	*	*			trans	-60	131.8	166.2	-68.6	-54.7	0	0	0	111.2
113	H	47.9	Very low	48.6	Very low	160 Å²	160	138.7 Å²	138.7	74%	0.741	73%	0.727	S	S	*	*				158	115.4	118.1	-85.2	-17.6	0	0	0	113.8
114	I	47.9	Very low	47.6	Very low	116 Å²	116	141 Å²	141	60%	0.595	74%	0.743	S	S	*	*				64	102	127.5	-51	166.8	0	0	0	117.2
115	H	49.4	Very low	46.8	Very low	186 Å²	186	141.8 Å²	141.8	86%	0.861	76%	0.756	S	S	*	*				-163.7	120.3	107.5	-98	-54.6	0	0	0	113.3
116	I	47	Very low	46.2	Very low	146 Å²	146	144.7 Å²	144.7	75%	0.749	77%	0.765	S	S	*	*			trans	-58.6	143.6	168.7	-61.4	152.9	0	0	0	110.3
117	R	46.9	Very low	45.7	Very low	224 Å²	224	143.7 Å²	143.7	85%	0.845	76%	0.764	S	S	*	*				137.1	131.3	121.9	-145.2	171.6	-153.7	-165.5	3.5	114.9
118	S	46.9	Very low	45.5	Very low	104 Å²	104	141.6 Å²	141.6	73%	0.727	77%	0.768	S	S	*	*			trans	75.2	127.2	149.3	-103.2	0	0	0	0	116.6
119	V	48.3	Very low	45.4	Very low	117 Å²	117	143.8 Å²	143.8	71%	0.709	78%	0.776	S	S	*	*			cis	-156	129.6	23.9	-177	0	0	0	0	108.1	S121	V119-S121 PolarHBondContact O-N 2.8Å
120	Q	40.5	Very low	45.8	Very low	202 Å²	202	142.8 Å²	142.8	94%	0.944	77%	0.768	S	S	*	*			trans	-67.1	115	155.4	-79.1	171.5	-27.9	0	0	107.9
121	S	44	Very low	46	Very low	98 Å²	98	142.4 Å²	142.4	69%	0.685	77%	0.766	S	S	*	*			trans	-130.1	96.2	166.8	-174.4	0	0	0	0	108.8	V119	V119-S121 PolarHBondContact O-N 2.8Å
122	T	47.6	Very low	46.5	Very low	116 Å²	116	145 Å²	145	71%	0.712	76%	0.764	S	S	*	*			trans	33.4	112	138.4	50.8	0	0	0	0	118.8	S124	T122-S124 PolarHBondContact O-N 2.92Å
123	Q	39.5	Very low	47.3	Very low	192 Å²	192	143.7 Å²	143.7	90%	0.897	76%	0.762	S	S	*	*			trans	-12.8	117	138.2	-62.9	173.1	13.1	0	0	113.9
124	S	45.9	Very low	47.5	Very low	109 Å²	109	147.2 Å²	147.2	76%	0.762	77%	0.769	S	S	*	*			trans	-135.3	90.2	149.4	43.8	0	0	0	0	107.3	T122 D126	T122-S124 PolarHBondContact O-N 2.92Å; S124-D126 PolarHBondContact O-N 3.33Å
125	S	42.6	Very low	47.5	Very low	106 Å²	106	146.6 Å²	146.6	74%	0.741	77%	0.774	S	S	*	*			trans	-79.5	86.4	160.5	49.3	0	0	0	0	107.3
126	D	46.3	Very low	47.3	Very low	135 Å²	135	141.3 Å²	141.3	72%	0.722	76%	0.758	S	S	*	*			trans	-147.2	112.2	170.2	-86.9	-42.1	0	0	0	111.2	S124	S124-D126 PolarHBondContact O-N 3.33Å
127	T	45.9	Very low	47.7	Very low	119 Å²	119	140 Å²	140	73%	0.73	76%	0.759	S	S	*	*			trans	50.3	88.8	141.7	56.8	0	0	0	0	118.8
128	L	48.8	Very low	47.8	Very low	175 Å²	175	137.5 Å²	137.5	92%	0.916	76%	0.762	S	S	*	*			trans	-148.4	77.7	138.7	-76.3	-174	0	0	0	109.4	P130	L128-P130 VanDerWaalsContact O-CD 3.24Å; L128-P130 WeakPolarHBondContact O-CD 3.33Å
