A0AA82MER5_SCHMA Loading...

GIT2 AlphaSync

AlphaFold DB , UniProt , Accession A0AA82MER5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 224 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	40.9	Very low	75.6	Confident	235 Å²	235	96.7 Å²	96.7	100%	1.158	51%	0.511	S	S	*	.				0	130.9	0	-85.7	172.2	169.8	0	0	108.2	V3	M1-V3 PolarHBondContact O-N 2.88Å; M1-V3 VanDerWaalsContact O-N 3.13Å
2	K	47.8	Very low	77.1	Confident	216 Å²	216	101.2 Å²	101.2	94%	0.939	52%	0.518	S	S	*	.			trans	-60	116	165.4	-94.5	172.6	173.8	173	0	106.2	G4	K2-G4 VanDerWaalsContact C-N 3.27Å; K2-G4 PolarHBondContact O-N 3.38Å
3	V	54.7	Low	78.5	Confident	115 Å²	115	98.9 Å²	98.9	70%	0.697	50%	0.499	S	S	*	.			trans	-61.7	98.7	171.6	-178.3	0	0	0	0	105.4	M1	M1-V3 PolarHBondContact O-N 2.88Å; M1-V3 VanDerWaalsContact O-N 3.13Å
4	G	64.4	Low	79.8	Confident	50 Å²	50	100.8 Å²	100.8	52%	0.515	50%	0.503	S	S	.	.			trans	-57.3	148.6	176.2	0	0	0	0	0	108.7	K2 I6	K2-G4 VanDerWaalsContact C-N 3.27Å; K2-G4 PolarHBondContact O-N 3.38Å; G4-I6 VanDerWaalsContact C-N 3.29Å; G4-I6 WeakPolarHBondContact O-CG1 3.38Å; G4-I6 PolarHBondContact O-N 3Å
5	N	82.8	Confident	80.9	Confident	122 Å²	122	100.5 Å²	100.5	65%	0.652	50%	0.497	S	S	*	.			trans	-64.5	90.7	178.8	-177.3	-4.9	0	0	0	109.8	E7 G8 A9	N5-E7 PolarHBondContact O-N 3.49Å; N5-E7 WeakPolarHBondContact OD1-CB 3.23Å; N5-E7 PolarHBondContact OD1-N 3.49Å; N5-G8 PolarHBondContact O-N 3.45Å; N5-G8 VanDerWaalsContact O-N 3.12Å; N5-G8 PolarHBondContact OD1-N 2.68Å; N5-A9 PolarHBondContact O-N 2.92Å
6	I	86.3	Confident	81.9	Confident	38 Å²	38	97.5 Å²	97.5	20%	0.195	49%	0.489	C	S	.	.	H	α-helix	trans	-60	-37	-178.2	-58.2	-179.6	0	0	0	109.9	G4 A9 I10 V51 K55 I58	G4-I6 VanDerWaalsContact C-N 3.29Å; G4-I6 WeakPolarHBondContact O-CG1 3.38Å; G4-I6 PolarHBondContact O-N 3Å; I6-A9 WeakPolarHBondContact O-CB 3.33Å; I6-A9 PolarHBondContact O-N 3.19Å; I6-I10 HydrophobicContact CG2-CD1 3.99Å; I6-I10 HydrophobicContact CG2-CG1 4.43Å; I6-I10 VanDerWaalsContact O-CG1 3.31Å; I6-I10 WeakPolarHBondContact O-CG1 3.48Å; I6-I10 PolarHBondContact O-N 2.65Å; I6-V51 HydrophobicContact CG2-CG1 3.68Å; I6-K55 HydrophobicContact CG2-CB 3.91Å; I6-K55 HydrophobicContact CG2-CG 4.46Å; I6-I58 HydrophobicContact CD1-CD1 3.22Å
7	E	88.2	Confident	82.8	Confident	99 Å²	99	92.5 Å²	92.5	46%	0.463	46%	0.464	S	S	.	.	H	α-helix	trans	-63.5	-43	177.1	-161.1	61	-150.1	0	0	111.7	N5 A9 I10 Y11 K55	N5-E7 PolarHBondContact O-N 3.49Å; N5-E7 WeakPolarHBondContact OD1-CB 3.23Å; N5-E7 PolarHBondContact OD1-N 3.49Å; E7-A9 PolarHBondContact O-N 3.17Å; E7-I10 PolarHBondContact O-N 3.17Å; E7-Y11 WeakPolarHBondContact O-CB 3.4Å; E7-Y11 PolarHBondContact O-N 3.11Å; E7-K55 IonicContact OE1-NZ 3.7Å; E7-K55 WeakPolarHBondContact OE2-CE 3.4Å; E7-K55 IonicContact OE2-NZ 2.65Å; E7-K55 PolarHBondContact OE2-NZ 2.85Å
8	G	89.6	Confident	83.5	Confident	18 Å²	18	90.5 Å²	90.5	19%	0.186	46%	0.464	C	S	.	.	H	α-helix	trans	-59.7	-44.6	172.7	0	0	0	0	0	112	N5 Y11 Y12	N5-G8 PolarHBondContact O-N 3.45Å; N5-G8 VanDerWaalsContact O-N 3.12Å; N5-G8 PolarHBondContact OD1-N 2.68Å; G8-Y11 WeakPolarHBondContact O-CB 3.45Å; G8-Y11 PolarHBondContact O-N 2.97Å; G8-Y12 WeakPolarHBondContact O-CD2 3.48Å; G8-Y12 PolarHBondContact O-N 3.35Å
9	A	90.2	Very high	84.2	Confident	32 Å²	32	92.1 Å²	92.1	26%	0.264	47%	0.468	S	S	.	.	H	α-helix	trans	-60.9	-47.9	176.3	0	0	0	0	0	111.7	N5 I6 E7 Y11 Y12 Y13 V51	N5-A9 PolarHBondContact O-N 2.92Å; I6-A9 WeakPolarHBondContact O-CB 3.33Å; I6-A9 PolarHBondContact O-N 3.19Å; E7-A9 PolarHBondContact O-N 3.17Å; A9-Y11 VanDerWaalsContact C-N 3.29Å; A9-Y11 PolarHBondContact O-N 2.93Å; A9-Y12 PolarHBondContact O-N 3.36Å; A9-Y13 HydrophobicContact CB-CD2 4.46Å; A9-Y13 HydrophobicContact CB-CE2 4.3Å; A9-Y13 WeakPolarHBondContact O-CD2 3.34Å; A9-Y13 PolarHBondContact O-N 2.96Å; A9-V51 HydrophobicContact CB-CG1 4.23Å
10	I	92.6	Very high	84.8	Confident	7 Å²	7	89.4 Å²	89.4	4%	0.036	45%	0.453	C	S	.	.	H	α-helix	trans	-56.8	-44	176.2	-69.9	168.8	0	0	0	110.9	I6 E7 Y13 K14 L48 V51 V52 K55	I6-I10 HydrophobicContact CG2-CD1 3.99Å; I6-I10 HydrophobicContact CG2-CG1 4.43Å; I6-I10 VanDerWaalsContact O-CG1 3.31Å; I6-I10 WeakPolarHBondContact O-CG1 3.48Å; I6-I10 PolarHBondContact O-N 2.65Å; E7-I10 PolarHBondContact O-N 3.17Å; I10-Y13 PolarHBondContact O-N 3.19Å; I10-K14 HydrophobicContact CG2-CD 4.18Å; I10-K14 WeakPolarHBondContact O-CG 3.47Å; I10-K14 PolarHBondContact O-N 3.33Å; I10-L48 HydrophobicContact CB-CD1 4.4Å; I10-L48 HydrophobicContact CG1-CD1 4.35Å; I10-L48 HydrophobicContact CG2-CD1 4.06Å; I10-V51 HydrophobicContact CD1-CG1 4.35Å; I10-V51 HydrophobicContact CG1-CG1 3.68Å; I10-V52 HydrophobicContact CD1-CG2 4.14Å; I10-V52 HydrophobicContact CG1-CG2 4.27Å; I10-K55 HydrophobicContact CD1-CB 4.33Å; I10-K55 HydrophobicContact CD1-CD 3.54Å
11	Y	93.8	Very high	85.3	Confident	132 Å²	132	88.4 Å²	88.4	52%	0.518	45%	0.447	S	S	.	.	H	α-helix	trans	-59.6	-47.8	177	171.8	-98.9	0	0	0	112.1	E7 G8 A9 K14 K15	E7-Y11 WeakPolarHBondContact O-CB 3.4Å; E7-Y11 PolarHBondContact O-N 3.11Å; G8-Y11 WeakPolarHBondContact O-CB 3.45Å; G8-Y11 PolarHBondContact O-N 2.97Å; A9-Y11 VanDerWaalsContact C-N 3.29Å; A9-Y11 PolarHBondContact O-N 2.93Å; Y11-K14 PolarHBondContact O-N 3.29Å; Y11-K15 HydrophobicContact CE1-CD 4.41Å; Y11-K15 WeakPolarHBondContact O-CB 3.45Å; Y11-K15 PolarHBondContact O-N 2.91Å
12	Y	94	Very high	87.9	Confident	150 Å²	150	81.6 Å²	81.6	59%	0.588	42%	0.415	S	S	*	.	H	α-helix	trans	-66.3	-41.9	178.9	-73.7	-63.9	0	0	0	112.5	G8 A9 K14 K15 S16	G8-Y12 WeakPolarHBondContact O-CD2 3.48Å; G8-Y12 PolarHBondContact O-N 3.35Å; A9-Y12 PolarHBondContact O-N 3.36Å; Y12-K14 PolarHBondContact O-N 2.96Å; Y12-K15 PolarHBondContact O-N 2.88Å; Y12-S16 WeakPolarHBondContact O-CB 3.39Å; Y12-S16 PolarHBondContact O-N 3.46Å; Y12-S16 PolarHBondContact O-OG 3.49Å
13	Y	95.8	Very high	90	Very high	72 Å²	72	74 Å²	74	28%	0.282	39%	0.387	S	S	.	.	H	α-helix	trans	-58.2	-46.9	174.7	-80.1	-61.1	0	0	0	112	A9 I10 K15 S16 I17 L44 L48 V51	A9-Y13 HydrophobicContact CB-CD2 4.46Å; A9-Y13 HydrophobicContact CB-CE2 4.3Å; A9-Y13 WeakPolarHBondContact O-CD2 3.34Å; A9-Y13 PolarHBondContact O-N 2.96Å; I10-Y13 PolarHBondContact O-N 3.19Å; Y13-K15 VanDerWaalsContact C-N 3.34Å; Y13-K15 PolarHBondContact O-N 3.4Å; Y13-S16 PolarHBondContact O-N 3.29Å; Y13-I17 WeakPolarHBondContact O-CB 3.49Å; Y13-I17 WeakPolarHBondContact O-CD1 3.4Å; Y13-I17 VanDerWaalsContact O-CG1 3.24Å; Y13-I17 WeakPolarHBondContact O-CG1 3.45Å; Y13-I17 PolarHBondContact O-N 2.91Å; Y13-L44 HydrophobicContact CD1-CD2 4.09Å; Y13-L48 HydrophobicContact CG-CB 4.34Å; Y13-V51 HydrophobicContact CD2-CG2 4.43Å; Y13-V51 HydrophobicContact CE2-CB 4.47Å; Y13-V51 HydrophobicContact CE2-CG2 3.79Å
14	K	96.2	Very high	91.8	Very high	125 Å²	125	72.3 Å²	72.3	54%	0.543	37%	0.368	S	S	.	.	H	α-helix	trans	-59.8	-43.9	176.4	-74.4	178.3	175.7	-177.2	0	112	I10 Y11 Y12 I17 A18 L48	I10-K14 HydrophobicContact CG2-CD 4.18Å; I10-K14 WeakPolarHBondContact O-CG 3.47Å; I10-K14 PolarHBondContact O-N 3.33Å; Y11-K14 PolarHBondContact O-N 3.29Å; Y12-K14 PolarHBondContact O-N 2.96Å; K14-I17 PolarHBondContact O-N 3.07Å; K14-A18 PolarHBondContact O-N 2.78Å; K14-L48 HydrophobicContact CG-CD2 4.09Å
15	K	96.4	Very high	93.2	Very high	96 Å²	96	77.9 Å²	77.9	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-63.9	-43.8	178.2	-173.7	170.8	179.6	174.4	0	111.8	Y11 Y12 Y13 A18 F19	Y11-K15 HydrophobicContact CE1-CD 4.41Å; Y11-K15 WeakPolarHBondContact O-CB 3.45Å; Y11-K15 PolarHBondContact O-N 2.91Å; Y12-K15 PolarHBondContact O-N 2.88Å; Y13-K15 VanDerWaalsContact C-N 3.34Å; Y13-K15 PolarHBondContact O-N 3.4Å; K15-A18 PolarHBondContact O-N 3.29Å; K15-F19 HydrophobicContact CD-CE2 4.25Å; K15-F19 HydrophobicContact CG-CD2 4.05Å; K15-F19 HydrophobicContact CG-CE2 3.67Å; K15-F19 WeakPolarHBondContact O-CD2 3.49Å; K15-F19 PolarHBondContact O-N 2.92Å; K15-F19 VanDerWaalsContact O-N 3.14Å
16	S	96.2	Very high	93.6	Very high	53 Å²	53	79.1 Å²	79.1	37%	0.371	38%	0.382	S	S	.	.	H	α-helix	trans	-65.6	-40.7	176.9	-65.7	0	0	0	0	112.7	Y12 Y13 F19 M20	Y12-S16 WeakPolarHBondContact O-CB 3.39Å; Y12-S16 PolarHBondContact O-N 3.46Å; Y12-S16 PolarHBondContact O-OG 3.49Å; Y13-S16 PolarHBondContact O-N 3.29Å; S16-F19 PolarHBondContact O-N 3.44Å; S16-M20 WeakPolarHBondContact O-CB 3.42Å; S16-M20 PolarHBondContact O-N 3.06Å
17	I	97.1	Very high	93.9	Very high	13 Å²	13	78.8 Å²	78.8	7%	0.067	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-45.9	174.9	-70.5	163.3	0	0	0	110.4	Y13 K14 F19 M20 E21 L44 K45 L48	Y13-I17 WeakPolarHBondContact O-CB 3.49Å; Y13-I17 WeakPolarHBondContact O-CD1 3.4Å; Y13-I17 VanDerWaalsContact O-CG1 3.24Å; Y13-I17 WeakPolarHBondContact O-CG1 3.45Å; Y13-I17 PolarHBondContact O-N 2.91Å; K14-I17 PolarHBondContact O-N 3.07Å; I17-F19 VanDerWaalsContact C-N 3.34Å; I17-F19 PolarHBondContact O-N 3.22Å; I17-M20 PolarHBondContact O-N 3.46Å; I17-E21 HydrophobicContact CG2-CG 4.28Å; I17-E21 WeakPolarHBondContact O-CB 3.44Å; I17-E21 WeakPolarHBondContact O-CG 3.29Å; I17-E21 PolarHBondContact O-N 3.02Å; I17-L44 HydrophobicContact CD1-CB 4.42Å; I17-L44 HydrophobicContact CG1-CB 3.78Å; I17-K45 HydrophobicContact CD1-CG 3.95Å; I17-K45 HydrophobicContact CG1-CG 4.39Å; I17-K45 HydrophobicContact CG2-CG 4.49Å; I17-L48 HydrophobicContact CD1-CB 4.23Å; I17-L48 HydrophobicContact CD1-CD2 3.65Å
18	A	96.7	Very high	94	Very high	56 Å²	56	82 Å²	82	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-40.7	179	0	0	0	0	0	112.6	K14 K15 L22	K14-A18 PolarHBondContact O-N 2.78Å; K15-A18 PolarHBondContact O-N 3.29Å; A18-L22 PolarHBondContact O-N 3.47Å; A18-L22 VanDerWaalsContact O-N 3.1Å
19	F	96.4	Very high	93.8	Very high	121 Å²	121	89.2 Å²	89.2	53%	0.531	43%	0.426	S	S	.	.	H	α-helix	trans	-65.9	-42.2	174	-76.8	-59	0	0	0	112.4	K15 S16 I17 E21 L22 T23	K15-F19 HydrophobicContact CD-CE2 4.25Å; K15-F19 HydrophobicContact CG-CD2 4.05Å; K15-F19 HydrophobicContact CG-CE2 3.67Å; K15-F19 WeakPolarHBondContact O-CD2 3.49Å; K15-F19 PolarHBondContact O-N 2.92Å; K15-F19 VanDerWaalsContact O-N 3.14Å; S16-F19 PolarHBondContact O-N 3.44Å; I17-F19 VanDerWaalsContact C-N 3.34Å; I17-F19 PolarHBondContact O-N 3.22Å; F19-E21 VanDerWaalsContact C-N 3.33Å; F19-E21 PolarHBondContact O-N 3.44Å; F19-L22 WeakPolarHBondContact O-CB 3.46Å; F19-L22 PolarHBondContact O-N 3.36Å; F19-T23 PolarHBondContact O-N 2.91Å; F19-T23 PolarHBondContact O-OG1 3Å; F19-T23 VanDerWaalsContact O-OG1 3.05Å
