G4VL86_SCHMA Loading...

Putative ank repeat-containing

AlphaFold DB , UniProt , Accession G4VL86, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 160 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	42	Very low	59.8	Low	242 Å²	242	117 Å²	117	100%	1.192	65%	0.645	S	S	*	*				0	122.4	0	-90.4	166.5	71.6	0	0	106.5
2	S	51	Low	61.8	Low	76 Å²	76	112.6 Å²	112.6	53%	0.531	62%	0.616	S	S	.	*			trans	-65	118	-165.7	35.5	0	0	0	0	113.2	D4 S5	S2-D4 PolarHBondContact O-N 3.26Å; S2-S5 PolarHBondContact O-OG 2.82Å
3	L	55	Low	63.4	Low	145 Å²	145	106.5 Å²	106.5	76%	0.759	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-22.8	164	-82.2	157.3	0	0	0	111.8	S5	L3-S5 VanDerWaalsContact C-N 3.29Å; L3-S5 PolarHBondContact O-N 3.35Å
4	D	53.8	Low	65.1	Low	129 Å²	129	108.8 Å²	108.8	69%	0.69	58%	0.576	S	S	*	*	H	α-helix	trans	-67.6	-23.5	-175.3	-55	-30.2	0	0	0	113.8	S2 T7	S2-D4 PolarHBondContact O-N 3.26Å; D4-T7 PolarHBondContact O-OG1 3.35Å; D4-T7 VanDerWaalsContact O-OG1 3.1Å
5	S	57.5	Low	66.8	Low	70 Å²	70	111.1 Å²	111.1	49%	0.49	57%	0.574	S	S	.	*	H	α-helix	trans	-81.7	-30.2	-176	54.9	0	0	0	0	114.4	S2 L3	S2-S5 PolarHBondContact O-OG 2.82Å; L3-S5 VanDerWaalsContact C-N 3.29Å; L3-S5 PolarHBondContact O-N 3.35Å
6	E	52.4	Low	68.2	Low	150 Å²	150	104.5 Å²	104.5	70%	0.701	54%	0.54	S	S	*	.	H	α-helix	trans	-78.6	-30.3	178.5	-71.3	-178.3	-176.3	0	0	112.1	D8 T10	E6-D8 VanDerWaalsContact C-N 3.33Å; E6-T10 WeakPolarHBondContact O-CG2 3.46Å; E6-T10 PolarHBondContact O-N 3.17Å; E6-T10 PolarHBondContact O-OG1 3.09Å; E6-T10 VanDerWaalsContact O-OG1 3.11Å
7	T	58.6	Low	69.6	Low	82 Å²	82	98.4 Å²	98.4	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-71.2	-27.9	177.8	50.7	0	0	0	0	113.2	D4 T10 T11	D4-T7 PolarHBondContact O-OG1 3.35Å; D4-T7 VanDerWaalsContact O-OG1 3.1Å; T7-T10 PolarHBondContact O-OG1 3.34Å; T7-T10 VanDerWaalsContact O-OG1 3.14Å; T7-T11 WeakPolarHBondContact O-CB 3.4Å; T7-T11 PolarHBondContact O-N 3Å; T7-T11 PolarHBondContact O-OG1 2.78Å
8	D	64.9	Low	70.9	Confident	118 Å²	118	97.8 Å²	97.8	63%	0.631	51%	0.506	S	S	*	.	H	α-helix	trans	-73.9	-47.7	-177.7	-162.8	42.2	0	0	0	111.4	E6 T10 T11 E12	E6-D8 VanDerWaalsContact C-N 3.33Å; D8-T10 PolarHBondContact O-N 3.36Å; D8-T11 PolarHBondContact O-N 3.43Å; D8-T11 VanDerWaalsContact O-N 3.16Å; D8-E12 PolarHBondContact O-N 2.84Å
9	D	65.2	Low	72.2	Confident	119 Å²	119	96.9 Å²	96.9	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-62.2	-44.3	179.9	-171.5	59.2	0	0	0	112.2	T11 E12 Q13	D9-T11 VanDerWaalsContact C-N 3.3Å; D9-T11 PolarHBondContact O-N 2.83Å; D9-E12 PolarHBondContact O-N 3.1Å; D9-Q13 WeakPolarHBondContact O-CB 3.47Å; D9-Q13 PolarHBondContact O-N 3.23Å