129	N	46.7	Very low	47.8	Very low	150 Å²	150	136 Å²	136	80%	0.802	75%	0.752	S	S	*	*			trans	-99.3	93	167	-150.4	-17.8	0	0	0	105.7	K131	N129-K131 VanDerWaalsContact C-N 3.33Å; N129-K131 PolarHBondContact O-N 3.38Å; N129-K131 VanDerWaalsContact O-N 3.1Å
130	P	50.2	Low	47.9	Very low	85 Å²	85	135 Å²	135	55%	0.552	76%	0.756	S	S	*	*			trans	-74	102.9	161	30.4	-25.3	0	0	0	104.5	L128 F132	L128-P130 VanDerWaalsContact O-CD 3.24Å; L128-P130 WeakPolarHBondContact O-CD 3.33Å; P130-F132 HydrophobicContact CB-CD2 4.43Å; P130-F132 HydrophobicContact CB-CE2 4.28Å; P130-F132 HydrophobicContact CG-CD2 4.24Å; P130-F132 HydrophobicContact CG-CE2 3.87Å; P130-F132 PolarHBondContact O-N 3.5Å
131	K	50.2	Low	48.3	Very low	194 Å²	194	133.2 Å²	133.2	84%	0.843	75%	0.745	S	S	*	*			trans	-56.4	88.9	156.7	-96.8	175.3	172.6	175	0	106.2	N129 P133	N129-K131 VanDerWaalsContact C-N 3.33Å; N129-K131 PolarHBondContact O-N 3.38Å; N129-K131 VanDerWaalsContact O-N 3.1Å; K131-P133 WeakPolarHBondContact O-CD 3.37Å
132	F	50.9	Low	48.7	Very low	172 Å²	172	133.1 Å²	133.1	75%	0.754	74%	0.742	S	S	*	*			trans	-58.3	122	157.8	-78	-80.2	0	0	0	105.6	P130 R134	P130-F132 HydrophobicContact CB-CD2 4.43Å; P130-F132 HydrophobicContact CB-CE2 4.28Å; P130-F132 HydrophobicContact CG-CD2 4.24Å; P130-F132 HydrophobicContact CG-CE2 3.87Å; P130-F132 PolarHBondContact O-N 3.5Å; F132-R134 PolarHBondContact O-N 2.91Å
133	P	60.8	Low	48.8	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	74%	0.738	S	S	*	*			trans	-60.6	109	163.7	-10.9	26	0	0	0	105.2	K131 C135	K131-P133 WeakPolarHBondContact O-CD 3.37Å; P133-C135 VanDerWaalsContact C-N 3.33Å; P133-C135 PolarHBondContact O-N 3.15Å
134	R	51.1	Low	49.3	Very low	234 Å²	234	128.5 Å²	128.5	88%	0.883	73%	0.733	S	S	*	*			trans	-58.3	104.3	165.8	-84.9	-176.3	170.5	-177	-2.8	106	F132 S136	F132-R134 PolarHBondContact O-N 2.91Å; R134-S136 PolarHBondContact O-N 2.91Å
135	C	49	Very low	49.3	Very low	103 Å²	103	132.3 Å²	132.3	70%	0.696	74%	0.736	S	S	*	*			trans	-61.5	93.9	163.5	-66.4	0	0	0	0	106.6	P133	P133-C135 VanDerWaalsContact C-N 3.33Å; P133-C135 PolarHBondContact O-N 3.15Å
136	S	45.2	Very low	48.9	Very low	76 Å²	76	130.2 Å²	130.2	53%	0.531	73%	0.731	S	S	.	*			trans	-71.9	128.1	164.6	-61.1	0	0	0	0	106.6	R134 D138	R134-S136 PolarHBondContact O-N 2.91Å; S136-D138 PolarHBondContact O-N 3.22Å
137	P	55.1	Low	48.8	Very low	118 Å²	118	132.2 Å²	132.2	77%	0.766	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	86.8	172.4	30.6	-27.7	0	0	0	106.4