20	M	95.3	Very high	93.6	Very high	37 Å²	37	91.1 Å²	91.1	18%	0.182	45%	0.449	C	S	.	.	H	α-helix	trans	-66.7	-36.3	179.2	-161.1	63.7	69.5	0	0	112.1	S16 I17 L22 T23 R24 I37 Q40 L41 L44	S16-M20 WeakPolarHBondContact O-CB 3.42Å; S16-M20 PolarHBondContact O-N 3.06Å; I17-M20 PolarHBondContact O-N 3.46Å; M20-L22 VanDerWaalsContact C-N 3.35Å; M20-T23 PolarHBondContact O-N 3.2Å; M20-R24 WeakPolarHBondContact O-CB 3.31Å; M20-R24 PolarHBondContact O-N 3.22Å; M20-I37 HydrophobicContact CG-CG2 3.89Å; M20-I37 HydrophobicContact SD-CB 4.49Å; M20-I37 HydrophobicContact SD-CG1 4.4Å; M20-I37 HydrophobicContact SD-CG2 3.94Å; M20-Q40 HydrophobicContact CE-CB 4.18Å; M20-Q40 HydrophobicContact SD-CB 4.41Å; M20-L41 HydrophobicContact CB-CG 4.5Å; M20-L41 HydrophobicContact CG-CB 4.08Å; M20-L41 HydrophobicContact CG-CG 4.3Å; M20-L44 HydrophobicContact CE-CD1 4.13Å
21	E	95.6	Very high	93.5	Very high	70 Å²	70	94.9 Å²	94.9	33%	0.327	47%	0.469	S	S	.	.	H	α-helix	trans	-64.1	-38.5	172.8	-78.3	173.8	165.1	0	0	111.8	I17 F19 R24 E25 L41 K45	I17-E21 HydrophobicContact CG2-CG 4.28Å; I17-E21 WeakPolarHBondContact O-CB 3.44Å; I17-E21 WeakPolarHBondContact O-CG 3.29Å; I17-E21 PolarHBondContact O-N 3.02Å; F19-E21 VanDerWaalsContact C-N 3.33Å; F19-E21 PolarHBondContact O-N 3.44Å; E21-R24 PolarHBondContact O-N 3.41Å; E21-E25 PolarHBondContact O-N 3.12Å; E21-L41 HydrophobicContact CG-CD1 3.7Å; E21-L41 HydrophobicContact CG-CD2 4.35Å; E21-L41 HydrophobicContact CG-CG 4.23Å; E21-K45 VanDerWaalsContact OE1-CE 3.31Å; E21-K45 WeakPolarHBondContact OE1-CE 3.45Å; E21-K45 IonicContact OE1-NZ 2.76Å; E21-K45 PolarHBondContact OE1-NZ 3.14Å
22	L	95.2	Very high	93.5	Very high	91 Å²	91	95 Å²	95	48%	0.476	47%	0.474	S	S	.	.	H	α-helix	trans	-66.4	-47.1	173.8	-174.4	68.7	0	0	0	111.6	A18 F19 M20 R24 E25 E26	A18-L22 PolarHBondContact O-N 3.47Å; A18-L22 VanDerWaalsContact O-N 3.1Å; F19-L22 WeakPolarHBondContact O-CB 3.46Å; F19-L22 PolarHBondContact O-N 3.36Å; M20-L22 VanDerWaalsContact C-N 3.35Å; L22-R24 PolarHBondContact O-N 3.29Å; L22-E25 WeakPolarHBondContact O-CB 3.36Å; L22-E25 PolarHBondContact O-N 2.83Å; L22-E25 VanDerWaalsContact O-N 3.07Å; L22-E26 PolarHBondContact O-N 2.88Å
23	T	93.1	Very high	93.5	Very high	58 Å²	58	91.9 Å²	91.9	36%	0.356	47%	0.468	S	S	.	.	H	α-helix	trans	-60.4	-34.7	176.7	-53.5	0	0	0	0	111.6	F19 M20 E25 E26 I37	F19-T23 PolarHBondContact O-N 2.91Å; F19-T23 PolarHBondContact O-OG1 3Å; F19-T23 VanDerWaalsContact O-OG1 3.05Å; M20-T23 PolarHBondContact O-N 3.2Å; T23-E25 VanDerWaalsContact C-N 3.31Å; T23-E25 PolarHBondContact O-N 2.73Å; T23-E26 PolarHBondContact O-N 3.24Å; T23-I37 HydrophobicContact CG2-CD1 3.81Å; T23-I37 HydrophobicContact CG2-CG1 4.46Å
24	R	92.8	Very high	93.4	Very high	79 Å²	79	90.7 Å²	90.7	30%	0.298	46%	0.463	S	S	.	.	H	α-helix	trans	-64.2	-34.4	175.3	-166	177.8	59.8	176.4	4.3	113.1	M20 E21 L22 E26 V27 Y34 I37 D38	M20-R24 WeakPolarHBondContact O-CB 3.31Å; M20-R24 PolarHBondContact O-N 3.22Å; E21-R24 PolarHBondContact O-N 3.41Å; L22-R24 PolarHBondContact O-N 3.29Å; R24-E26 VanDerWaalsContact C-N 3.25Å; R24-E26 PolarHBondContact O-N 2.76Å; R24-V27 PolarHBondContact O-N 3.01Å; R24-Y34 HydrophobicContact CG-CD2 4.15Å; R24-Y34 HydrophobicContact CG-CE2 3.74Å; R24-I37 HydrophobicContact CB-CG2 3.6Å; R24-I37 HydrophobicContact CG-CG2 3.99Å; R24-D38 WeakPolarHBondContact CD-OD1 3.44Å; R24-D38 IonicContact CZ-OD1 3.75Å; R24-D38 IonicContact NE-OD1 3.21Å; R24-D38 IonicContact NH1-OD1 2.87Å; R24-D38 PolarHBondContact NH1-OD1 3Å
25	E	92.8	Very high	93.4	Very high	166 Å²	166	89 Å²	89	78%	0.776	46%	0.463	S	S	*	.	H	α-helix	trans	-71.3	-22.7	178.8	-168.8	171.7	-169.7	0	0	112.2	E21 L22 T23	E21-E25 PolarHBondContact O-N 3.12Å; L22-E25 WeakPolarHBondContact O-CB 3.36Å; L22-E25 PolarHBondContact O-N 2.83Å; L22-E25 VanDerWaalsContact O-N 3.07Å; T23-E25 VanDerWaalsContact C-N 3.31Å; T23-E25 PolarHBondContact O-N 2.73Å
26	E	92.1	Very high	93.3	Very high	148 Å²	148	87.5 Å²	87.5	69%	0.692	46%	0.459	S	S	*	.	H	α-helix	trans	-83.7	-13.9	177.7	-64.4	177.6	166.7	0	0	113.7	L22 T23 R24	L22-E26 PolarHBondContact O-N 2.88Å; T23-E26 PolarHBondContact O-N 3.24Å; R24-E26 VanDerWaalsContact C-N 3.25Å; R24-E26 PolarHBondContact O-N 2.76Å
27	V	92.5	Very high	93.3	Very high	32 Å²	32	85.6 Å²	85.6	19%	0.194	45%	0.445	C	S	.	.	S	Bend	trans	-106.3	137.2	-176.7	-179.8	0	0	0	0	110.7	R24 D31 D33 I37	R24-V27 PolarHBondContact O-N 3.01Å; V27-D31 HydrophobicContact CG1-CB 4.02Å; V27-D33 HydrophobicContact CG1-CB 4.02Å; V27-I37 HydrophobicContact CB-CD1 4.26Å; V27-I37 HydrophobicContact CG2-CD1 3.67Å
28	E	89.7	Confident	93.2	Very high	166 Å²	166	87.2 Å²	87.2	78%	0.776	45%	0.453	S	S	*	.			trans	-68	136.5	179.7	-66	-172	172.5	0	0	112.3	G30 D31	E28-G30 PolarHBondContact O-N 2.87Å; E28-D31 PolarHBondContact O-N 2.76Å; E28-D31 VanDerWaalsContact O-N 3.14Å
29	E	85.7	Confident	93.1	Very high	169 Å²	169	90.6 Å²	90.6	79%	0.79	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	105.7	175.8	-171	174.5	-166	0	0	109.7	Y34	E29-Y34 HydrophobicContact CB-CD2 4.49Å; E29-Y34 HydrophobicContact CB-CE2 4.24Å; E29-Y34 HydrophobicContact CG-CE1 4.27Å; E29-Y34 HydrophobicContact CG-CE2 4.39Å
30	G	85.4	Confident	93.1	Very high	73 Å²	73	89.1 Å²	89.1	75%	0.753	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	129.3	-17	-177.4	0	0	0	0	0	114.2	E28	E28-G30 PolarHBondContact O-N 2.87Å
31	D	91.1	Very high	93.2	Very high	86 Å²	86	87.5 Å²	87.5	46%	0.46	45%	0.45	S	S	.	.	S	Bend	trans	-71.6	154.8	173.9	-155.5	-3.5	0	0	0	111.4	V27 E28 D33 Y34	V27-D31 HydrophobicContact CG1-CB 4.02Å; E28-D31 PolarHBondContact O-N 2.76Å; E28-D31 VanDerWaalsContact O-N 3.14Å; D31-D33 PolarHBondContact O-N 3.03Å; D31-Y34 WeakPolarHBondContact O-CB 3.06Å; D31-Y34 PolarHBondContact O-N 3.23Å; D31-Y34 VanDerWaalsContact O-N 3.14Å
32	H	92.7	Very high	93.2	Very high	133 Å²	133	87.8 Å²	87.8	62%	0.616	46%	0.459	S	S	*	.	H	α-helix	trans	-60.8	-36.3	178.7	-171.6	58.9	0	0	0	111.6	Y34 V35 I36	H32-Y34 VanDerWaalsContact C-N 3.3Å; H32-Y34 PolarHBondContact O-N 3.5Å; H32-V35 PolarHBondContact O-N 3.06Å; H32-I36 WeakPolarHBondContact O-CG1 3.46Å; H32-I36 PolarHBondContact O-N 3.44Å; H32-I36 VanDerWaalsContact O-N 3.17Å
33	D	94.2	Very high	93.2	Very high	85 Å²	85	86.8 Å²	86.8	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-34.6	177.8	-73	-9.6	0	0	0	112	V27 D31 V35 I36 I37	V27-D33 HydrophobicContact CG1-CB 4.02Å; D31-D33 PolarHBondContact O-N 3.03Å; D33-V35 VanDerWaalsContact C-N 3.33Å; D33-V35 PolarHBondContact O-N 3.05Å; D33-I36 PolarHBondContact O-N 2.66Å; D33-I37 WeakPolarHBondContact O-CB 3.04Å; D33-I37 WeakPolarHBondContact O-CD1 3.31Å; D33-I37 WeakPolarHBondContact O-CG1 3.31Å; D33-I37 PolarHBondContact O-N 3.48Å
34	Y	95.3	Very high	93.4	Very high	47 Å²	47	85.5 Å²	85.5	18%	0.184	45%	0.451	C	S	.	.	H	α-helix	trans	-59.2	-45.7	175.7	-172.5	-84.9	0	0	0	111	R24 E29 D31 H32 I36 I37 D38	R24-Y34 HydrophobicContact CG-CD2 4.15Å; R24-Y34 HydrophobicContact CG-CE2 3.74Å; E29-Y34 HydrophobicContact CB-CD2 4.49Å; E29-Y34 HydrophobicContact CB-CE2 4.24Å; E29-Y34 HydrophobicContact CG-CE1 4.27Å; E29-Y34 HydrophobicContact CG-CE2 4.39Å; D31-Y34 WeakPolarHBondContact O-CB 3.06Å; D31-Y34 PolarHBondContact O-N 3.23Å; D31-Y34 VanDerWaalsContact O-N 3.14Å; H32-Y34 VanDerWaalsContact C-N 3.3Å; H32-Y34 PolarHBondContact O-N 3.5Å; Y34-I36 PolarHBondContact O-N 3.01Å; Y34-I37 PolarHBondContact O-N 3.34Å; Y34-D38 WeakPolarHBondContact CE1-OD2 3.49Å; Y34-D38 WeakPolarHBondContact O-CB 3.42Å; Y34-D38 PolarHBondContact O-N 3.07Å
35	V	94.6	Very high	93.5	Very high	91 Å²	91	86.2 Å²	86.2	55%	0.552	46%	0.456	S	S	*	.	H	α-helix	trans	-64.9	-39.8	178.7	-178.5	0	0	0	0	111.4	H32 D33 L39	H32-V35 PolarHBondContact O-N 3.06Å; D33-V35 VanDerWaalsContact C-N 3.33Å; D33-V35 PolarHBondContact O-N 3.05Å; V35-L39 WeakPolarHBondContact O-CB 3.36Å; V35-L39 PolarHBondContact O-N 3.37Å
36	I	95.4	Very high	93.6	Very high	63 Å²	63	83.1 Å²	83.1	32%	0.323	45%	0.445	S	S	.	.	H	α-helix	trans	-63.9	-48.6	177	-67.1	165.2	0	0	0	110.3	H32 D33 Y34 D38 L39 Q40	H32-I36 WeakPolarHBondContact O-CG1 3.46Å; H32-I36 PolarHBondContact O-N 3.44Å; H32-I36 VanDerWaalsContact O-N 3.17Å; D33-I36 PolarHBondContact O-N 2.66Å; Y34-I36 PolarHBondContact O-N 3.01Å; I36-D38 PolarHBondContact O-N 3.45Å; I36-L39 PolarHBondContact O-N 3.46Å; I36-Q40 HydrophobicContact CG2-CG 4.49Å; I36-Q40 WeakPolarHBondContact O-CG 3.24Å; I36-Q40 PolarHBondContact O-N 2.95Å
37	I	95.9	Very high	93.7	Very high	13 Å²	13	77.6 Å²	77.6	7%	0.067	42%	0.422	C	S	.	.	H	α-helix	trans	-60	-47.6	179.5	-69.5	162.6	0	0	0	109.9	M20 T23 R24 V27 D33 Y34 L39 Q40 L41	M20-I37 HydrophobicContact CG-CG2 3.89Å; M20-I37 HydrophobicContact SD-CB 4.49Å; M20-I37 HydrophobicContact SD-CG1 4.4Å; M20-I37 HydrophobicContact SD-CG2 3.94Å; T23-I37 HydrophobicContact CG2-CD1 3.81Å; T23-I37 HydrophobicContact CG2-CG1 4.46Å; R24-I37 HydrophobicContact CB-CG2 3.6Å; R24-I37 HydrophobicContact CG-CG2 3.99Å; V27-I37 HydrophobicContact CB-CD1 4.26Å; V27-I37 HydrophobicContact CG2-CD1 3.67Å; D33-I37 WeakPolarHBondContact O-CB 3.04Å; D33-I37 WeakPolarHBondContact O-CD1 3.31Å; D33-I37 WeakPolarHBondContact O-CG1 3.31Å; D33-I37 PolarHBondContact O-N 3.48Å; Y34-I37 PolarHBondContact O-N 3.34Å; I37-L39 VanDerWaalsContact C-N 3.34Å; I37-L39 PolarHBondContact O-N 2.95Å; I37-Q40 PolarHBondContact O-N 3.33Å; I37-L41 VanDerWaalsContact O-CB 3.22Å; I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 PolarHBondContact O-N 3.44Å
38	D	94.5	Very high	93.7	Very high	47 Å²	47	77.5 Å²	77.5	25%	0.251	42%	0.42	S	S	.	.	H	α-helix	trans	-62.6	-37.5	179.2	-99.6	-8.4	0	0	0	113.1	R24 Y34 I36 S42	R24-D38 WeakPolarHBondContact CD-OD1 3.44Å; R24-D38 IonicContact CZ-OD1 3.75Å; R24-D38 IonicContact NE-OD1 3.21Å; R24-D38 IonicContact NH1-OD1 2.87Å; R24-D38 PolarHBondContact NH1-OD1 3Å; Y34-D38 WeakPolarHBondContact CE1-OD2 3.49Å; Y34-D38 WeakPolarHBondContact O-CB 3.42Å; Y34-D38 PolarHBondContact O-N 3.07Å; I36-D38 PolarHBondContact O-N 3.45Å; D38-S42 WeakPolarHBondContact O-CB 3.48Å; D38-S42 PolarHBondContact O-N 2.93Å; D38-S42 PolarHBondContact O-OG 3.42Å
39	L	95.7	Very high	93.8	Very high	127 Å²	127	72.3 Å²	72.3	67%	0.665	40%	0.402	S	S	*	.	H	α-helix	trans	-65	-46.1	174.3	179.2	63	0	0	0	111.5	V35 I36 I37 S42 S43	V35-L39 WeakPolarHBondContact O-CB 3.36Å; V35-L39 PolarHBondContact O-N 3.37Å; I36-L39 PolarHBondContact O-N 3.46Å; I37-L39 VanDerWaalsContact C-N 3.34Å; I37-L39 PolarHBondContact O-N 2.95Å; L39-S42 WeakPolarHBondContact O-CB 3.48Å; L39-S42 PolarHBondContact O-N 3.45Å; L39-S43 PolarHBondContact O-N 3.23Å
40	Q	96.4	Very high	94.1	Very high	90 Å²	90	68.7 Å²	68.7	42%	0.421	39%	0.386	S	S	.	.	H	α-helix	trans	-62.8	-45.1	177.6	-72.4	179.7	-8.3	0	0	111.2	M20 I36 I37 S42 S43 L44	M20-Q40 HydrophobicContact CE-CB 4.18Å; M20-Q40 HydrophobicContact SD-CB 4.41Å; I36-Q40 HydrophobicContact CG2-CG 4.49Å; I36-Q40 WeakPolarHBondContact O-CG 3.24Å; I36-Q40 PolarHBondContact O-N 2.95Å; I37-Q40 PolarHBondContact O-N 3.33Å; Q40-S42 VanDerWaalsContact C-N 3.3Å; Q40-S42 PolarHBondContact O-N 2.92Å; Q40-S43 WeakPolarHBondContact O-CB 3.48Å; Q40-S43 PolarHBondContact O-N 3.1Å; Q40-S43 VanDerWaalsContact O-N 3.15Å; Q40-L44 WeakPolarHBondContact O-CB 3.42Å; Q40-L44 WeakPolarHBondContact O-CD1 3.44Å; Q40-L44 PolarHBondContact O-N 3.44Å