10	T	73.7	Confident	73.3	Confident	70 Å²	70	92.1 Å²	92.1	43%	0.429	47%	0.473	S	S	.	.	H	α-helix	trans	-64.3	-34.5	176.3	54.2	0	0	0	0	112.6	E6 T7 D8 R14	E6-T10 WeakPolarHBondContact O-CG2 3.46Å; E6-T10 PolarHBondContact O-N 3.17Å; E6-T10 PolarHBondContact O-OG1 3.09Å; E6-T10 VanDerWaalsContact O-OG1 3.11Å; T7-T10 PolarHBondContact O-OG1 3.34Å; T7-T10 VanDerWaalsContact O-OG1 3.14Å; D8-T10 PolarHBondContact O-N 3.36Å; T10-R14 WeakPolarHBondContact O-CB 3.45Å; T10-R14 WeakPolarHBondContact O-CD 3.27Å; T10-R14 WeakPolarHBondContact O-CG 3.5Å; T10-R14 PolarHBondContact O-N 3.22Å; T10-R14 VanDerWaalsContact O-N 3.15Å
11	T	83.8	Confident	74.4	Confident	86 Å²	86	89.9 Å²	89.9	53%	0.528	46%	0.459	S	S	.	.	H	α-helix	trans	-71.7	-43.1	178.6	-60.5	0	0	0	0	111.3	T7 D8 D9 R14 R15	T7-T11 WeakPolarHBondContact O-CB 3.4Å; T7-T11 PolarHBondContact O-N 3Å; T7-T11 PolarHBondContact O-OG1 2.78Å; D8-T11 PolarHBondContact O-N 3.43Å; D8-T11 VanDerWaalsContact O-N 3.16Å; D9-T11 VanDerWaalsContact C-N 3.3Å; D9-T11 PolarHBondContact O-N 2.83Å; T11-R14 PolarHBondContact O-N 2.63Å; T11-R15 WeakPolarHBondContact O-CB 3.47Å; T11-R15 PolarHBondContact O-N 3Å
12	E	84	Confident	77	Confident	64 Å²	64	82.2 Å²	82.2	30%	0.299	42%	0.422	S	S	.	.	H	α-helix	trans	-70.3	-41.6	179	-169.2	58.2	-151.9	0	0	111.6	D8 D9 R14 R15 I16	D8-E12 PolarHBondContact O-N 2.84Å; D9-E12 PolarHBondContact O-N 3.1Å; E12-R14 VanDerWaalsContact C-N 3.29Å; E12-R14 PolarHBondContact O-N 3.4Å; E12-R15 WeakPolarHBondContact O-CB 3.39Å; E12-R15 PolarHBondContact O-N 3.32Å; E12-R15 VanDerWaalsContact O-N 3.08Å; E12-R15 WeakPolarHBondContact OE2-CD 3.43Å; E12-R15 IonicContact OE2-NH1 2.94Å; E12-R15 PolarHBondContact OE2-NH1 3.03Å; E12-I16 HydrophobicContact CG-CD1 3.93Å; E12-I16 HydrophobicContact CG-CG1 4.42Å; E12-I16 WeakPolarHBondContact O-CG1 3.37Å; E12-I16 PolarHBondContact O-N 3.25Å; E12-I16 WeakPolarHBondContact OE1-CD1 3.46Å; E12-I16 WeakPolarHBondContact OE1-CG1 3.29Å
13	Q	82.9	Confident	79.2	Confident	33 Å²	33	78.8 Å²	78.8	15%	0.154	40%	0.398	C	S	.	.	H	α-helix	trans	-57.3	-43.1	173.9	-177	63.7	24.5	0	0	111.5	D9 I16 G17 D40	D9-Q13 WeakPolarHBondContact O-CB 3.47Å; D9-Q13 PolarHBondContact O-N 3.23Å; Q13-I16 PolarHBondContact O-N 3.03Å; Q13-G17 PolarHBondContact O-N 3.45Å; Q13-D40 PolarHBondContact NE2-O 3.46Å
14	R	87	Confident	81.2	Confident	139 Å²	139	71.9 Å²	71.9	53%	0.525	36%	0.362	S	S	.	.	H	α-helix	trans	-63	-43.4	174.7	-75.8	171.2	-172.6	-143.8	-7.5	112.1	T10 T11 E12 I16 G17 L18 E47	T10-R14 WeakPolarHBondContact O-CB 3.45Å; T10-R14 WeakPolarHBondContact O-CD 3.27Å; T10-R14 WeakPolarHBondContact O-CG 3.5Å; T10-R14 PolarHBondContact O-N 3.22Å; T10-R14 VanDerWaalsContact O-N 3.15Å; T11-R14 PolarHBondContact O-N 2.63Å; E12-R14 VanDerWaalsContact C-N 3.29Å; E12-R14 PolarHBondContact O-N 3.4Å; R14-I16 VanDerWaalsContact C-N 3.31Å; R14-I16 PolarHBondContact O-N 3.1Å; R14-G17 PolarHBondContact O-N 2.67Å; R14-L18 WeakPolarHBondContact O-CB 3.33Å; R14-L18 PolarHBondContact O-N 3.12Å; R14-E47 IonicContact CZ-OE1 3.45Å; R14-E47 IonicContact NH1-OE1 2.76Å; R14-E47 PolarHBondContact NH1-OE1 3.37Å; R14-E47 IonicContact NH2-OE1 3.81Å; R14-E47 PolarHBondContact NH2-OE1 3.39Å