138	D	49	Very low	48.7	Very low	171 Å²	171	129.8 Å²	129.8	91%	0.914	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	169.1	1.6	160.9	-89.7	-19.1	0	0	0	113.9	S136 A140	S136-D138 PolarHBondContact O-N 3.22Å; D138-A140 PolarHBondContact O-N 3.27Å
139	S	47.2	Very low	48.3	Very low	73 Å²	73	129.8 Å²	129.8	51%	0.51	74%	0.741	S	S	.	*			trans	-91.3	108.2	173.1	58	0	0	0	0	111.4	F141	S139-F141 PolarHBondContact O-N 3.44Å
140	A	49.2	Very low	48.3	Very low	96 Å²	96	133.5 Å²	133.5	79%	0.793	74%	0.744	S	S	*	*			trans	-50.2	107.5	164.1	0	0	0	0	0	109.6	D138 P142	D138-A140 PolarHBondContact O-N 3.27Å; A140-P142 VanDerWaalsContact O-CD 3.29Å; A140-P142 WeakPolarHBondContact O-CD 3.43Å
141	F	48.7	Very low	48	Very low	164 Å²	164	138.5 Å²	138.5	72%	0.719	76%	0.76	S	S	*	*			trans	-63.1	121.8	168.8	-80.7	-88.6	0	0	0	107.8	S139 S143	S139-F141 PolarHBondContact O-N 3.44Å; F141-S143 PolarHBondContact O-N 3.35Å
142	P	52.4	Low	47.7	Very low	96 Å²	96	134.4 Å²	134.4	62%	0.623	76%	0.756	S	S	*	*			trans	-64.8	111.9	154.6	13.8	-1.4	0	0	0	105.9	A140 F145	A140-P142 VanDerWaalsContact O-CD 3.29Å; A140-P142 WeakPolarHBondContact O-CD 3.43Å; P142-F145 HydrophobicContact CB-CD2 4.11Å; P142-F145 HydrophobicContact CB-CE2 3.46Å; P142-F145 VanDerWaalsContact CB-CE2 3.46Å; P142-F145 HydrophobicContact CB-CZ 4.4Å
143	S	50	Low	47.6	Very low	87 Å²	87	133.2 Å²	133.2	61%	0.608	75%	0.752	S	S	*	*			trans	-37.3	143.2	159.8	174.4	0	0	0	0	109.4	F141 F145	F141-S143 PolarHBondContact O-N 3.35Å; S143-F145 VanDerWaalsContact O-CD2 3.26Å; S143-F145 WeakPolarHBondContact O-CD2 3.39Å; S143-F145 PolarHBondContact O-N 3.16Å
144	P	51.2	Low	46.8	Very low	124 Å²	124	137.5 Å²	137.5	81%	0.805	76%	0.76	S	S	*	*	S	Bend	trans	-59.3	94.9	171.2	26.7	-31.5	0	0	0	107.9	G146	P144-G146 PolarHBondContact O-N 2.95Å
145	F	44.3	Very low	46.5	Very low	189 Å²	189	133.1 Å²	133.1	83%	0.829	75%	0.754	S	S	*	*			trans	-49.2	133.9	169.1	-74.1	-89.1	0	0	0	108.2	P142 S143	P142-F145 HydrophobicContact CB-CD2 4.11Å; P142-F145 HydrophobicContact CB-CE2 3.46Å; P142-F145 VanDerWaalsContact CB-CE2 3.46Å; P142-F145 HydrophobicContact CB-CZ 4.4Å; S143-F145 VanDerWaalsContact O-CD2 3.26Å; S143-F145 WeakPolarHBondContact O-CD2 3.39Å; S143-F145 PolarHBondContact O-N 3.16Å
146	G	34.9	Very low	46.5	Very low	62 Å²	62	137.5 Å²	137.5	64%	0.639	76%	0.761	S	S	*	*			cis	176.4	175.6	-0.3	0	0	0	0	0	114.6	P144	P144-G146 PolarHBondContact O-N 2.95Å