41	L	95.8	Very high	94.2	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-59.2	-42.5	177.4	-155.9	171.5	0	0	0	110.8	M20 E21 I37 L44 K45	M20-L41 HydrophobicContact CB-CG 4.5Å; M20-L41 HydrophobicContact CG-CB 4.08Å; M20-L41 HydrophobicContact CG-CG 4.3Å; E21-L41 HydrophobicContact CG-CD1 3.7Å; E21-L41 HydrophobicContact CG-CD2 4.35Å; E21-L41 HydrophobicContact CG-CG 4.23Å; I37-L41 VanDerWaalsContact O-CB 3.22Å; I37-L41 WeakPolarHBondContact O-CB 3.47Å; I37-L41 PolarHBondContact O-N 3.44Å; L41-L44 PolarHBondContact O-N 3.06Å; L41-K45 HydrophobicContact CD2-CD 3.46Å; L41-K45 VanDerWaalsContact CD2-CD 3.46Å; L41-K45 HydrophobicContact CD2-CG 4.01Å; L41-K45 WeakPolarHBondContact O-CB 3.33Å; L41-K45 WeakPolarHBondContact O-CG 3.44Å; L41-K45 PolarHBondContact O-N 2.97Å
42	S	96	Very high	94.1	Very high	75 Å²	75	65 Å²	65	52%	0.524	35%	0.351	S	S	.	.	H	α-helix	trans	-62.1	-43.9	174.4	-62.2	0	0	0	0	112.5	D38 L39 Q40 K45 L46	D38-S42 WeakPolarHBondContact O-CB 3.48Å; D38-S42 PolarHBondContact O-N 2.93Å; D38-S42 PolarHBondContact O-OG 3.42Å; L39-S42 WeakPolarHBondContact O-CB 3.48Å; L39-S42 PolarHBondContact O-N 3.45Å; Q40-S42 VanDerWaalsContact C-N 3.3Å; Q40-S42 PolarHBondContact O-N 2.92Å; S42-K45 PolarHBondContact O-N 3.3Å; S42-L46 WeakPolarHBondContact O-CB 3.17Å; S42-L46 PolarHBondContact O-N 3.41Å
43	S	95.9	Very high	93.8	Very high	70 Å²	70	62 Å²	62	49%	0.49	35%	0.345	S	S	.	.	H	α-helix	trans	-63.2	-46.8	176.4	-175.3	0	0	0	0	112	L39 Q40 K45 L46 S47	L39-S43 PolarHBondContact O-N 3.23Å; Q40-S43 WeakPolarHBondContact O-CB 3.48Å; Q40-S43 PolarHBondContact O-N 3.1Å; Q40-S43 VanDerWaalsContact O-N 3.15Å; S43-K45 PolarHBondContact O-N 3.05Å; S43-L46 WeakPolarHBondContact O-CB 3.45Å; S43-L46 PolarHBondContact O-N 2.9Å; S43-S47 PolarHBondContact O-N 2.85Å; S43-S47 PolarHBondContact O-OG 3.49Å
44	L	96.3	Very high	93.2	Very high	31 Å²	31	63.2 Å²	63.2	16%	0.162	35%	0.346	C	S	.	.	H	α-helix	trans	-59.5	-45	176.5	-85.6	146.8	0	0	0	112.3	Y13 I17 M20 Q40 L41 S47 L48	Y13-L44 HydrophobicContact CD1-CD2 4.09Å; I17-L44 HydrophobicContact CD1-CB 4.42Å; I17-L44 HydrophobicContact CG1-CB 3.78Å; M20-L44 HydrophobicContact CE-CD1 4.13Å; Q40-L44 WeakPolarHBondContact O-CB 3.42Å; Q40-L44 WeakPolarHBondContact O-CD1 3.44Å; Q40-L44 PolarHBondContact O-N 3.44Å; L41-L44 PolarHBondContact O-N 3.06Å; L44-S47 PolarHBondContact O-N 2.85Å; L44-L48 WeakPolarHBondContact O-CB 2.93Å; L44-L48 PolarHBondContact O-N 3.18Å
45	K	96.3	Very high	92.5	Very high	95 Å²	95	64.4 Å²	64.4	41%	0.413	35%	0.352	S	S	.	.	H	α-helix	trans	-63.3	-39.9	176.4	-78.7	179.5	173.5	167.6	0	111.8	I17 E21 L41 S42 S43 L48 S49	I17-K45 HydrophobicContact CD1-CG 3.95Å; I17-K45 HydrophobicContact CG1-CG 4.39Å; I17-K45 HydrophobicContact CG2-CG 4.49Å; E21-K45 VanDerWaalsContact OE1-CE 3.31Å; E21-K45 WeakPolarHBondContact OE1-CE 3.45Å; E21-K45 IonicContact OE1-NZ 2.76Å; E21-K45 PolarHBondContact OE1-NZ 3.14Å; L41-K45 HydrophobicContact CD2-CD 3.46Å; L41-K45 VanDerWaalsContact CD2-CD 3.46Å; L41-K45 HydrophobicContact CD2-CG 4.01Å; L41-K45 WeakPolarHBondContact O-CB 3.33Å; L41-K45 WeakPolarHBondContact O-CG 3.44Å; L41-K45 PolarHBondContact O-N 2.97Å; S42-K45 PolarHBondContact O-N 3.3Å; S43-K45 PolarHBondContact O-N 3.05Å; K45-L48 PolarHBondContact O-N 3.41Å; K45-S49 PolarHBondContact O-N 3.37Å
46	L	94.8	Very high	91.6	Very high	101 Å²	101	64.2 Å²	64.2	53%	0.529	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-51.1	175	-179.5	63.6	0	0	0	111.3	S42 S43 L48 S49 E50	S42-L46 WeakPolarHBondContact O-CB 3.17Å; S42-L46 PolarHBondContact O-N 3.41Å; S43-L46 WeakPolarHBondContact O-CB 3.45Å; S43-L46 PolarHBondContact O-N 2.9Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.34Å; L46-S49 WeakPolarHBondContact O-CA 3.45Å; L46-S49 WeakPolarHBondContact O-CB 3.37Å; L46-S49 PolarHBondContact O-N 3.33Å; L46-S49 PolarHBondContact O-OG 3.34Å; L46-E50 PolarHBondContact O-N 3.4Å
47	S	93	Very high	90.5	Very high	32 Å²	32	67.8 Å²	67.8	22%	0.224	37%	0.367	C	S	.	.	H	α-helix	trans	-60.4	-38.2	178.2	-60.6	0	0	0	0	112.6	S43 L44 S49 E50 V51	S43-S47 PolarHBondContact O-N 2.85Å; S43-S47 PolarHBondContact O-OG 3.49Å; L44-S47 PolarHBondContact O-N 2.85Å; S47-S49 VanDerWaalsContact C-N 3.33Å; S47-S49 PolarHBondContact O-N 2.9Å; S47-E50 PolarHBondContact O-N 2.99Å; S47-V51 WeakPolarHBondContact O-CG2 3.15Å; S47-V51 PolarHBondContact O-N 3.15Å
48	L	93.2	Very high	88.9	Confident	30 Å²	30	71.6 Å²	71.6	16%	0.157	39%	0.386	C	S	.	.	H	α-helix	trans	-60.3	-44	172.6	176.5	59.4	0	0	0	111.2	I10 Y13 K14 I17 L44 K45 L46 E50 V51 V52	I10-L48 HydrophobicContact CB-CD1 4.4Å; I10-L48 HydrophobicContact CG1-CD1 4.35Å; I10-L48 HydrophobicContact CG2-CD1 4.06Å; Y13-L48 HydrophobicContact CG-CB 4.34Å; K14-L48 HydrophobicContact CG-CD2 4.09Å; I17-L48 HydrophobicContact CD1-CB 4.23Å; I17-L48 HydrophobicContact CD1-CD2 3.65Å; L44-L48 WeakPolarHBondContact O-CB 2.93Å; L44-L48 PolarHBondContact O-N 3.18Å; K45-L48 PolarHBondContact O-N 3.41Å; L46-L48 VanDerWaalsContact C-N 3.3Å; L46-L48 PolarHBondContact O-N 3.34Å; L48-E50 VanDerWaalsContact C-N 3.33Å; L48-E50 PolarHBondContact O-N 3.15Å; L48-V51 PolarHBondContact O-N 3.13Å; L48-V52 HydrophobicContact CD1-CG2 4Å; L48-V52 HydrophobicContact CG-CG2 4.42Å; L48-V52 WeakPolarHBondContact O-CB 3.47Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.22Å; L48-V52 PolarHBondContact O-N 3.5Å
49	S	92.7	Very high	87.3	Confident	56 Å²	56	75.4 Å²	75.4	39%	0.392	41%	0.406	S	S	.	.	H	α-helix	trans	-62.8	-37.3	179	81.4	0	0	0	0	112.9	K45 L46 S47 S53	K45-S49 PolarHBondContact O-N 3.37Å; L46-S49 WeakPolarHBondContact O-CA 3.45Å; L46-S49 WeakPolarHBondContact O-CB 3.37Å; L46-S49 PolarHBondContact O-N 3.33Å; L46-S49 PolarHBondContact O-OG 3.34Å; S47-S49 VanDerWaalsContact C-N 3.33Å; S47-S49 PolarHBondContact O-N 2.9Å; S49-S53 WeakPolarHBondContact O-CB 3.48Å; S49-S53 PolarHBondContact O-N 2.81Å; S49-S53 PolarHBondContact O-OG 2.96Å
50	E	90.4	Very high	85.6	Confident	94 Å²	94	74.5 Å²	74.5	44%	0.439	41%	0.41	S	S	.	.	H	α-helix	trans	-67.7	-41.6	175.6	-68.8	178.1	-175.6	0	0	111.8	L46 S47 L48 S53 K54	L46-E50 PolarHBondContact O-N 3.4Å; S47-E50 PolarHBondContact O-N 2.99Å; L48-E50 VanDerWaalsContact C-N 3.33Å; L48-E50 PolarHBondContact O-N 3.15Å; E50-S53 WeakPolarHBondContact O-CB 3.41Å; E50-S53 PolarHBondContact O-N 2.93Å; E50-K54 WeakPolarHBondContact O-CG 3.48Å; E50-K54 PolarHBondContact O-N 3.22Å
51	V	88.5	Confident	83.4	Confident	22 Å²	22	72.3 Å²	72.3	13%	0.133	41%	0.412	C	S	.	.	H	α-helix	trans	-69.6	-37.6	179.2	174.5	0	0	0	0	111.2	I6 A9 I10 Y13 S47 L48 K54 K55	I6-V51 HydrophobicContact CG2-CG1 3.68Å; A9-V51 HydrophobicContact CB-CG1 4.23Å; I10-V51 HydrophobicContact CD1-CG1 4.35Å; I10-V51 HydrophobicContact CG1-CG1 3.68Å; Y13-V51 HydrophobicContact CD2-CG2 4.43Å; Y13-V51 HydrophobicContact CE2-CB 4.47Å; Y13-V51 HydrophobicContact CE2-CG2 3.79Å; S47-V51 WeakPolarHBondContact O-CG2 3.15Å; S47-V51 PolarHBondContact O-N 3.15Å; L48-V51 PolarHBondContact O-N 3.13Å; V51-K54 PolarHBondContact O-N 2.84Å; V51-K55 PolarHBondContact O-N 3.45Å
52	V	89.2	Confident	81	Confident	60 Å²	60	79.7 Å²	79.7	36%	0.364	45%	0.451	S	S	.	.	H	α-helix	trans	-64.6	-41.1	171.5	172.3	0	0	0	0	110.7	I10 L48 K54 K55 T56	I10-V52 HydrophobicContact CD1-CG2 4.14Å; I10-V52 HydrophobicContact CG1-CG2 4.27Å; L48-V52 HydrophobicContact CD1-CG2 4Å; L48-V52 HydrophobicContact CG-CG2 4.42Å; L48-V52 WeakPolarHBondContact O-CB 3.47Å; L48-V52 VanDerWaalsContact O-CG2 3.29Å; L48-V52 WeakPolarHBondContact O-CG2 3.22Å; L48-V52 PolarHBondContact O-N 3.5Å; V52-K54 PolarHBondContact O-N 3.45Å; V52-K55 WeakPolarHBondContact O-CB 3.47Å; V52-K55 PolarHBondContact O-N 3.47Å; V52-K55 VanDerWaalsContact O-N 3.17Å; V52-T56 PolarHBondContact O-N 3.26Å; V52-T56 PolarHBondContact O-OG1 3.24Å
53	S	85.8	Confident	78.6	Confident	68 Å²	68	83.7 Å²	83.7	48%	0.476	46%	0.461	S	S	.	.	H	α-helix	trans	-60.9	-43.1	174.3	-60.1	0	0	0	0	112.2	S49 E50 K55 T56 E57	S49-S53 WeakPolarHBondContact O-CB 3.48Å; S49-S53 PolarHBondContact O-N 2.81Å; S49-S53 PolarHBondContact O-OG 2.96Å; E50-S53 WeakPolarHBondContact O-CB 3.41Å; E50-S53 PolarHBondContact O-N 2.93Å; S53-K55 VanDerWaalsContact C-N 3.34Å; S53-K55 PolarHBondContact O-N 3.49Å; S53-T56 WeakPolarHBondContact CA-OG1 3.43Å; S53-T56 PolarHBondContact O-N 3.27Å; S53-T56 PolarHBondContact O-OG1 3.43Å; S53-E57 PolarHBondContact O-N 3.38Å
54	K	82	Confident	76.3	Confident	112 Å²	112	87 Å²	87	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-63.8	-37	173.5	-73.3	171.5	-177.4	170.1	0	112.2	E50 V51 V52 T56 E57 I58	E50-K54 WeakPolarHBondContact O-CG 3.48Å; E50-K54 PolarHBondContact O-N 3.22Å; V51-K54 PolarHBondContact O-N 2.84Å; V52-K54 PolarHBondContact O-N 3.45Å; K54-T56 VanDerWaalsContact C-N 3.32Å; K54-T56 PolarHBondContact O-N 2.96Å; K54-E57 PolarHBondContact O-N 3.14Å; K54-I58 WeakPolarHBondContact O-CB 3.41Å; K54-I58 WeakPolarHBondContact O-CD1 3.19Å; K54-I58 VanDerWaalsContact O-CG1 3.31Å; K54-I58 WeakPolarHBondContact O-CG1 3.32Å; K54-I58 PolarHBondContact O-N 3.24Å
55	K	80.6	Confident	74.2	Confident	71 Å²	71	93 Å²	93	31%	0.309	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-43.3	173	-176.2	175.6	169.4	177.3	0	110.8	I6 E7 I10 V51 V52 S53 I59	I6-K55 HydrophobicContact CG2-CB 3.91Å; I6-K55 HydrophobicContact CG2-CG 4.46Å; E7-K55 IonicContact OE1-NZ 3.7Å; E7-K55 WeakPolarHBondContact OE2-CE 3.4Å; E7-K55 IonicContact OE2-NZ 2.65Å; E7-K55 PolarHBondContact OE2-NZ 2.85Å; I10-K55 HydrophobicContact CD1-CB 4.33Å; I10-K55 HydrophobicContact CD1-CD 3.54Å; V51-K55 PolarHBondContact O-N 3.45Å; V52-K55 WeakPolarHBondContact O-CB 3.47Å; V52-K55 PolarHBondContact O-N 3.47Å; V52-K55 VanDerWaalsContact O-N 3.17Å; S53-K55 VanDerWaalsContact C-N 3.34Å; S53-K55 PolarHBondContact O-N 3.49Å; K55-I59 HydrophobicContact CG-CD1 3.87Å; K55-I59 WeakPolarHBondContact O-CD1 3.35Å; K55-I59 VanDerWaalsContact O-CG1 3.23Å; K55-I59 WeakPolarHBondContact O-CG1 3.4Å; K55-I59 PolarHBondContact O-N 3.41Å
56	T	75.9	Confident	71.4	Confident	88 Å²	88	93.1 Å²	93.1	54%	0.54	52%	0.517	S	S	.	.	H	α-helix	trans	-69.3	-35.8	178.1	49.9	0	0	0	0	112.9	V52 S53 K54 S60	V52-T56 PolarHBondContact O-N 3.26Å; V52-T56 PolarHBondContact O-OG1 3.24Å; S53-T56 WeakPolarHBondContact CA-OG1 3.43Å; S53-T56 PolarHBondContact O-N 3.27Å; S53-T56 PolarHBondContact O-OG1 3.43Å; K54-T56 VanDerWaalsContact C-N 3.32Å; K54-T56 PolarHBondContact O-N 2.96Å; T56-S60 WeakPolarHBondContact O-CB 3.36Å; T56-S60 PolarHBondContact O-N 3.3Å; T56-S60 VanDerWaalsContact O-N 3.11Å