147	L	44.7	Very low	46.3	Very low	177 Å²	177	139.9 Å²	139.9	93%	0.927	78%	0.778	S	S	*	*			trans	-129	103.1	150.6	-78.5	167	0	0	0	104.9
148	G	42.5	Very low	45.9	Very low	68 Å²	68	143.8 Å²	143.8	70%	0.701	78%	0.783	S	S	*	*			trans	-55.8	147.6	171.4	0	0	0	0	0	110.1	R150	G148-R150 PolarHBondContact O-N 3.39Å
149	N	40.5	Very low	45.6	Very low	176 Å²	176	147 Å²	147	94%	0.941	78%	0.782	S	S	*	*			trans	-40.1	101.9	157.6	-88.8	-16.8	0	0	0	110.2
150	R	46.9	Very low	45.5	Very low	228 Å²	228	148 Å²	148	86%	0.86	79%	0.787	S	S	*	*			trans	-122.8	116.7	148.6	-83.4	-163.2	174.2	-131.8	1.4	106.6	G148 S152	G148-R150 PolarHBondContact O-N 3.39Å; R150-S152 PolarHBondContact O-N 3.19Å
151	Q	43.8	Very low	45.1	Very low	190 Å²	190	152.8 Å²	152.8	89%	0.888	79%	0.793	S	S	*	*			trans	-46.5	97	147.9	-75.5	167.8	-26.7	0	0	107.5
152	S	45.2	Very low	44.9	Very low	108 Å²	108	152.1 Å²	152.1	76%	0.755	80%	0.795	S	S	*	*			trans	-104	101	165.6	64.5	0	0	0	0	106.9	R150	R150-S152 PolarHBondContact O-N 3.19Å
153	H	48.4	Very low	44.5	Very low	147 Å²	147	152.9 Å²	152.9	68%	0.681	80%	0.802	S	S	*	*			trans	-35.6	135.6	164.1	-65.8	-94.5	0	0	0	111.7	N155	H153-N155 VanDerWaalsContact C-N 3.33Å; H153-N155 PolarHBondContact O-N 2.84Å
154	F	43.2	Very low	44	Very low	201 Å²	201	153.9 Å²	153.9	88%	0.882	81%	0.809	S	S	*	*			trans	-48.3	100.6	157.1	-82.9	-92.4	0	0	0	108.6
155	N	45.4	Very low	43.7	Very low	141 Å²	141	153 Å²	153	75%	0.754	81%	0.806	S	S	*	*			trans	-117.9	100	167.4	-82.2	-41.1	0	0	0	106.4	H153 S157	H153-N155 VanDerWaalsContact C-N 3.33Å; H153-N155 PolarHBondContact O-N 2.84Å; N155-S157 PolarHBondContact O-N 3.36Å; N155-S157 VanDerWaalsContact O-N 3.12Å
156	F	48	Very low	43.5	Very low	196 Å²	196	151.8 Å²	151.8	86%	0.86	81%	0.808	S	S	*	*			trans	-55	114.6	161.1	-86.9	-89.9	0	0	0	108.1	K158	F156-K158 PolarHBondContact O-N 2.81Å
157	S	41.7	Very low	43.9	Very low	126 Å²	126	155.7 Å²	155.7	88%	0.881	81%	0.814	S	S	*	*			trans	-55.1	107.2	166.2	-84.3	0	0	0	0	109.6	N155	N155-S157 PolarHBondContact O-N 3.36Å; N155-S157 VanDerWaalsContact O-N 3.12Å
158	K	45.9	Very low	43.8	Very low	200 Å²	200	155.7 Å²	155.7	87%	0.87	81%	0.807	S	S	*	*			trans	-93.6	111.9	153.1	-75.9	-174	177.5	-178.5	0	107.5	F156	F156-K158 PolarHBondContact O-N 2.81Å
159	R	43.9	Very low	43.7	Very low	239 Å²	239	159.4 Å²	159.4	90%	0.902	81%	0.81	S	S	*	*			trans	-175.2	158.6	149.5	-116.6	-164.9	176.2	-168.3	-0.7	112
160	P	44.2	Very low	43.7	Very low	93 Å²	93	155.1 Å²	155.1	60%	0.604	80%	0.799	S	S	*	*				-129.4	149.2	-93.2	38.3	-23.1	0	0	0	112.2
161	E	42.4	Very low	43.6	Very low	197 Å²	197	152.4 Å²	152.4	92%	0.921	80%	0.796	S	S	*	*			trans	-123.7	109.8	156.4	-72.2	-155.1	168	0	0	110.3	S163	E161-S163 PolarHBondContact O-N 3.09Å
162	I	44.2	Very low	43.7	Very low	150 Å²	150	149.8 Å²	149.8	77%	0.769	79%	0.793	S	S	*	*			trans	-73	107.6	164.2	-64.8	160.8	0	0	0	105.2
163	S	43.1	Very low	43.4	Very low	111 Å²	111	149.6 Å²	149.6	78%	0.776	79%	0.792	S	S	*	*			trans	-122.4	94.2	156.8	-167.8	0	0	0	0	107.6	E161 S165	E161-S163 PolarHBondContact O-N 3.09Å; S163-S165 PolarHBondContact O-N 3.46Å
164	S	40.7	Very low	43.1	Very low	108 Å²	108	153.2 Å²	153.2	76%	0.755	80%	0.799	S	S	*	*			trans	-76.5	107	176.6	-55.1	0	0	0	0	108.8
165	S	44.7	Very low	43.2	Very low	105 Å²	105	152.7 Å²	152.7	73%	0.734	80%	0.797	S	S	*	*			trans	-133.2	74.1	160.5	64.5	0	0	0	0	109.2	S163	S163-S165 PolarHBondContact O-N 3.46Å
166	N	39.5	Very low	43.1	Very low	164 Å²	164	151 Å²	151	88%	0.877	80%	0.796	S	S	*	*			trans	-93.8	105.7	160.8	-79.2	-28	0	0	0	107.5
167	L	43.8	Very low	42.8	Very low	144 Å²	144	147.8 Å²	147.8	75%	0.754	80%	0.795	S	S	*	*			trans	-141.7	118.8	168.2	-87	175	0	0	0	109
168	F	42.7	Very low	42.9	Very low	178 Å²	178	147.3 Å²	147.3	78%	0.781	79%	0.786	S	S	*	*			trans	72.3	137.9	159.3	-66.8	-72	0	0	0	117.1
169	L	40.1	Very low	42.8	Very low	146 Å²	146	146.9 Å²	146.9	76%	0.764	79%	0.785	S	S	*	*			cis	-176.5	165.9	3	-176.7	61.5	0	0	0	106.5
170	A	40.6	Very low	42.7	Very low	85 Å²	85	142.7 Å²	142.7	70%	0.702	78%	0.777	S	S	*	*			trans	95.2	86.7	173.3	0	0	0	0	0	115.1
171	Q	43.4	Very low	42.6	Very low	171 Å²	171	146 Å²	146	80%	0.799	79%	0.789	S	S	*	*				81.4	128.6	78	-74.8	-174.1	-14.3	0	0	115
172	T	46.9	Very low	42.8	Very low	135 Å²	135	142.9 Å²	142.9	83%	0.828	78%	0.778	S	S	*	*			trans	85.1	97.5	169	79.9	0	0	0	0	115.6
173	S	39	Very low	42.6	Very low	105 Å²	105	141.1 Å²	141.1	73%	0.734	78%	0.776	S	S	*	*				69.9	94.4	74.8	-164.5	0	0	0	0	114.6
174	R	42.1	Very low	42.8	Very low	223 Å²	223	141.3 Å²	141.3	84%	0.842	77%	0.769	S	S	*	*				156.3	117	117.7	-82.4	-178.1	-170.4	-166.7	4	113.3
175	K	44.2	Very low	43.1	Very low	190 Å²	190	140.7 Å²	140.7	83%	0.826	76%	0.762	S	S	*	*			trans	60.1	119.3	131.5	-58.9	-173.6	177.2	-174.7	0	121.6
176	S	44.6	Very low	43.1	Very low	106 Å²	106	144.6 Å²	144.6	74%	0.741	77%	0.766	S	S	*	*			trans	91	133.1	140.2	72.5	0	0	0	0	119.9
177	P	41.6	Very low	43.3	Very low	127 Å²	127	143.3 Å²	143.3	83%	0.825	76%	0.759	S	S	*	*			trans	-94.1	109.8	179.7	35	-26.5	0	0	0	110.6