57	E	72.3	Confident	68.9	Low	138 Å²	138	96.3 Å²	96.3	65%	0.645	53%	0.534	S	S	*	.	H	α-helix	trans	-68	-43.1	176.8	-171.8	178.4	-174.2	0	0	111.9	S53 K54 I59 S60 G61	S53-E57 PolarHBondContact O-N 3.38Å; K54-E57 PolarHBondContact O-N 3.14Å; E57-I59 VanDerWaalsContact C-N 3.34Å; E57-I59 PolarHBondContact O-N 3Å; E57-S60 CarbonylContact O-C 3.59Å; E57-S60 PolarHBondContact O-N 3.38Å; E57-S60 VanDerWaalsContact O-N 3.17Å; E57-G61 WeakPolarHBondContact O-CA 3.43Å; E57-G61 PolarHBondContact O-N 3.05Å
58	I	62.5	Low	66.4	Low	92 Å²	92	104.1 Å²	104.1	47%	0.472	56%	0.564	S	S	.	*	H	α-helix	trans	-67.5	-34.7	179.1	-68.8	163.2	0	0	0	111.6	I6 K54 S60	I6-I58 HydrophobicContact CD1-CD1 3.22Å; K54-I58 WeakPolarHBondContact O-CB 3.41Å; K54-I58 WeakPolarHBondContact O-CD1 3.19Å; K54-I58 VanDerWaalsContact O-CG1 3.31Å; K54-I58 WeakPolarHBondContact O-CG1 3.32Å; K54-I58 PolarHBondContact O-N 3.24Å; I58-S60 VanDerWaalsContact C-N 3.32Å
59	I	61.1	Low	63.9	Low	128 Å²	128	108 Å²	108	66%	0.656	59%	0.589	S	S	*	*	H	α-helix	trans	-72.9	-27.1	175.3	-65.6	167.4	0	0	0	111.5	K55 E57	K55-I59 HydrophobicContact CG-CD1 3.87Å; K55-I59 WeakPolarHBondContact O-CD1 3.35Å; K55-I59 VanDerWaalsContact O-CG1 3.23Å; K55-I59 WeakPolarHBondContact O-CG1 3.4Å; K55-I59 PolarHBondContact O-N 3.41Å; E57-I59 VanDerWaalsContact C-N 3.34Å; E57-I59 PolarHBondContact O-N 3Å
60	S	59	Low	61.7	Low	107 Å²	107	113 Å²	113	75%	0.748	61%	0.609	S	S	*	*	H	α-helix	trans	-94.7	-9.4	-178.7	-164.6	0	0	0	0	114.4	T56 E57 I58	T56-S60 WeakPolarHBondContact O-CB 3.36Å; T56-S60 PolarHBondContact O-N 3.3Å; T56-S60 VanDerWaalsContact O-N 3.11Å; E57-S60 CarbonylContact O-C 3.59Å; E57-S60 PolarHBondContact O-N 3.38Å; E57-S60 VanDerWaalsContact O-N 3.17Å; I58-S60 VanDerWaalsContact C-N 3.32Å
61	G	50	Low	59.3	Low	45 Å²	45	113.5 Å²	113.5	46%	0.464	62%	0.621	S	S	.	*			trans	-109.2	15.3	-163.8	0	0	0	0	0	116.9	E57 Q63	E57-G61 WeakPolarHBondContact O-CA 3.43Å; E57-G61 PolarHBondContact O-N 3.05Å; G61-Q63 PolarHBondContact O-N 3.14Å
62	D	45.6	Very low	57.1	Low	159 Å²	159	120 Å²	120	85%	0.85	66%	0.655	S	S	*	*	S	Bend	trans	-67.4	8.8	-178.5	-112.8	0.9	0	0	0	114.8
63	Q	46.6	Very low	54.9	Low	158 Å²	158	122.8 Å²	122.8	74%	0.738	67%	0.668	S	S	*	*	S	Bend	trans	-142.8	130.3	172	-59.1	-175.5	14.5	0	0	109.3	G61	G61-Q63 PolarHBondContact O-N 3.14Å
64	N	47.2	Very low	53.3	Low	140 Å²	140	127.5 Å²	127.5	75%	0.749	68%	0.682	S	S	*	*			trans	89.3	122.1	165.5	-47.9	-49	0	0	0	114.5
65	I	51.2	Low	51.3	Low	156 Å²	156	126.9 Å²	126.9	80%	0.8	69%	0.692	S	S	*	*			cis	-154.8	129.8	15.5	-83.8	128.9	0	0	0	109.1
66	S	38.8	Very low	49.5	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	71%	0.709	S	S	*	*			trans	23.5	109.2	141.1	-150.7	0	0	0	0	119.2
67	L	40.9	Very low	48.3	Very low	168 Å²	168	134 Å²	134	88%	0.88	72%	0.722	S	S	*	*			trans	-51.7	131.4	140.7	-68.6	153.7	0	0	0	109.4
68	K	40.4	Very low	47	Very low	195 Å²	195	134.5 Å²	134.5	85%	0.848	73%	0.729	S	S	*	*			trans	-138.4	81.5	160.5	-137.2	-176.8	-173.6	-173.4	0	109.3
69	T	41.7	Very low	46.3	Very low	112 Å²	112	139.7 Å²	139.7	69%	0.687	75%	0.748	S	S	*	*			trans	7.3	125.5	131.5	-8.8	0	0	0	0	117.3
70	I	47.1	Very low	45.4	Very low	160 Å²	160	143 Å²	143	82%	0.821	76%	0.757	S	S	*	*				173.5	131.4	104.3	-79.2	151.4	0	0	0	109.5
71	P	39.7	Very low	45	Very low	105 Å²	105	145.5 Å²	145.5	68%	0.682	76%	0.761	S	S	*	*			trans	-98.2	161.2	173.7	39	-31.1	0	0	0	112.8
72	D	41.6	Very low	44.8	Very low	160 Å²	160	147.2 Å²	147.2	86%	0.856	77%	0.771	S	S	*	*			trans	147	151.4	157.2	-91.8	-8.4	0	0	0	109.2
73	D	43.3	Very low	44.9	Very low	118 Å²	118	147 Å²	147	63%	0.631	77%	0.77	S	S	*	*			cis	-171.3	158.1	-28.3	-169.6	2.9	0	0	0	103.8
74	H	51	Low	45.3	Very low	167 Å²	167	145.4 Å²	145.4	77%	0.773	77%	0.773	S	S	*	*			trans	80.8	141.9	171.3	-45.3	-36.5	0	0	0	118
75	S	41.7	Very low	45.7	Very low	99 Å²	99	143.1 Å²	143.1	69%	0.692	77%	0.766	S	S	*	*			cis	179.5	148.4	-13.4	175.5	0	0	0	0	105.5
76	P	42.4	Very low	45.5	Very low	104 Å²	104	141.1 Å²	141.1	68%	0.675	77%	0.766	S	S	*	*			trans	-109.9	114.5	-162.8	34.9	-21.9	0	0	0	113.8
77	Y	49.5	Very low	46.1	Very low	205 Å²	205	145.8 Å²	145.8	80%	0.804	77%	0.77	S	S	*	*			trans	-153	142.6	160	-70.6	-72.2	0	0	0	113.4
78	D	46.2	Very low	46.4	Very low	147 Å²	147	145.5 Å²	145.5	79%	0.786	77%	0.768	S	S	*	*			trans	75	101.9	150.4	-65.8	-30	0	0	0	121.4
79	K	47.4	Very low	46.6	Very low	201 Å²	201	141.2 Å²	141.2	87%	0.874	76%	0.76	S	S	*	*				-179.3	130.8	89.8	-115.8	169.7	177.8	171.7	0	112.4
80	K	42.5	Very low	46.5	Very low	197 Å²	197	143.7 Å²	143.7	86%	0.857	77%	0.768	S	S	*	*			trans	-69	161.8	164.6	-63.4	-163.1	176.8	-168.4	0	111.4
81	I	50.6	Low	46.1	Very low	160 Å²	160	141 Å²	141	82%	0.821	76%	0.764	S	S	*	*			trans	139.2	89.4	156.7	-71.8	154.2	0	0	0	106.1
82	A	44.7	Very low	46.3	Very low	81 Å²	81	141.3 Å²	141.3	67%	0.669	77%	0.768	S	S	*	*				66.3	93.9	89.4	0	0	0	0	0	112.3
83	D	48.8	Very low	46.5	Very low	156 Å²	156	140.4 Å²	140.4	83%	0.834	76%	0.763	S	S	*	*			trans	-173.9	137.7	142.7	-89.6	-24.3	0	0	0	108.5	P85	D83-P85 WeakPolarHBondContact O-CD 3.3Å
84	P	55	Low	46.4	Very low	123 Å²	123	143.6 Å²	143.6	80%	0.799	78%	0.775	S	S	*	*			trans	-96.7	114.3	174.8	33.6	-24	0	0	0	109.5
85	P	56.1	Low	46.2	Very low	92 Å²	92	142.1 Å²	142.1	60%	0.597	78%	0.778	S	S	*	*			trans	-99.8	114.3	175.2	37.7	-29.7	0	0	0	110.5	D83 Y87	D83-P85 WeakPolarHBondContact O-CD 3.3Å; P85-Y87 HydrophobicContact CB-CD2 3.95Å; P85-Y87 HydrophobicContact CB-CE2 3.42Å; P85-Y87 VanDerWaalsContact CB-CE2 3.42Å; P85-Y87 HydrophobicContact CG-CD2 4.26Å; P85-Y87 HydrophobicContact CG-CE2 3.87Å; P85-Y87 PolarHBondContact O-N 3.41Å
86	S	46.6	Very low	46.4	Very low	115 Å²	115	141.8 Å²	141.8	80%	0.804	78%	0.775	S	S	*	*			trans	-47.7	125.7	155.6	174.9	0	0	0	0	110.9
87	Y	50.6	Low	46.2	Very low	197 Å²	197	144.1 Å²	144.1	77%	0.773	78%	0.782	S	S	*	*			trans	-149.4	105	163.2	-69.5	-69.8	0	0	0	111.3	P85	P85-Y87 HydrophobicContact CB-CD2 3.95Å; P85-Y87 HydrophobicContact CB-CE2 3.42Å; P85-Y87 VanDerWaalsContact CB-CE2 3.42Å; P85-Y87 HydrophobicContact CG-CD2 4.26Å; P85-Y87 HydrophobicContact CG-CE2 3.87Å; P85-Y87 PolarHBondContact O-N 3.41Å
88	L	48	Very low	45.9	Very low	161 Å²	161	144.4 Å²	144.4	84%	0.843	79%	0.787	S	S	*	*				-97.9	157.2	125.7	-65.2	178.7	0	0	0	105.7
89	P	44	Very low	45.6	Very low	105 Å²	105	147.2 Å²	147.2	68%	0.682	79%	0.793	S	S	*	*			cis	-137.5	170.8	19.1	20.3	6.7	0	0	0	115.9
90	L	39.4	Very low	45.6	Very low	165 Å²	165	146.8 Å²	146.8	86%	0.864	79%	0.794	S	S	*	*			trans	36	107.6	148	-70.8	91.9	0	0	0	119.2
91	S	39.4	Very low	45.4	Very low	103 Å²	103	147.4 Å²	147.4	72%	0.72	80%	0.799	S	S	*	*			trans	-119.2	92.2	150	-169.9	0	0	0	0	109.2	N93	S91-N93 PolarHBondContact O-N 2.87Å
92	S	44.4	Very low	45.2	Very low	112 Å²	112	143 Å²	143	78%	0.783	79%	0.794	S	S	*	*			trans	-83.9	97.2	167.8	-177.7	0	0	0	0	107.6	Q94	S92-Q94 PolarHBondContact O-N 3.38Å
93	N	44.8	Very low	45.2	Very low	140 Å²	140	143.4 Å²	143.4	75%	0.749	80%	0.797	S	S	*	*			trans	-82.4	98.1	169.9	-81.1	-15	0	0	0	109.5	S91 T95	S91-N93 PolarHBondContact O-N 2.87Å; N93-T95 PolarHBondContact O-N 3.48Å
94	Q	42.5	Very low	45.3	Very low	186 Å²	186	141 Å²	141	87%	0.869	80%	0.799	S	S	*	*			trans	-50.3	113.6	155.8	-176.9	176.3	51.1	0	0	110.2	S92	S92-Q94 PolarHBondContact O-N 3.38Å
95	T	46.5	Very low	45.5	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	79%	0.793	S	S	*	*			trans	-129.3	124.1	150.9	50.9	0	0	0	0	109.9	N93	N93-T95 PolarHBondContact O-N 3.48Å
96	S	45	Very low	46.3	Very low	92 Å²	92	145.6 Å²	145.6	64%	0.643	81%	0.806	S	S	*	*			trans	-55.2	138.9	179.8	47.1	0	0	0	0	115.5
97	N	38.6	Very low	47.3	Very low	152 Å²	152	147 Å²	147	81%	0.813	80%	0.804	S	S	*	*				51.2	99.7	129	-47.8	-28	0	0	0	118.2
98	K	42.5	Very low	48.6	Very low	212 Å²	212	143 Å²	143	92%	0.922	80%	0.802	S	S	*	*				-171.2	131.3	122.7	-106.7	167.4	-177.6	179	0	111.3
99	K	39.8	Very low	50.3	Low	206 Å²	206	141 Å²	141	90%	0.896	79%	0.787	S	S	*	*			trans	-36.9	130.8	165.8	-76.5	165.6	165	175.2	0	111.9
100	E	49	Very low	52.5	Low	192 Å²	192	139.3 Å²	139.3	90%	0.897	77%	0.774	S	S	*	*			trans	-167.4	132.3	132.5	-104.5	162.3	-150	0	0	109.8	G102	E100-G102 PolarHBondContact O-N 3.23Å
101	Q	38.5	Very low	54.9	Low	209 Å²	209	139.2 Å²	139.2	98%	0.977	77%	0.77	S	S	*	*			trans	-67.1	99.3	-179.9	-70.1	166.3	-25.7	0	0	108.4
102	G	45.8	Very low	57.5	Low	68 Å²	68	141.2 Å²	141.2	70%	0.701	77%	0.765	S	S	*	*			trans	-106.6	128.1	-177.1	0	0	0	0	0	111.5	E100	E100-G102 PolarHBondContact O-N 3.23Å
103	A	43.5	Very low	59.8	Low	90 Å²	90	140.1 Å²	140.1	74%	0.744	75%	0.748	S	S	*	*			trans	-38.5	137.9	174.1	0	0	0	0	0	113.2	V105	A103-V105 PolarHBondContact O-N 3.17Å
104	A	50.7	Low	62.1	Low	105 Å²	105	136.1 Å²	136.1	87%	0.868	73%	0.729	S	S	*	*			trans	-66.4	78.5	172.8	0	0	0	0	0	110.2	K106	A104-K106 PolarHBondContact O-N 2.97Å
105	V	60.2	Low	64.7	Low	112 Å²	112	134.8 Å²	134.8	68%	0.679	72%	0.716	S	S	*	*			trans	-65.3	115.3	165.1	176.1	0	0	0	0	105.9	A103 L107	A103-V105 PolarHBondContact O-N 3.17Å; V105-L107 PolarHBondContact O-N 3.25Å
106	K	72.4	Confident	67.1	Low	200 Å²	200	133.6 Å²	133.6	87%	0.87	70%	0.701	S	S	*	*			trans	-57.5	104.5	168.1	-68.6	-177.2	178.9	-179	0	106.5	A104	A104-K106 PolarHBondContact O-N 2.97Å
107	L	67.4	Low	69.5	Low	143 Å²	143	133.2 Å²	133.2	75%	0.749	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-57.6	135.9	170.8	-105.2	82.6	0	0	0	107.5	V105 K109	V105-L107 PolarHBondContact O-N 3.25Å; L107-K109 PolarHBondContact O-N 2.67Å
108	P	79.2	Confident	72.3	Confident	115 Å²	115	130.9 Å²	130.9	75%	0.747	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.7	138.2	169.5	25	-32.1	0	0	0	108.3	T110	P108-T110 PolarHBondContact O-N 3.31Å
109	K	83.3	Confident	74.9	Confident	119 Å²	119	125.1 Å²	125.1	52%	0.517	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-50.8	132.5	178.9	-70	-175.2	-178.4	-174.1	0	109	L107 Q113 E117	L107-K109 PolarHBondContact O-N 2.67Å; K109-Q113 HydrophobicContact CB-CB 4.38Å; K109-E117 VanDerWaalsContact CE-OE1 3.3Å; K109-E117 WeakPolarHBondContact CE-OE1 3.46Å; K109-E117 IonicContact NZ-OE1 2.67Å; K109-E117 PolarHBondContact NZ-OE1 2.74Å; K109-E117 IonicContact NZ-OE2 3.77Å; K109-E117 PolarHBondContact NZ-OE2 3.28Å
110	T	88.9	Confident	77.7	Confident	68 Å²	68	118.6 Å²	118.6	42%	0.417	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-66.1	151.1	175.2	59.9	0	0	0	0	109	P108 F112 Q113 T114	P108-T110 PolarHBondContact O-N 3.31Å; T110-F112 PolarHBondContact O-N 2.96Å; T110-Q113 PolarHBondContact O-N 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.27Å; T110-Q113 PolarHBondContact OG1-N 2.91Å; T110-T114 PolarHBondContact O-N 2.99Å; T110-T114 PolarHBondContact O-OG1 2.85Å