178	T	43.8	Very low	43.2	Very low	116 Å²	116	142.3 Å²	142.3	71%	0.712	75%	0.754	S	S	*	*			trans	-91.4	111.4	167.8	-57.6	0	0	0	0	109	M180	T178-M180 PolarHBondContact O-N 2.9Å
179	K	42.5	Very low	43.1	Very low	191 Å²	191	140 Å²	140	83%	0.83	75%	0.749	S	S	*	*			trans	-60.6	101	164.7	-69.2	177.6	178	178.5	0	108.5	L181	K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.41Å; K179-L181 VanDerWaalsContact O-N 3.11Å
180	M	42.9	Very low	43.4	Very low	152 Å²	152	138.4 Å²	138.4	75%	0.749	75%	0.751	S	S	*	*			trans	-79.4	86.5	166.3	-77	-83.4	-80.6	0	0	108.5	T178 L182	T178-M180 PolarHBondContact O-N 2.9Å; M180-L182 HydrophobicContact CE-CD1 3.55Å; M180-L182 PolarHBondContact O-N 2.76Å
181	L	41.3	Very low	43.8	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	76%	0.756	S	S	*	*			trans	-68.1	98.3	157.2	-93.9	150.2	0	0	0	107.4	K179	K179-L181 VanDerWaalsContact C-N 3.32Å; K179-L181 PolarHBondContact O-N 3.41Å; K179-L181 VanDerWaalsContact O-N 3.11Å
182	L	46.3	Very low	44.2	Very low	131 Å²	131	142.3 Å²	142.3	69%	0.686	75%	0.751	S	S	*	*			trans	-108.5	125.7	161.2	-101.3	133.6	0	0	0	108.3	M180 N184	M180-L182 HydrophobicContact CE-CD1 3.55Å; M180-L182 PolarHBondContact O-N 2.76Å; L182-N184 PolarHBondContact O-N 3.2Å
183	P	40.6	Very low	44.3	Very low	112 Å²	112	143.1 Å²	143.1	73%	0.727	75%	0.75	S	S	*	*			trans	-73.3	125.4	-176.4	29.3	-31.2	0	0	0	109.1	P185	P183-P185 VanDerWaalsContact C-CD 3.47Å; P183-P185 WeakPolarHBondContact O-CD 3.13Å
184	N	46.8	Very low	44.6	Very low	116 Å²	116	145.4 Å²	145.4	62%	0.62	75%	0.753	S	S	*	*			trans	-111	85.3	177.9	-150.2	-4.8	0	0	0	109.5	L182 F186 L187	L182-N184 PolarHBondContact O-N 3.2Å; N184-F186 VanDerWaalsContact C-N 3.32Å; N184-L187 WeakPolarHBondContact ND2-CD1 3.45Å
185	P	47	Very low	45	Very low	95 Å²	95	139.6 Å²	139.6	62%	0.617	75%	0.747	S	S	*	*			trans	-84.8	-3.2	172.8	33.1	-31.4	0	0	0	112.9	P183	P183-P185 VanDerWaalsContact C-CD 3.47Å; P183-P185 WeakPolarHBondContact O-CD 3.13Å
186	F	44.5	Very low	45.4	Very low	186 Å²	186	139.7 Å²	139.7	82%	0.816	75%	0.747	S	S	*	*	S	Bend	trans	-95.5	-6.3	-169.9	-84	-78.7	0	0	0	116.3	N184	N184-F186 VanDerWaalsContact C-N 3.32Å
187	L	45.3	Very low	45.6	Very low	138 Å²	138	142.9 Å²	142.9	72%	0.723	75%	0.754	S	S	*	*	S	Bend	trans	-102	-2.2	-179.4	-68.3	179.3	0	0	0	115.1	N184	N184-L187 WeakPolarHBondContact ND2-CD1 3.45Å
188	N	41	Very low	45.9	Very low	123 Å²	123	142.1 Å²	142.1	66%	0.658	75%	0.752	S	S	*	*	S	Bend	trans	-97.3	-1	-169.9	-132.6	-23.1	0	0	0	115.8