111	E	91.6	Very high	80	Confident	164 Å²	164	112.4 Å²	112.4	77%	0.766	61%	0.613	S	S	*	*	H	α-helix	trans	-54.3	-29.7	174.9	-64.8	-176.1	175.3	0	0	112	R115	E111-R115 VanDerWaalsContact O-CB 3.27Å; E111-R115 WeakPolarHBondContact O-CB 3.47Å; E111-R115 PolarHBondContact O-N 3.18Å
112	F	92.2	Very high	82.9	Confident	144 Å²	144	106 Å²	106	63%	0.632	59%	0.585	S	S	*	*	H	α-helix	trans	-63.7	-51	172.6	-178	-91.4	0	0	0	112.3	T110 T114 R115 E116	T110-F112 PolarHBondContact O-N 2.96Å; F112-T114 PolarHBondContact O-N 3.47Å; F112-R115 WeakPolarHBondContact O-CB 3.36Å; F112-R115 PolarHBondContact O-N 3.38Å; F112-E116 PolarHBondContact O-N 3.01Å
113	Q	93.7	Very high	85.4	Confident	89 Å²	89	107 Å²	107	42%	0.416	57%	0.571	S	S	.	*	H	α-helix	trans	-60.3	-45.5	177.5	-76	171.7	-12.3	0	0	111.5	K109 T110 R115 E116 E117	K109-Q113 HydrophobicContact CB-CB 4.38Å; T110-Q113 PolarHBondContact O-N 3.23Å; T110-Q113 WeakPolarHBondContact OG1-CG 3.27Å; T110-Q113 PolarHBondContact OG1-N 2.91Å; Q113-R115 VanDerWaalsContact C-N 3.28Å; Q113-R115 PolarHBondContact O-N 3.35Å; Q113-E116 PolarHBondContact O-N 2.94Å; Q113-E117 WeakPolarHBondContact O-CG 3.45Å; Q113-E117 PolarHBondContact O-N 3.05Å
114	T	93.7	Very high	88	Confident	57 Å²	57	107.9 Å²	107.9	35%	0.35	56%	0.56	S	S	.	*	H	α-helix	trans	-59.6	-40.6	176.5	-56.7	0	0	0	0	111.4	T110 F112 L118	T110-T114 PolarHBondContact O-N 2.99Å; T110-T114 PolarHBondContact O-OG1 2.85Å; F112-T114 PolarHBondContact O-N 3.47Å; T114-L118 HydrophobicContact CG2-CD1 4.23Å; T114-L118 WeakPolarHBondContact O-CB 3.26Å; T114-L118 VanDerWaalsContact O-CG 3.25Å; T114-L118 WeakPolarHBondContact O-CG 3.47Å; T114-L118 PolarHBondContact O-N 2.86Å
115	R	96.2	Very high	90.2	Very high	158 Å²	158	108 Å²	108	60%	0.596	55%	0.545	S	S	*	.	H	α-helix	trans	-66	-43.5	177	-173.9	-175.7	-55.1	-80.7	-3.5	112	E111 F112 Q113 L118 V119	E111-R115 VanDerWaalsContact O-CB 3.27Å; E111-R115 WeakPolarHBondContact O-CB 3.47Å; E111-R115 PolarHBondContact O-N 3.18Å; F112-R115 WeakPolarHBondContact O-CB 3.36Å; F112-R115 PolarHBondContact O-N 3.38Å; Q113-R115 VanDerWaalsContact C-N 3.28Å; Q113-R115 PolarHBondContact O-N 3.35Å; R115-L118 PolarHBondContact O-N 3.19Å; R115-V119 VanDerWaalsContact O-CG2 3.26Å; R115-V119 WeakPolarHBondContact O-CG2 3.5Å; R115-V119 PolarHBondContact O-N 2.93Å
116	E	96.6	Very high	92.1	Very high	110 Å²	110	109.4 Å²	109.4	51%	0.514	54%	0.538	S	S	.	.	H	α-helix	trans	-62.8	-43.8	178.2	-177	175.6	-156.7	0	0	111.9	F112 Q113 V119 T120	F112-E116 PolarHBondContact O-N 3.01Å; Q113-E116 PolarHBondContact O-N 2.94Å; E116-V119 PolarHBondContact O-N 3.5Å; E116-T120 WeakPolarHBondContact O-CB 3.49Å; E116-T120 PolarHBondContact O-N 3.33Å; E116-T120 PolarHBondContact O-OG1 3.32Å
117	E	95.6	Very high	93.3	Very high	84 Å²	84	106 Å²	106	39%	0.393	52%	0.524	S	S	.	.	H	α-helix	trans	-60.8	-46.6	174	-71.8	175.3	-172.8	0	0	111.3	K109 Q113 V119 T120 C121	K109-E117 VanDerWaalsContact CE-OE1 3.3Å; K109-E117 WeakPolarHBondContact CE-OE1 3.46Å; K109-E117 IonicContact NZ-OE1 2.67Å; K109-E117 PolarHBondContact NZ-OE1 2.74Å; K109-E117 IonicContact NZ-OE2 3.77Å; K109-E117 PolarHBondContact NZ-OE2 3.28Å; Q113-E117 WeakPolarHBondContact O-CG 3.45Å; Q113-E117 PolarHBondContact O-N 3.05Å; E117-V119 VanDerWaalsContact C-N 3.35Å; E117-V119 PolarHBondContact O-N 3.44Å; E117-T120 WeakPolarHBondContact O-CB 3.46Å; E117-T120 PolarHBondContact O-N 2.91Å; E117-C121 PolarHBondContact O-N 3.49Å; E117-C121 PolarHBondContact O-SG 3.44Å; E117-C121 VanDerWaalsContact O-SG 3.32Å
118	L	97.8	Very high	94.8	Very high	104 Å²	104	103.5 Å²	103.5	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-61.7	-41.2	176.8	-73.9	172.5	0	0	0	112.3	T114 R115 T120 C121 I122	T114-L118 HydrophobicContact CG2-CD1 4.23Å; T114-L118 WeakPolarHBondContact O-CB 3.26Å; T114-L118 VanDerWaalsContact O-CG 3.25Å; T114-L118 WeakPolarHBondContact O-CG 3.47Å; T114-L118 PolarHBondContact O-N 2.86Å; R115-L118 PolarHBondContact O-N 3.19Å; L118-T120 VanDerWaalsContact C-N 3.32Å; L118-T120 PolarHBondContact O-N 3.36Å; L118-C121 PolarHBondContact O-N 2.97Å; L118-I122 WeakPolarHBondContact O-CB 3.47Å; L118-I122 WeakPolarHBondContact O-CD1 3.45Å; L118-I122 WeakPolarHBondContact O-CG1 3.25Å; L118-I122 PolarHBondContact O-N 3.2Å
119	V	97.6	Very high	95.7	Very high	91 Å²	91	102.5 Å²	102.5	55%	0.552	50%	0.502	S	S	*	.	H	α-helix	trans	-62.1	-42.4	175.4	168.8	0	0	0	0	110.7	R115 E116 E117 I122 E123	R115-V119 VanDerWaalsContact O-CG2 3.26Å; R115-V119 WeakPolarHBondContact O-CG2 3.5Å; R115-V119 PolarHBondContact O-N 2.93Å; E116-V119 PolarHBondContact O-N 3.5Å; E117-V119 VanDerWaalsContact C-N 3.35Å; E117-V119 PolarHBondContact O-N 3.44Å; V119-I122 PolarHBondContact O-N 3.41Å; V119-E123 PolarHBondContact O-N 2.93Å
120	T	97.9	Very high	96.4	Very high	68 Å²	68	101.7 Å²	101.7	42%	0.417	50%	0.503	S	S	.	.	H	α-helix	trans	-63.1	-48.4	177.2	-55.2	0	0	0	0	111.3	E116 E117 L118 I122 E123 E124	E116-T120 WeakPolarHBondContact O-CB 3.49Å; E116-T120 PolarHBondContact O-N 3.33Å; E116-T120 PolarHBondContact O-OG1 3.32Å; E117-T120 WeakPolarHBondContact O-CB 3.46Å; E117-T120 PolarHBondContact O-N 2.91Å; L118-T120 VanDerWaalsContact C-N 3.32Å; L118-T120 PolarHBondContact O-N 3.36Å; T120-I122 VanDerWaalsContact C-N 3.32Å; T120-I122 PolarHBondContact O-N 3.02Å; T120-E123 PolarHBondContact O-N 3.41Å; T120-E123 VanDerWaalsContact O-N 3.13Å; T120-E124 WeakPolarHBondContact O-CG 3.18Å; T120-E124 PolarHBondContact O-N 3.45Å
121	C	97.6	Very high	96.8	Very high	62 Å²	62	102.8 Å²	102.8	42%	0.419	51%	0.505	S	S	.	.	H	α-helix	trans	-59	-41.5	176	-70.4	0	0	0	0	112.3	E117 L118 E123 E124 L125	E117-C121 PolarHBondContact O-N 3.49Å; E117-C121 PolarHBondContact O-SG 3.44Å; E117-C121 VanDerWaalsContact O-SG 3.32Å; L118-C121 PolarHBondContact O-N 2.97Å; C121-E123 VanDerWaalsContact C-N 3.3Å; C121-E123 PolarHBondContact O-N 3.38Å; C121-E124 PolarHBondContact O-N 3.13Å; C121-L125 WeakPolarHBondContact O-CB 3.42Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.3Å; C121-L125 PolarHBondContact O-N 2.93Å
122	I	98.2	Very high	97.2	Very high	76 Å²	76	99.9 Å²	99.9	39%	0.39	49%	0.494	S	S	.	.	H	α-helix	trans	-62.3	-41.4	177.2	-72.4	165	0	0	0	110.5	L118 V119 T120 L125 R126	L118-I122 WeakPolarHBondContact O-CB 3.47Å; L118-I122 WeakPolarHBondContact O-CD1 3.45Å; L118-I122 WeakPolarHBondContact O-CG1 3.25Å; L118-I122 PolarHBondContact O-N 3.2Å; V119-I122 PolarHBondContact O-N 3.41Å; T120-I122 VanDerWaalsContact C-N 3.32Å; T120-I122 PolarHBondContact O-N 3.02Å; I122-L125 PolarHBondContact O-N 3.4Å; I122-R126 VanDerWaalsContact CG2-CZ 3.4Å; I122-R126 WeakPolarHBondContact O-CG 3.4Å; I122-R126 PolarHBondContact O-N 3.36Å
123	E	98	Very high	97.5	Very high	87 Å²	87	95.7 Å²	95.7	41%	0.407	49%	0.486	S	S	.	.	H	α-helix	trans	-67.8	-39	179.1	-170.3	57	-156.6	0	0	112.4	V119 T120 C121 R126 K127	V119-E123 PolarHBondContact O-N 2.93Å; T120-E123 PolarHBondContact O-N 3.41Å; T120-E123 VanDerWaalsContact O-N 3.13Å; C121-E123 VanDerWaalsContact C-N 3.3Å; C121-E123 PolarHBondContact O-N 3.38Å; E123-R126 PolarHBondContact O-N 3.29Å; E123-R126 IonicContact OE2-NH1 2.74Å; E123-R126 PolarHBondContact OE2-NH1 2.98Å; E123-K127 WeakPolarHBondContact O-CG 3.43Å; E123-K127 PolarHBondContact O-N 3.11Å; E123-K127 VanDerWaalsContact O-N 3.11Å
124	E	98.3	Very high	97.7	Very high	110 Å²	110	95.2 Å²	95.2	51%	0.514	49%	0.492	S	S	.	.	H	α-helix	trans	-63.2	-44.6	172.6	-70.8	178.3	172.2	0	0	112	T120 C121 R126 K127 L128	T120-E124 WeakPolarHBondContact O-CG 3.18Å; T120-E124 PolarHBondContact O-N 3.45Å; C121-E124 PolarHBondContact O-N 3.13Å; E124-R126 VanDerWaalsContact C-N 3.32Å; E124-R126 PolarHBondContact O-N 3.06Å; E124-K127 WeakPolarHBondContact O-CB 3.44Å; E124-K127 PolarHBondContact O-N 3.38Å; E124-L128 WeakPolarHBondContact O-CG 3.43Å; E124-L128 PolarHBondContact O-N 3.38Å
125	L	98.6	Very high	97.9	Very high	108 Å²	108	96.9 Å²	96.9	57%	0.565	50%	0.496	S	S	*	.	H	α-helix	trans	-60.8	-40.3	176	-73.5	172.7	0	0	0	111.9	C121 I122 L128 V129	C121-L125 WeakPolarHBondContact O-CB 3.42Å; C121-L125 VanDerWaalsContact O-CG 3.3Å; C121-L125 WeakPolarHBondContact O-CG 3.3Å; C121-L125 PolarHBondContact O-N 2.93Å; I122-L125 PolarHBondContact O-N 3.4Å; L125-L128 PolarHBondContact O-N 3.39Å; L125-V129 VanDerWaalsContact O-CG2 3.3Å; L125-V129 WeakPolarHBondContact O-CG2 3.39Å; L125-V129 PolarHBondContact O-N 2.96Å
126	R	98.4	Very high	98	Very high	141 Å²	141	93.3 Å²	93.3	53%	0.532	49%	0.488	S	S	.	.	H	α-helix	trans	-59.5	-47.4	174	-74.9	179.4	-175.8	129.8	3.2	111.7	I122 E123 E124 L128 V129 D130	I122-R126 VanDerWaalsContact CG2-CZ 3.4Å; I122-R126 WeakPolarHBondContact O-CG 3.4Å; I122-R126 PolarHBondContact O-N 3.36Å; E123-R126 PolarHBondContact O-N 3.29Å; E123-R126 IonicContact OE2-NH1 2.74Å; E123-R126 PolarHBondContact OE2-NH1 2.98Å; E124-R126 VanDerWaalsContact C-N 3.32Å; E124-R126 PolarHBondContact O-N 3.06Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.99Å; R126-V129 PolarHBondContact O-N 3.46Å; R126-D130 PolarHBondContact O-N 2.99Å
127	K	98	Very high	98.1	Very high	129 Å²	129	91.7 Å²	91.7	56%	0.561	49%	0.489	S	S	*	.	H	α-helix	trans	-58.2	-42	176.1	-70.7	169	-178.8	171.9	0	112.4	E123 E124 D130 M131	E123-K127 WeakPolarHBondContact O-CG 3.43Å; E123-K127 PolarHBondContact O-N 3.11Å; E123-K127 VanDerWaalsContact O-N 3.11Å; E124-K127 WeakPolarHBondContact O-CB 3.44Å; E124-K127 PolarHBondContact O-N 3.38Å; K127-D130 PolarHBondContact O-N 2.91Å; K127-M131 WeakPolarHBondContact O-CB 3.4Å; K127-M131 PolarHBondContact O-N 3.18Å
128	L	98.7	Very high	98.2	Very high	90 Å²	90	93.9 Å²	93.9	47%	0.471	49%	0.494	S	S	.	.	H	α-helix	trans	-65.4	-41.8	177.2	-69	177.2	0	0	0	112	E124 L125 R126 M131 L132	E124-L128 WeakPolarHBondContact O-CG 3.43Å; E124-L128 PolarHBondContact O-N 3.38Å; L125-L128 PolarHBondContact O-N 3.39Å; R126-L128 VanDerWaalsContact C-N 3.31Å; R126-L128 PolarHBondContact O-N 2.99Å; L128-M131 HydrophobicContact CD2-CE 3.51Å; L128-M131 PolarHBondContact O-N 3.44Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 2.94Å
129	V	98.6	Very high	98.2	Very high	93 Å²	93	92.8 Å²	92.8	56%	0.564	49%	0.491	S	S	*	.	H	α-helix	trans	-61.9	-46	175.4	170.1	0	0	0	0	110.9	L125 R126 M131 L132 A133	L125-V129 VanDerWaalsContact O-CG2 3.3Å; L125-V129 WeakPolarHBondContact O-CG2 3.39Å; L125-V129 PolarHBondContact O-N 2.96Å; R126-V129 PolarHBondContact O-N 3.46Å; V129-M131 VanDerWaalsContact C-N 3.34Å; V129-M131 PolarHBondContact O-N 3.42Å; V129-L132 PolarHBondContact O-N 2.96Å; V129-A133 WeakPolarHBondContact O-CB 3.49Å; V129-A133 PolarHBondContact O-N 3.32Å
130	D	98.2	Very high	98.2	Very high	103 Å²	103	96.2 Å²	96.2	55%	0.551	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-39.9	178.8	-69.7	-22.4	0	0	0	112.1	R126 K127 S134	R126-D130 PolarHBondContact O-N 2.99Å; K127-D130 PolarHBondContact O-N 2.91Å; D130-S134 WeakPolarHBondContact O-CB 3.39Å; D130-S134 PolarHBondContact O-N 2.8Å; D130-S134 PolarHBondContact O-OG 2.86Å
131	M	98.1	Very high	98.2	Very high	90 Å²	90	98.5 Å²	98.5	44%	0.443	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-48.1	174.7	177.3	179.5	54.2	0	0	111.5	K127 L128 V129 S134 Q135	K127-M131 WeakPolarHBondContact O-CB 3.4Å; K127-M131 PolarHBondContact O-N 3.18Å; L128-M131 HydrophobicContact CD2-CE 3.51Å; L128-M131 PolarHBondContact O-N 3.44Å; V129-M131 VanDerWaalsContact C-N 3.34Å; V129-M131 PolarHBondContact O-N 3.42Å; M131-S134 WeakPolarHBondContact O-CB 3.25Å; M131-S134 PolarHBondContact O-N 2.92Å; M131-Q135 WeakPolarHBondContact O-CG 3.16Å; M131-Q135 PolarHBondContact O-N 2.89Å
132	L	98.6	Very high	98.3	Very high	104 Å²	104	100 Å²	100	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-64.3	-40.7	178.6	-74.9	170.6	0	0	0	111.7	L128 V129 S134 Q135 L136	L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 2.94Å; V129-L132 PolarHBondContact O-N 2.96Å; L132-S134 VanDerWaalsContact C-N 3.32Å; L132-S134 PolarHBondContact O-N 3.46Å; L132-Q135 PolarHBondContact O-N 3.29Å; L132-L136 VanDerWaalsContact O-CB 3.25Å; L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 PolarHBondContact O-N 3.32Å
133	A	98.3	Very high	98.2	Very high	55 Å²	55	100.1 Å²	100.1	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-60.5	-42.8	174.6	0	0	0	0	0	111.5	V129 L136 S137	V129-A133 WeakPolarHBondContact O-CB 3.49Å; V129-A133 PolarHBondContact O-N 3.32Å; A133-L136 PolarHBondContact O-N 3.39Å; A133-S137 WeakPolarHBondContact O-CB 3.35Å; A133-S137 PolarHBondContact O-N 3.17Å
134	S	97.9	Very high	98.2	Very high	79 Å²	79	99.3 Å²	99.3	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-43.9	176.2	-59.9	0	0	0	0	112.2	D130 M131 L132 S137 R138	D130-S134 WeakPolarHBondContact O-CB 3.39Å; D130-S134 PolarHBondContact O-N 2.8Å; D130-S134 PolarHBondContact O-OG 2.86Å; M131-S134 WeakPolarHBondContact O-CB 3.25Å; M131-S134 PolarHBondContact O-N 2.92Å; L132-S134 VanDerWaalsContact C-N 3.32Å; L132-S134 PolarHBondContact O-N 3.46Å; S134-S137 PolarHBondContact O-N 3.27Å; S134-R138 PolarHBondContact O-N 2.92Å
135	Q	98.4	Very high	98.2	Very high	93 Å²	93	97.6 Å²	97.6	44%	0.435	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-42.7	176.3	-73	-177	5.6	0	0	112.1	M131 L132 R138 V139	M131-Q135 WeakPolarHBondContact O-CG 3.16Å; M131-Q135 PolarHBondContact O-N 2.89Å; L132-Q135 PolarHBondContact O-N 3.29Å; Q135-R138 PolarHBondContact O-N 3.44Å; Q135-V139 WeakPolarHBondContact O-CG2 3.34Å; Q135-V139 PolarHBondContact O-N 3.43Å
136	L	98.5	Very high	98.2	Very high	83 Å²	83	95.5 Å²	95.5	44%	0.435	49%	0.486	S	S	.	.	H	α-helix	trans	-65.7	-40	178.5	179.3	157.1	0	0	0	111.4	L132 A133 V139 R140	L132-L136 VanDerWaalsContact O-CB 3.25Å; L132-L136 WeakPolarHBondContact O-CB 3.3Å; L132-L136 PolarHBondContact O-N 3.32Å; A133-L136 PolarHBondContact O-N 3.39Å; L136-V139 PolarHBondContact O-N 3.41Å; L136-R140 HydrophobicContact CD2-CG 4.4Å; L136-R140 VanDerWaalsContact CD2-NH1 3.27Å; L136-R140 WeakPolarHBondContact O-CG 3.46Å; L136-R140 PolarHBondContact O-N 3.43Å
137	S	98	Very high	98.1	Very high	76 Å²	76	95.7 Å²	95.7	53%	0.531	49%	0.487	S	S	.	.	H	α-helix	trans	-58.9	-48.7	171.8	-171.5	0	0	0	0	111.7	A133 S134 V139 R140 Q141	A133-S137 WeakPolarHBondContact O-CB 3.35Å; A133-S137 PolarHBondContact O-N 3.17Å; S134-S137 PolarHBondContact O-N 3.27Å; S137-V139 PolarHBondContact O-N 3.31Å; S137-R140 PolarHBondContact O-N 3.14Å; S137-Q141 PolarHBondContact O-N 2.93Å
138	R	98.2	Very high	98.1	Very high	130 Å²	130	96.2 Å²	96.2	49%	0.491	49%	0.491	S	S	.	.	H	α-helix	trans	-58.7	-45.3	176.6	-176.7	-175.9	63.2	85.1	0.7	112.4	S134 Q135 Q141 M142	S134-R138 PolarHBondContact O-N 2.92Å; Q135-R138 PolarHBondContact O-N 3.44Å; R138-Q141 PolarHBondContact O-N 2.94Å; R138-M142 HydrophobicContact CG-SD 4.25Å; R138-M142 PolarHBondContact NH1-SD 2.92Å; R138-M142 WeakPolarHBondContact O-CG 3.38Å; R138-M142 PolarHBondContact O-N 3.29Å
139	V	98.2	Very high	98	Very high	80 Å²	80	98 Å²	98	49%	0.485	49%	0.492	S	S	.	.	H	α-helix	trans	-65	-39.7	178.6	170.2	0	0	0	0	111.3	Q135 L136 S137 Q141 M142 L143	Q135-V139 WeakPolarHBondContact O-CG2 3.34Å; Q135-V139 PolarHBondContact O-N 3.43Å; L136-V139 PolarHBondContact O-N 3.41Å; S137-V139 PolarHBondContact O-N 3.31Å; V139-Q141 VanDerWaalsContact C-N 3.35Å; V139-M142 PolarHBondContact O-N 2.96Å; V139-L143 VanDerWaalsContact O-CB 3.27Å; V139-L143 WeakPolarHBondContact O-CB 3.39Å; V139-L143 PolarHBondContact O-N 3.01Å
140	R	98.2	Very high	97.8	Very high	164 Å²	164	100.4 Å²	100.4	62%	0.619	49%	0.491	S	S	*	.	H	α-helix	trans	-62.1	-42	174.2	-75.9	179.7	176.7	160.4	-0.8	111.9	L136 S137 L143 S144	L136-R140 HydrophobicContact CD2-CG 4.4Å; L136-R140 VanDerWaalsContact CD2-NH1 3.27Å; L136-R140 WeakPolarHBondContact O-CG 3.46Å; L136-R140 PolarHBondContact O-N 3.43Å; S137-R140 PolarHBondContact O-N 3.14Å; R140-L143 PolarHBondContact O-N 2.8Å; R140-S144 PolarHBondContact O-N 3.28Å; R140-S144 PolarHBondContact O-OG 3.41Å
141	Q	98.2	Very high	97.7	Very high	115 Å²	115	100.8 Å²	100.8	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-61.1	-52.3	174.9	-179	-175.7	-14.5	0	0	111.2	S137 R138 V139 L143 S144 E145	S137-Q141 PolarHBondContact O-N 2.93Å; R138-Q141 PolarHBondContact O-N 2.94Å; V139-Q141 VanDerWaalsContact C-N 3.35Å; Q141-L143 VanDerWaalsContact C-N 3.26Å; Q141-L143 PolarHBondContact O-N 2.89Å; Q141-S144 WeakPolarHBondContact O-CB 3.45Å; Q141-S144 PolarHBondContact O-N 2.98Å; Q141-E145 WeakPolarHBondContact CG-OE1 3.28Å; Q141-E145 PolarHBondContact NE2-OE1 2.95Å; Q141-E145 WeakPolarHBondContact O-CG 3.27Å; Q141-E145 PolarHBondContact O-N 3.32Å
142	M	98.1	Very high	97.5	Very high	95 Å²	95	98.9 Å²	98.9	47%	0.468	49%	0.491	S	S	.	.	H	α-helix	trans	-58.9	-37.7	178.6	-69.4	178.1	68.2	0	0	112.4	R138 V139 E145 E146	R138-M142 HydrophobicContact CG-SD 4.25Å; R138-M142 PolarHBondContact NH1-SD 2.92Å; R138-M142 WeakPolarHBondContact O-CG 3.38Å; R138-M142 PolarHBondContact O-N 3.29Å; V139-M142 PolarHBondContact O-N 2.96Å; M142-E145 PolarHBondContact O-N 2.9Å; M142-E146 VanDerWaalsContact O-CB 3.28Å; M142-E146 WeakPolarHBondContact O-CB 3.28Å; M142-E146 PolarHBondContact O-N 2.86Å
143	L	97.6	Very high	97.2	Very high	78 Å²	78	98.4 Å²	98.4	41%	0.408	49%	0.488	S	S	.	.	H	α-helix	trans	-64.6	-40.6	175.4	178.9	66.7	0	0	0	111.9	V139 R140 Q141 R147	V139-L143 VanDerWaalsContact O-CB 3.27Å; V139-L143 WeakPolarHBondContact O-CB 3.39Å; V139-L143 PolarHBondContact O-N 3.01Å; R140-L143 PolarHBondContact O-N 2.8Å; Q141-L143 VanDerWaalsContact C-N 3.26Å; Q141-L143 PolarHBondContact O-N 2.89Å; L143-R147 WeakPolarHBondContact O-CB 3.38Å; L143-R147 VanDerWaalsContact O-CG 3.28Å; L143-R147 WeakPolarHBondContact O-CG 3.48Å; L143-R147 PolarHBondContact O-N 2.88Å
144	S	97.4	Very high	96.8	Very high	69 Å²	69	100.2 Å²	100.2	48%	0.483	49%	0.487	S	S	.	.	H	α-helix	trans	-66.1	-45.5	175.5	-66.1	0	0	0	0	111.7	R140 Q141 E146 R147 E148	R140-S144 PolarHBondContact O-N 3.28Å; R140-S144 PolarHBondContact O-OG 3.41Å; Q141-S144 WeakPolarHBondContact O-CB 3.45Å; Q141-S144 PolarHBondContact O-N 2.98Å; S144-E146 VanDerWaalsContact C-N 3.31Å; S144-E146 PolarHBondContact O-N 3.21Å; S144-R147 WeakPolarHBondContact O-CB 3.45Å; S144-R147 PolarHBondContact O-N 3.42Å; S144-E148 PolarHBondContact O-N 3.05Å
145	E	97.9	Very high	96.5	Very high	74 Å²	74	98.9 Å²	98.9	35%	0.346	48%	0.48	S	S	.	.	H	α-helix	trans	-60.3	-41.2	175.7	-69.8	170.9	-169.2	0	0	111.7	Q141 M142 E148 R149	Q141-E145 WeakPolarHBondContact CG-OE1 3.28Å; Q141-E145 PolarHBondContact NE2-OE1 2.95Å; Q141-E145 WeakPolarHBondContact O-CG 3.27Å; Q141-E145 PolarHBondContact O-N 3.32Å; M142-E145 PolarHBondContact O-N 2.9Å; E145-E148 PolarHBondContact O-N 3.28Å; E145-R149 WeakPolarHBondContact O-CG 3.29Å; E145-R149 PolarHBondContact O-N 3.23Å
146	E	98	Very high	96.1	Very high	65 Å²	65	100.8 Å²	100.8	30%	0.304	49%	0.489	S	S	.	.	H	α-helix	trans	-67.3	-39.3	176.8	-179	58.8	-160	0	0	112	M142 S144 R149 R150	M142-E146 VanDerWaalsContact O-CB 3.28Å; M142-E146 WeakPolarHBondContact O-CB 3.28Å; M142-E146 PolarHBondContact O-N 2.86Å; S144-E146 VanDerWaalsContact C-N 3.31Å; S144-E146 PolarHBondContact O-N 3.21Å; E146-R149 PolarHBondContact O-N 3.4Å; E146-R149 IonicContact OE2-CZ 2.74Å; E146-R149 IonicContact OE2-NE 3.4Å; E146-R149 PolarHBondContact OE2-NE 3.42Å; E146-R149 IonicContact OE2-NH2 3.41Å; E146-R149 PolarHBondContact OE2-NH2 2.93Å; E146-R150 VanDerWaalsContact O-CG 3.29Å; E146-R150 WeakPolarHBondContact O-CG 3.45Å; E146-R150 PolarHBondContact O-N 3.02Å; E146-R150 IonicContact OE1-CZ 3.82Å; E146-R150 IonicContact OE1-NE 3.12Å; E146-R150 PolarHBondContact OE1-NE 2.74Å; E146-R150 VanDerWaalsContact OE1-NE 3.12Å; E146-R150 IonicContact OE1-NH2 3.6Å
147	R	97.6	Very high	95.6	Very high	144 Å²	144	100.2 Å²	100.2	54%	0.543	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-42.4	173	-77.7	172	175.9	156.7	-2.8	111.7	L143 S144 R150 L151	L143-R147 WeakPolarHBondContact O-CB 3.38Å; L143-R147 VanDerWaalsContact O-CG 3.28Å; L143-R147 WeakPolarHBondContact O-CG 3.48Å; L143-R147 PolarHBondContact O-N 2.88Å; S144-R147 WeakPolarHBondContact O-CB 3.45Å; S144-R147 PolarHBondContact O-N 3.42Å; R147-R150 PolarHBondContact O-N 2.97Å; R147-L151 WeakPolarHBondContact O-CB 3.44Å; R147-L151 VanDerWaalsContact O-CG 3.31Å; R147-L151 WeakPolarHBondContact O-CG 3.4Å; R147-L151 PolarHBondContact O-N 2.93Å
148	E	97.4	Very high	95	Very high	140 Å²	140	101 Å²	101	65%	0.654	48%	0.484	S	S	*	.	H	α-helix	trans	-63.3	-44.8	176.3	-174.9	174.2	-169.8	0	0	111.5	S144 E145 R150 L151 A152	S144-E148 PolarHBondContact O-N 3.05Å; E145-E148 PolarHBondContact O-N 3.28Å; E148-R150 PolarHBondContact O-N 3.42Å; E148-L151 PolarHBondContact O-N 2.97Å; E148-A152 WeakPolarHBondContact O-CB 3.31Å; E148-A152 PolarHBondContact O-N 3.19Å
149	R	97.1	Very high	94.5	Very high	129 Å²	129	99.9 Å²	99.9	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-58.2	-45	173.3	-77.3	-165.5	-67.3	-97.1	0.6	112.5	E145 E146 A152 I153	E145-R149 WeakPolarHBondContact O-CG 3.29Å; E145-R149 PolarHBondContact O-N 3.23Å; E146-R149 PolarHBondContact O-N 3.4Å; E146-R149 IonicContact OE2-CZ 2.74Å; E146-R149 IonicContact OE2-NE 3.4Å; E146-R149 PolarHBondContact OE2-NE 3.42Å; E146-R149 IonicContact OE2-NH2 3.41Å; E146-R149 PolarHBondContact OE2-NH2 2.93Å; R149-A152 PolarHBondContact O-N 3.31Å; R149-I153 WeakPolarHBondContact O-CG1 3.47Å; R149-I153 PolarHBondContact O-N 3.12Å