189	N	41.3	Very low	46.3	Very low	128 Å²	128	142 Å²	142	68%	0.684	76%	0.756	S	S	*	*	S	Bend	trans	-111.6	-5.1	-178.3	-80.5	-9.6	0	0	0	115.1	L191	N189-L191 PolarHBondContact O-N 3.06Å
190	S	46.7	Very low	46.8	Very low	114 Å²	114	142.4 Å²	142.4	80%	0.797	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-0.4	-172.1	-146.1	0	0	0	0	115.5
191	L	48	Very low	47	Very low	153 Å²	153	140 Å²	140	80%	0.801	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.4	6.8	-179.9	-67.3	176.1	0	0	0	114.6	N189	N189-L191 PolarHBondContact O-N 3.06Å
192	R	52.1	Low	47.3	Very low	185 Å²	185	139 Å²	139	70%	0.698	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-0.8	-179.1	-76.8	-168.1	-170.9	-161.6	2.8	115.7
193	N	48.5	Very low	47.6	Very low	152 Å²	152	142.9 Å²	142.9	81%	0.813	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	12.7	-174.2	-75.3	-28	0	0	0	115.9
194	L	46.3	Very low	48	Very low	153 Å²	153	150.9 Å²	150.9	80%	0.801	78%	0.779	S	S	*	*	S	Bend	trans	-97.8	9.9	176.5	-71	171.8	0	0	0	114.5
195	S	50.6	Low	48.1	Very low	101 Å²	101	152.7 Å²	152.7	71%	0.706	79%	0.787	S	S	*	*	S	Bend	trans	-99.5	16.5	-175.7	61	0	0	0	0	116
196	K	52.6	Low	48.1	Very low	191 Å²	191	155.7 Å²	155.7	83%	0.83	80%	0.795	S	S	*	*			trans	-126.6	9.5	-175.7	-70.4	-169.4	179.1	-177.2	0	117.4	S198	K196-S198 PolarHBondContact O-N 3.43Å
197	I	48.4	Very low	48.4	Very low	174 Å²	174	154 Å²	154	89%	0.892	79%	0.794	S	S	*	*			trans	-97.6	75.2	175.4	-56.4	173.4	0	0	0	108.6
198	S	48.4	Very low	48.5	Very low	110 Å²	110	154.9 Å²	154.9	77%	0.769	80%	0.799	S	S	*	*			trans	-143.6	92.4	172.2	169.1	0	0	0	0	109.2	K196	K196-S198 PolarHBondContact O-N 3.43Å
199	S	50.5	Low	49	Very low	115 Å²	115	156.9 Å²	156.9	80%	0.804	81%	0.807	S	S	*	*			trans	178.9	104.5	138.2	50.6	0	0	0	0	108.6
200	K	53	Low	49.5	Very low	198 Å²	198	158.9 Å²	158.9	86%	0.861	82%	0.816	S	S	*	*			trans	-55.4	-178.5	154.5	-59.5	179	172.9	177.9	0	110
201	P	46.9	Very low	49.7	Very low	102 Å²	102	162.1 Å²	162.1	66%	0.662	82%	0.817	S	S	*	*			cis	-138.5	166.6	-7.4	14.3	13.1	0	0	0	115.5
202	L	48.7	Very low	49.8	Very low	143 Å²	143	162.8 Å²	162.8	75%	0.749	82%	0.818	S	S	*	*			trans	43	139.5	131.7	-65	150.1	0	0	0	123.2
203	Y	52.2	Low	49.7	Very low	212 Å²	212	160.9 Å²	160.9	83%	0.831	83%	0.828	S	S	*	*			trans	83.3	96.6	156.7	-69.7	-74	0	0	0	119.1
204	K	49.9	Very low	49.8	Very low	280 Å²	280	161.7 Å²	161.7	100%	1.217	83%	0.829	S	S	*	*				-156.8	0	94.7	-108.2	-179.8	-179.7	178.5	0	110

Retrieved 204 of 204 residues in 67.9 ms (Link to these results)

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