150	R	95.2	Very high	94	Very high	142 Å²	142	100.2 Å²	100.2	54%	0.536	50%	0.502	S	S	.	.	H	α-helix	trans	-61.5	-46.3	176.6	-73.2	174.7	-171	-162.7	1	111.6	E146 R147 E148 A152 I153 E154	E146-R150 VanDerWaalsContact O-CG 3.29Å; E146-R150 WeakPolarHBondContact O-CG 3.45Å; E146-R150 PolarHBondContact O-N 3.02Å; E146-R150 IonicContact OE1-CZ 3.82Å; E146-R150 IonicContact OE1-NE 3.12Å; E146-R150 PolarHBondContact OE1-NE 2.74Å; E146-R150 VanDerWaalsContact OE1-NE 3.12Å; E146-R150 IonicContact OE1-NH2 3.6Å; R147-R150 PolarHBondContact O-N 2.97Å; E148-R150 PolarHBondContact O-N 3.42Å; R150-A152 VanDerWaalsContact C-N 3.32Å; R150-A152 PolarHBondContact O-N 3.33Å; R150-I153 PolarHBondContact O-N 3.07Å; R150-E154 WeakPolarHBondContact O-CB 3.5Å; R150-E154 VanDerWaalsContact O-CG 3.28Å; R150-E154 WeakPolarHBondContact O-CG 3.28Å; R150-E154 PolarHBondContact O-N 3.49Å
151	L	94.8	Very high	92.7	Very high	112 Å²	112	95.3 Å²	95.3	59%	0.586	50%	0.502	S	S	*	.	H	α-helix	trans	-61	-40.1	177	-74.5	170	0	0	0	112.1	R147 E148 E154 A155	R147-L151 WeakPolarHBondContact O-CB 3.44Å; R147-L151 VanDerWaalsContact O-CG 3.31Å; R147-L151 WeakPolarHBondContact O-CG 3.4Å; R147-L151 PolarHBondContact O-N 2.93Å; E148-L151 PolarHBondContact O-N 2.97Å; L151-E154 PolarHBondContact O-N 3.4Å; L151-A155 WeakPolarHBondContact O-CB 3.38Å; L151-A155 PolarHBondContact O-N 3.35Å
152	A	94.9	Very high	91.1	Very high	49 Å²	49	92.5 Å²	92.5	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-47.4	175.6	0	0	0	0	0	111.7	E148 R149 R150 A155 E156	E148-A152 WeakPolarHBondContact O-CB 3.31Å; E148-A152 PolarHBondContact O-N 3.19Å; R149-A152 PolarHBondContact O-N 3.31Å; R150-A152 VanDerWaalsContact C-N 3.32Å; R150-A152 PolarHBondContact O-N 3.33Å; A152-A155 PolarHBondContact O-N 3.05Å; A152-E156 WeakPolarHBondContact O-CG 3.3Å; A152-E156 PolarHBondContact O-N 3.03Å
153	I	92.4	Very high	89.1	Confident	94 Å²	94	92.5 Å²	92.5	48%	0.482	50%	0.501	S	S	.	.	H	α-helix	trans	-63.4	-43.4	176.7	-69.4	160.9	0	0	0	111.2	R149 R150 A155 E156 L157	R149-I153 WeakPolarHBondContact O-CG1 3.47Å; R149-I153 PolarHBondContact O-N 3.12Å; R150-I153 PolarHBondContact O-N 3.07Å; I153-A155 VanDerWaalsContact C-N 3.32Å; I153-A155 PolarHBondContact O-N 2.94Å; I153-E156 PolarHBondContact O-N 2.85Å; I153-L157 HydrophobicContact CG2-CD1 3.94Å; I153-L157 HydrophobicContact CG2-CG 4.25Å; I153-L157 WeakPolarHBondContact O-CB 3.42Å; I153-L157 VanDerWaalsContact O-CG 3.3Å; I153-L157 WeakPolarHBondContact O-CG 3.25Å; I153-L157 PolarHBondContact O-N 2.95Å
154	E	89.8	Confident	87.3	Confident	94 Å²	94	96.1 Å²	96.1	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-60.1	-42.5	176.5	-75.6	170.9	-167.5	0	0	111.1	R150 L151 L157 I158	R150-E154 WeakPolarHBondContact O-CB 3.5Å; R150-E154 VanDerWaalsContact O-CG 3.28Å; R150-E154 WeakPolarHBondContact O-CG 3.28Å; R150-E154 PolarHBondContact O-N 3.49Å; L151-E154 PolarHBondContact O-N 3.4Å; E154-L157 PolarHBondContact O-N 3Å; E154-I158 WeakPolarHBondContact O-CD1 3.49Å; E154-I158 VanDerWaalsContact O-CG1 3.25Å; E154-I158 WeakPolarHBondContact O-CG1 3.44Å; E154-I158 PolarHBondContact O-N 3.44Å
155	A	91	Very high	85.4	Confident	50 Å²	50	101.1 Å²	101.1	41%	0.413	53%	0.531	S	S	.	.	H	α-helix	trans	-64.5	-40.6	175.2	0	0	0	0	0	113	L151 A152 I153 I158 S159	L151-A155 WeakPolarHBondContact O-CB 3.38Å; L151-A155 PolarHBondContact O-N 3.35Å; A152-A155 PolarHBondContact O-N 3.05Å; I153-A155 VanDerWaalsContact C-N 3.32Å; I153-A155 PolarHBondContact O-N 2.94Å; A155-I158 PolarHBondContact O-N 3.35Å; A155-S159 WeakPolarHBondContact O-CB 3.5Å; A155-S159 PolarHBondContact O-N 3.44Å; A155-S159 PolarHBondContact O-OG 2.89Å
156	E	90.5	Very high	83.3	Confident	134 Å²	134	104.9 Å²	104.9	63%	0.626	55%	0.548	S	S	*	.	H	α-helix	trans	-64.7	-41	173.4	-74.2	178.5	-173.3	0	0	112.2	A152 I153 S159 S160	A152-E156 WeakPolarHBondContact O-CG 3.3Å; A152-E156 PolarHBondContact O-N 3.03Å; I153-E156 PolarHBondContact O-N 2.85Å; E156-S159 PolarHBondContact O-N 2.92Å; E156-S160 VanDerWaalsContact O-CB 3.32Å; E156-S160 WeakPolarHBondContact O-CB 3.36Å; E156-S160 PolarHBondContact O-N 3.22Å; E156-S160 PolarHBondContact O-OG 2.91Å
157	L	87.9	Confident	80.8	Confident	70 Å²	70	106.7 Å²	106.7	37%	0.366	57%	0.568	S	S	.	*	H	α-helix	trans	-66.6	-37.6	177.6	-71.4	169.8	0	0	0	112.3	I153 E154 S160 G161 G162 F163	I153-L157 HydrophobicContact CG2-CD1 3.94Å; I153-L157 HydrophobicContact CG2-CG 4.25Å; I153-L157 WeakPolarHBondContact O-CB 3.42Å; I153-L157 VanDerWaalsContact O-CG 3.3Å; I153-L157 WeakPolarHBondContact O-CG 3.25Å; I153-L157 PolarHBondContact O-N 2.95Å; E154-L157 PolarHBondContact O-N 3Å; L157-S160 WeakPolarHBondContact CA-OG 3.48Å; L157-S160 PolarHBondContact O-OG 2.77Å; L157-G161 PolarHBondContact O-N 3.45Å; L157-G162 PolarHBondContact O-N 3.3Å; L157-F163 HydrophobicContact CB-CD2 3.7Å; L157-F163 HydrophobicContact CB-CE2 4.26Å; L157-F163 HydrophobicContact CD1-CD2 4.24Å; L157-F163 HydrophobicContact CD1-CE2 4.1Å; L157-F163 PolarHBondContact O-N 3.43Å
158	I	85.4	Confident	78.4	Confident	94 Å²	94	106.7 Å²	106.7	48%	0.482	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-43.8	172.6	-68.2	164.9	0	0	0	110.1	E154 A155 G161 F163	E154-I158 WeakPolarHBondContact O-CD1 3.49Å; E154-I158 VanDerWaalsContact O-CG1 3.25Å; E154-I158 WeakPolarHBondContact O-CG1 3.44Å; E154-I158 PolarHBondContact O-N 3.44Å; A155-I158 PolarHBondContact O-N 3.35Å; I158-G161 PolarHBondContact O-N 3.28Å; I158-F163 HydrophobicContact CG1-CB 4.49Å; I158-F163 HydrophobicContact CG1-CG 4.42Å
159	S	87.3	Confident	76.1	Confident	105 Å²	105	108.4 Å²	108.4	73%	0.734	59%	0.587	S	S	*	*	H	α-helix	trans	-70.7	-34.3	-177.8	-58.1	0	0	0	0	113.5	A155 E156 G161	A155-S159 WeakPolarHBondContact O-CB 3.5Å; A155-S159 PolarHBondContact O-N 3.44Å; A155-S159 PolarHBondContact O-OG 2.89Å; E156-S159 PolarHBondContact O-N 2.92Å; S159-G161 VanDerWaalsContact C-N 3.25Å; S159-G161 PolarHBondContact O-N 3.38Å
160	S	86.5	Confident	73.6	Confident	88 Å²	88	106.7 Å²	106.7	62%	0.615	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-4	178.7	56.3	0	0	0	0	113.8	E156 L157 G162	E156-S160 VanDerWaalsContact O-CB 3.32Å; E156-S160 WeakPolarHBondContact O-CB 3.36Å; E156-S160 PolarHBondContact O-N 3.22Å; E156-S160 PolarHBondContact O-OG 2.91Å; L157-S160 WeakPolarHBondContact CA-OG 3.48Å; L157-S160 PolarHBondContact O-OG 2.77Å; S160-G162 PolarHBondContact O-N 2.82Å
161	G	71	Confident	71.3	Confident	61 Å²	61	107.5 Å²	107.5	63%	0.629	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.9	10.6	-176.7	0	0	0	0	0	113.8	L157 I158 S159 F163	L157-G161 PolarHBondContact O-N 3.45Å; I158-G161 PolarHBondContact O-N 3.28Å; S159-G161 VanDerWaalsContact C-N 3.25Å; S159-G161 PolarHBondContact O-N 3.38Å; G161-F163 PolarHBondContact O-N 2.89Å
162	G	64.7	Low	69	Low	55 Å²	55	105.6 Å²	105.6	57%	0.567	60%	0.602	S	S	*	*			trans	-74.4	-13.1	176.2	0	0	0	0	0	113.5	L157 S160 N164	L157-G162 PolarHBondContact O-N 3.3Å; S160-G162 PolarHBondContact O-N 2.82Å; G162-N164 PolarHBondContact O-N 2.96Å
163	F	57.8	Low	67	Low	96 Å²	96	112.8 Å²	112.8	42%	0.421	62%	0.62	S	S	.	*			trans	-82.6	89.5	176.3	-128.4	-98.8	0	0	0	110.9	L157 I158 G161 Y165	L157-F163 HydrophobicContact CB-CD2 3.7Å; L157-F163 HydrophobicContact CB-CE2 4.26Å; L157-F163 HydrophobicContact CD1-CD2 4.24Å; L157-F163 HydrophobicContact CD1-CE2 4.1Å; L157-F163 PolarHBondContact O-N 3.43Å; I158-F163 HydrophobicContact CG1-CB 4.49Å; I158-F163 HydrophobicContact CG1-CG 4.42Å; G161-F163 PolarHBondContact O-N 2.89Å; F163-Y165 HydrophobicContact CD1-CD2 4.19Å; F163-Y165 HydrophobicContact CD1-CE2 4.14Å; F163-Y165 PolarHBondContact O-N 3.35Å
164	N	59.8	Low	65.2	Low	154 Å²	154	116.5 Å²	116.5	82%	0.824	64%	0.635	S	S	*	*			trans	-69	100.2	159.6	-94.7	-30.7	0	0	0	107.9	G162 Q166	G162-N164 PolarHBondContact O-N 2.96Å; N164-Q166 PolarHBondContact O-N 3.27Å
165	Y	55.8	Low	63.5	Low	174 Å²	174	118.1 Å²	118.1	68%	0.682	65%	0.647	S	S	*	*			trans	-59.7	89.7	163	-87.5	-94.7	0	0	0	108.5	F163 S167	F163-Y165 HydrophobicContact CD1-CD2 4.19Å; F163-Y165 HydrophobicContact CD1-CE2 4.14Å; F163-Y165 PolarHBondContact O-N 3.35Å; Y165-S167 PolarHBondContact O-N 2.98Å
166	Q	53.9	Low	61.6	Low	152 Å²	152	123.2 Å²	123.2	71%	0.71	66%	0.656	S	S	*	*			trans	-69.1	96.6	146.7	-80.8	179.5	-5.7	0	0	104.5	N164 N168	N164-Q166 PolarHBondContact O-N 3.27Å; Q166-N168 PolarHBondContact O-N 2.85Å
167	S	46.7	Very low	60	Low	104 Å²	104	124.1 Å²	124.1	73%	0.727	67%	0.666	S	S	*	*			trans	-55.6	84.2	167.4	56.2	0	0	0	0	108.3	Y165 E169	Y165-S167 PolarHBondContact O-N 2.98Å; S167-E169 PolarHBondContact O-N 3.27Å
168	N	46.7	Very low	58.8	Low	143 Å²	143	128.5 Å²	128.5	77%	0.765	69%	0.689	S	S	*	*			trans	-62.4	120.6	148.7	-65.5	-39.6	0	0	0	103.7	Q166 S170	Q166-N168 PolarHBondContact O-N 2.85Å; N168-S170 PolarHBondContact O-N 3.45Å
169	E	49.1	Very low	57.8	Low	177 Å²	177	131.1 Å²	131.1	83%	0.827	70%	0.704	S	S	*	*			trans	-26	125.5	179.6	-68.3	171.2	147.2	0	0	110.6	S167 L171	S167-E169 PolarHBondContact O-N 3.27Å; E169-L171 VanDerWaalsContact C-N 3.32Å; E169-L171 PolarHBondContact O-N 3.47Å
170	S	44.7	Very low	56.6	Low	93 Å²	93	134 Å²	134	65%	0.65	71%	0.712	S	S	*	*			trans	-43.8	104.2	168.3	51.6	0	0	0	0	107.9	N168 T172	N168-S170 PolarHBondContact O-N 3.45Å; S170-T172 PolarHBondContact O-N 2.94Å
171	L	46.4	Very low	55.6	Low	159 Å²	159	132.7 Å²	132.7	83%	0.832	71%	0.712	S	S	*	*			trans	-68.7	71.7	162.6	-94.4	156.5	0	0	0	105	E169 Y173	E169-L171 VanDerWaalsContact C-N 3.32Å; E169-L171 PolarHBondContact O-N 3.47Å; L171-Y173 PolarHBondContact O-N 3.44Å
172	T	47.3	Very low	54.9	Low	71 Å²	71	138.6 Å²	138.6	44%	0.436	72%	0.721	S	S	.	*			trans	-58.5	129.4	164.3	40.8	0	0	0	0	105.3	S170 Q174 N175	S170-T172 PolarHBondContact O-N 2.94Å; T172-Q174 PolarHBondContact O-N 3.36Å; T172-N175 PolarHBondContact O-N 3.18Å
173	Y	53.1	Low	55.1	Low	200 Å²	200	140.5 Å²	140.5	78%	0.784	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.5	10.2	177.5	-149.8	-92.9	0	0	0	113.5	L171 Y176	L171-Y173 PolarHBondContact O-N 3.44Å; Y173-Y176 HydrophobicContact CD1-CD2 4.35Å; Y173-Y176 HydrophobicContact CD2-CD2 4.48Å; Y173-Y176 HydrophobicContact CD2-CE2 4.06Å; Y173-Y176 HydrophobicContact CE1-CD2 4.49Å; Y173-Y176 HydrophobicContact CE2-CE2 4.16Å; Y173-Y176 HydrophobicContact CG-CD2 4.34Å; Y173-Y176 HydrophobicContact CG-CE2 4.35Å
174	Q	52.9	Low	55.7	Low	172 Å²	172	143.7 Å²	143.7	80%	0.804	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	-1.9	-175.9	-70.2	-76.6	-44.2	0	0	112.9	T172	T172-Q174 PolarHBondContact O-N 3.36Å
175	N	54.5	Low	56	Low	128 Å²	128	142.9 Å²	142.9	68%	0.684	73%	0.73	S	S	*	*			trans	-102.4	14.6	175.4	-69	-52.4	0	0	0	113.5	T172 D177	T172-N175 PolarHBondContact O-N 3.18Å; N175-D177 PolarHBondContact O-N 3.06Å
176	Y	51.9	Low	56.2	Low	157 Å²	157	144 Å²	144	62%	0.616	73%	0.732	S	S	*	*			trans	-83.2	93.4	164.7	-69.7	-77.2	0	0	0	107.2	Y173 D178	Y173-Y176 HydrophobicContact CD1-CD2 4.35Å; Y173-Y176 HydrophobicContact CD2-CD2 4.48Å; Y173-Y176 HydrophobicContact CD2-CE2 4.06Å; Y173-Y176 HydrophobicContact CE1-CD2 4.49Å; Y173-Y176 HydrophobicContact CE2-CE2 4.16Å; Y173-Y176 HydrophobicContact CG-CD2 4.34Å; Y173-Y176 HydrophobicContact CG-CE2 4.35Å; Y176-D178 PolarHBondContact O-N 3.04Å
177	D	56.7	Low	56.6	Low	154 Å²	154	141.3 Å²	141.3	82%	0.824	73%	0.728	S	S	*	*			trans	-59.4	127.9	155.7	-86.1	-37.9	0	0	0	106.8	N175 D179	N175-D177 PolarHBondContact O-N 3.06Å; D177-D179 PolarHBondContact O-N 2.81Å
178	D	62.5	Low	57.2	Low	161 Å²	161	142.6 Å²	142.6	86%	0.861	74%	0.736	S	S	*	*	S	Bend	trans	-64.4	28	-176.1	-66.2	-57.5	0	0	0	114.5	Y176 D180	Y176-D178 PolarHBondContact O-N 3.04Å; D178-D180 PolarHBondContact O-N 2.72Å
179	D	65	Low	57.6	Low	149 Å²	149	140.6 Å²	140.6	80%	0.797	73%	0.729	S	S	*	*			trans	-94.1	86.9	178	-102.6	-34.5	0	0	0	110.7	D177 G181	D177-D179 PolarHBondContact O-N 2.81Å; D179-G181 PolarHBondContact O-N 3.27Å
180	D	61.8	Low	57.4	Low	167 Å²	167	139.3 Å²	139.3	89%	0.893	73%	0.727	S	S	*	*			trans	-69.5	37.3	171.4	-66	-34.1	0	0	0	113.2	D178 F182	D178-D180 PolarHBondContact O-N 2.72Å; D180-F182 PolarHBondContact O-N 3.34Å
181	G	65	Low	57.5	Low	60 Å²	60	140.7 Å²	140.7	62%	0.619	73%	0.732	S	S	*	*			trans	-75.8	107.1	173	0	0	0	0	0	110.5	D179 D183	D179-G181 PolarHBondContact O-N 3.27Å; G181-D183 PolarHBondContact O-N 3.31Å
182	F	56.8	Low	57.4	Low	185 Å²	185	136.1 Å²	136.1	81%	0.811	72%	0.723	S	S	*	*			trans	-62.1	95	167.7	-176.9	-97.3	0	0	0	109.7	D180 E184	D180-F182 PolarHBondContact O-N 3.34Å; F182-E184 HydrophobicContact CD1-CB 4.38Å; F182-E184 HydrophobicContact CE1-CB 3.95Å; F182-E184 PolarHBondContact O-N 2.73Å
183	D	69.9	Low	57.5	Low	95 Å²	95	139.5 Å²	139.5	51%	0.508	74%	0.737	S	S	.	*			trans	-87.3	98.8	172.3	-179.9	13.3	0	0	0	110.1	G181 N185 R186	G181-D183 PolarHBondContact O-N 3.31Å; D183-N185 PolarHBondContact O-N 2.73Å; D183-N185 VanDerWaalsContact O-N 3.14Å; D183-N185 WeakPolarHBondContact OD1-CB 3.32Å; D183-N185 PolarHBondContact OD1-N 3.4Å; D183-R186 HydrophobicContact CB-CB 4.31Å; D183-R186 PolarHBondContact O-N 2.73Å
184	E	68.9	Low	57.3	Low	162 Å²	162	135.5 Å²	135.5	76%	0.757	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-8.9	175.3	42.2	-173.2	158.8	0	0	114.2	F182	F182-E184 HydrophobicContact CD1-CB 4.38Å; F182-E184 HydrophobicContact CE1-CB 3.95Å; F182-E184 PolarHBondContact O-N 2.73Å
185	N	67.2	Low	57.1	Low	137 Å²	137	136.4 Å²	136.4	73%	0.733	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	4.1	176.2	-61.1	-63.6	0	0	0	113.8	D183 P187	D183-N185 PolarHBondContact O-N 2.73Å; D183-N185 VanDerWaalsContact O-N 3.14Å; D183-N185 WeakPolarHBondContact OD1-CB 3.32Å; D183-N185 PolarHBondContact OD1-N 3.4Å; N185-P187 WeakPolarHBondContact O-CD 3.38Å
186	R	59.6	Low	56.7	Low	197 Å²	197	137.6 Å²	137.6	74%	0.743	74%	0.741	S	S	*	*			trans	-70.3	111.7	179.8	-162.6	174.6	-155.3	-117.8	5	110	D183 C188	D183-R186 HydrophobicContact CB-CB 4.31Å; D183-R186 PolarHBondContact O-N 2.73Å; R186-C188 PolarHBondContact O-N 3.27Å
187	P	62.7	Low	56.6	Low	96 Å²	96	135.7 Å²	135.7	62%	0.623	75%	0.745	S	S	*	*			trans	-65.4	134.9	179.6	26.7	-31.9	0	0	0	109.4	N185 V189	N185-P187 WeakPolarHBondContact O-CD 3.38Å; P187-V189 VanDerWaalsContact C-N 3.26Å; P187-V189 PolarHBondContact O-N 3.25Å
188	C	57.9	Low	55.9	Low	132 Å²	132	134.1 Å²	134.1	89%	0.892	75%	0.745	S	S	*	*			trans	-64.4	89.7	169.9	-53.3	0	0	0	0	108.7	R186 L190	R186-C188 PolarHBondContact O-N 3.27Å; C188-L190 PolarHBondContact O-N 2.79Å
189	V	54.8	Low	55.3	Low	100 Å²	100	132.9 Å²	132.9	61%	0.606	74%	0.738	S	S	*	*			trans	-76.4	80.4	172.3	-80.5	0	0	0	0	108.8	P187 T191	P187-V189 VanDerWaalsContact C-N 3.26Å; P187-V189 PolarHBondContact O-N 3.25Å; V189-T191 HydrophobicContact CB-CG2 4.31Å; V189-T191 HydrophobicContact CG1-CG2 4.47Å; V189-T191 PolarHBondContact O-N 3.24Å
190	L	46.6	Very low	54	Low	151 Å²	151	132.3 Å²	132.3	79%	0.791	74%	0.735	S	S	*	*			trans	-75.4	60.2	160.1	-163	77.1	0	0	0	108.5	C188 L193	C188-L190 PolarHBondContact O-N 2.79Å; L190-L193 HydrophobicContact CD2-CD1 4.43Å
191	T	46.8	Very low	53.3	Low	122 Å²	122	132.9 Å²	132.9	75%	0.748	73%	0.73	S	S	*	*			trans	-96	102.6	177.4	42.3	0	0	0	0	108.4	V189	V189-T191 HydrophobicContact CB-CG2 4.31Å; V189-T191 HydrophobicContact CG1-CG2 4.47Å; V189-T191 PolarHBondContact O-N 3.24Å
192	G	44.3	Very low	52.2	Low	63 Å²	63	135.9 Å²	135.9	65%	0.649	73%	0.732	S	S	*	*			trans	152.3	10.4	166.2	0	0	0	0	0	119.1	T194	G192-T194 VanDerWaalsContact C-N 3.28Å; G192-T194 PolarHBondContact O-N 2.79Å
193	L	48.1	Very low	51.3	Low	141 Å²	141	132.3 Å²	132.3	74%	0.738	73%	0.725	S	S	*	*			trans	-78.7	81.1	172.6	-72.7	173.6	0	0	0	110.8	L190 K195	L190-L193 HydrophobicContact CD2-CD1 4.43Å; L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 2.85Å
194	T	48.7	Very low	49.9	Very low	117 Å²	117	135 Å²	135	72%	0.718	74%	0.74	S	S	*	*			trans	-63.7	93.8	159.2	25	0	0	0	0	108.8	G192 L196	G192-T194 VanDerWaalsContact C-N 3.28Å; G192-T194 PolarHBondContact O-N 2.79Å; T194-L196 PolarHBondContact O-N 3.27Å; T194-L196 VanDerWaalsContact O-N 3.07Å
195	K	49.2	Very low	48.4	Very low	191 Å²	191	135.5 Å²	135.5	83%	0.83	75%	0.746	S	S	*	*			trans	22.3	77.1	153.1	-144.5	174.7	-168.2	178.9	0	114.8	L193 T197	L193-K195 VanDerWaalsContact C-N 3.3Å; L193-K195 PolarHBondContact O-N 2.85Å; K195-T197 PolarHBondContact O-N 2.98Å
196	L	47.2	Very low	47.3	Very low	152 Å²	152	134.7 Å²	134.7	80%	0.796	75%	0.749	S	S	*	*			trans	-58.5	111.3	164.2	-82.3	159.3	0	0	0	107.9	T194 C198	T194-L196 PolarHBondContact O-N 3.27Å; T194-L196 VanDerWaalsContact O-N 3.07Å; L196-C198 PolarHBondContact O-N 3.5Å
197	T	49.4	Very low	46.2	Very low	117 Å²	117	130.1 Å²	130.1	72%	0.718	75%	0.747	S	S	*	*			trans	-76.4	108.3	166.5	37.4	0	0	0	0	106.5	K195 L199	K195-T197 PolarHBondContact O-N 2.98Å; T197-L199 PolarHBondContact O-N 3.24Å
198	C	41.5	Very low	45.1	Very low	121 Å²	121	131.3 Å²	131.3	82%	0.818	76%	0.757	S	S	*	*			trans	-63.9	107	175.8	-53.8	0	0	0	0	108.6	L196 N200	L196-C198 PolarHBondContact O-N 3.5Å; C198-N200 PolarHBondContact O-N 3.41Å
199	L	49.1	Very low	44.4	Very low	135 Å²	135	129.5 Å²	129.5	71%	0.707	75%	0.752	S	S	*	*			trans	-76.7	111	165.2	-69.8	176.1	0	0	0	107.9	T197 F201	T197-L199 PolarHBondContact O-N 3.24Å; L199-F201 HydrophobicContact CB-CD2 4.15Å; L199-F201 HydrophobicContact CB-CE2 3.59Å; L199-F201 HydrophobicContact CB-CZ 4.13Å; L199-F201 HydrophobicContact CD1-CE2 4.1Å; L199-F201 HydrophobicContact CD1-CZ 4.16Å; L199-F201 HydrophobicContact CG-CE2 4.48Å; L199-F201 PolarHBondContact O-N 3.48Å
200	N	39.3	Very low	43.8	Very low	138 Å²	138	133.9 Å²	133.9	74%	0.738	77%	0.766	S	S	*	*			trans	-81.8	96.4	178.8	-148.2	17.3	0	0	0	107.8	C198 N202	C198-N200 PolarHBondContact O-N 3.41Å; N200-N202 PolarHBondContact O-N 3.42Å
201	F	46.5	Very low	43.8	Very low	179 Å²	179	131.6 Å²	131.6	79%	0.785	77%	0.769	S	S	*	*			trans	-93.9	83	170.5	-66.7	-71.9	0	0	0	109	L199	L199-F201 HydrophobicContact CB-CD2 4.15Å; L199-F201 HydrophobicContact CB-CE2 3.59Å; L199-F201 HydrophobicContact CB-CZ 4.13Å; L199-F201 HydrophobicContact CD1-CE2 4.1Å; L199-F201 HydrophobicContact CD1-CZ 4.16Å; L199-F201 HydrophobicContact CG-CE2 4.48Å; L199-F201 PolarHBondContact O-N 3.48Å
202	N	41.8	Very low	43.6	Very low	122 Å²	122	133.3 Å²	133.3	65%	0.652	77%	0.773	S	S	*	*			trans	-69.1	130.1	158.5	-85.8	-26.5	0	0	0	108.5	N200	N200-N202 PolarHBondContact O-N 3.42Å
203	T	37.9	Very low	43.4	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	78%	0.778	S	S	*	*			trans	52.8	113.1	144.8	53.8	0	0	0	0	117.8
204	D	39.7	Very low	43.3	Very low	152 Å²	152	134.4 Å²	134.4	81%	0.813	78%	0.783	S	S	*	*				-179.8	110.2	109.4	-81.4	-25.4	0	0	0	110.6
205	L	39	Very low	43.1	Very low	171 Å²	171	135.8 Å²	135.8	90%	0.895	79%	0.786	S	S	*	*			trans	-73.3	134.8	161	-121.8	89.8	0	0	0	107.9
206	P	44	Very low	43.3	Very low	120 Å²	120	135.1 Å²	135.1	78%	0.779	79%	0.786	S	S	*	*			trans	-115.9	115.9	151	26.6	-11.2	0	0	0	110.3
207	S	35.2	Very low	43.1	Very low	101 Å²	101	134.7 Å²	134.7	71%	0.706	78%	0.784	S	S	*	*			trans	-63.3	161.6	157.6	61.4	0	0	0	0	111
208	S	40.5	Very low	43.4	Very low	121 Å²	121	134.1 Å²	134.1	85%	0.846	79%	0.785	S	S	*	*			trans	83.2	135.4	171	66.7	0	0	0	0	115.1
209	A	43.4	Very low	43.8	Very low	94 Å²	94	133.9 Å²	133.9	78%	0.777	78%	0.78	S	S	*	*			cis	-155.9	153.3	27.9	0	0	0	0	0	112.3
210	E	41.8	Very low	43.8	Very low	193 Å²	193	135.3 Å²	135.3	90%	0.902	79%	0.788	S	S	*	*			trans	-66.3	143.4	161	-57.2	-158.1	143.7	0	0	111
211	A	47.6	Very low	44.3	Very low	103 Å²	103	136.9 Å²	136.9	85%	0.851	79%	0.79	S	S	*	*			trans	-157	120.4	157.8	0	0	0	0	0	111.1
212	D	41.7	Very low	44.4	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	79%	0.792	S	S	*	*			trans	-63.9	152.3	176.1	-89.2	-45.5	0	0	0	115.6
213	S	39.2	Very low	45.7	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	79%	0.793	S	S	*	*			trans	24.6	133.1	144.8	74.4	0	0	0	0	122.4
214	S	46.8	Very low	46.7	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	82%	0.817	S	S	*	*				-174.2	142.2	117.3	55.4	0	0	0	0	113
215	N	44.2	Very low	47.1	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	82%	0.818	S	S	*	*			trans	-58.8	167.5	177.8	-71	-33.2	0	0	0	115.9
216	E	52.7	Low	47.5	Very low	176 Å²	176	144.1 Å²	144.1	82%	0.822	81%	0.814	S	S	*	*				178.5	99.2	126.5	-78.6	-52.6	89	0	0	107
217	D	43.6	Very low	47.7	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	82%	0.815	S	S	*	*				51.9	118.8	105.9	-161.9	23.1	0	0	0	117.8
218	S	55.6	Low	48.4	Very low	106 Å²	106	148 Å²	148	74%	0.741	82%	0.822	S	S	*	*			trans	179.7	109.7	139.5	-84.1	0	0	0	0	114.1
219	T	50.4	Low	48.9	Very low	115 Å²	115	149.7 Å²	149.7	71%	0.706	82%	0.82	S	S	*	*				82.1	95.4	127.2	-43.7	0	0	0	0	121.5
220	L	49.7	Very low	49.3	Very low	166 Å²	166	153.4 Å²	153.4	87%	0.869	82%	0.823	S	S	*	*				35.5	128.7	122.7	-67.2	164.1	0	0	0	121
221	H	48.6	Very low	49.8	Very low	171 Å²	171	150.6 Å²	150.6	79%	0.792	82%	0.818	S	S	*	*				172.5	124.4	97.2	-159.5	-27.9	0	0	0	112.1
222	E	50	Low	50	Low	177 Å²	177	154.2 Å²	154.2	83%	0.827	82%	0.815	S	S	*	*			trans	-133	137.9	158.7	-171.2	178.6	169.1	0	0	107.9
223	P	68.3	Low	50.7	Low	101 Å²	101	154 Å²	154	66%	0.656	81%	0.813	S	S	*	*			trans	-102.3	154.6	169.4	36.2	-26.3	0	0	0	112.1
224	R	59.2	Low	51.7	Low	319 Å²	319	158.4 Å²	158.4	100%	1.204	82%	0.82	S	S	*	*			trans	-56.5	0	-177.3	-161	-178.7	-167.2	160.2	3	116

Retrieved 224 of 224 residues in 56.8 ms (Link to these results)

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