15	R	90.1	Very high	83.3	Confident	143 Å²	143	67.1 Å²	67.1	54%	0.54	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-41.4	179.2	-173.3	-171.5	-176.9	-174.7	3.2	111.3	T11 E12 L18 K19	T11-R15 WeakPolarHBondContact O-CB 3.47Å; T11-R15 PolarHBondContact O-N 3Å; E12-R15 WeakPolarHBondContact O-CB 3.39Å; E12-R15 PolarHBondContact O-N 3.32Å; E12-R15 VanDerWaalsContact O-N 3.08Å; E12-R15 WeakPolarHBondContact OE2-CD 3.43Å; E12-R15 IonicContact OE2-NH1 2.94Å; E12-R15 PolarHBondContact OE2-NH1 3.03Å; R15-L18 PolarHBondContact O-N 3.09Å; R15-K19 WeakPolarHBondContact O-CG 3.4Å; R15-K19 PolarHBondContact O-N 3.2Å; R15-K19 VanDerWaalsContact O-N 3.07Å
16	I	89.3	Confident	85.2	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.031	34%	0.342	C	S	.	.	H	α-helix	trans	-75.7	-41.9	-178.8	-67.2	178.2	0	0	0	111.1	E12 Q13 R14 L18 K19 A20 F39	E12-I16 HydrophobicContact CG-CD1 3.93Å; E12-I16 HydrophobicContact CG-CG1 4.42Å; E12-I16 WeakPolarHBondContact O-CG1 3.37Å; E12-I16 PolarHBondContact O-N 3.25Å; E12-I16 WeakPolarHBondContact OE1-CD1 3.46Å; E12-I16 WeakPolarHBondContact OE1-CG1 3.29Å; Q13-I16 PolarHBondContact O-N 3.03Å; R14-I16 VanDerWaalsContact C-N 3.31Å; R14-I16 PolarHBondContact O-N 3.1Å; I16-L18 PolarHBondContact O-N 3.35Å; I16-K19 CarbonylContact O-C 3.54Å; I16-K19 WeakPolarHBondContact O-CB 3.19Å; I16-K19 PolarHBondContact O-N 2.88Å; I16-A20 WeakPolarHBondContact O-CB 3.46Å; I16-A20 PolarHBondContact O-N 2.99Å; I16-F39 HydrophobicContact CB-CG 4.36Å; I16-F39 HydrophobicContact CD1-CD1 3.64Å; I16-F39 HydrophobicContact CD1-CD2 3.33Å; I16-F39 HydrophobicContact CD1-CE1 3.32Å; I16-F39 HydrophobicContact CD1-CE2 3.02Å; I16-F39 HydrophobicContact CD1-CG 3.66Å; I16-F39 HydrophobicContact CD1-CZ 3.01Å; I16-F39 HydrophobicContact CG1-CD2 4.45Å; I16-F39 HydrophobicContact CG1-CE2 4.41Å; I16-F39 HydrophobicContact CG1-CZ 4.49Å; I16-F39 HydrophobicContact CG2-CB 3.99Å; I16-F39 HydrophobicContact CG2-CD1 4.47Å; I16-F39 HydrophobicContact CG2-CD2 3.82Å; I16-F39 HydrophobicContact CG2-CG 3.79Å
17	G	92	Very high	87.4	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58	-37.8	171.3	0	0	0	0	0	112.6	Q13 R14 A20 Y21 Y44	Q13-G17 PolarHBondContact O-N 3.45Å; R14-G17 PolarHBondContact O-N 2.67Å; G17-A20 PolarHBondContact O-N 2.65Å; G17-Y21 VanDerWaalsContact O-CB 3.26Å; G17-Y21 WeakPolarHBondContact O-CB 3.38Å; G17-Y21 PolarHBondContact O-N 3.22Å; G17-Y44 VanDerWaalsContact C-CZ 3.42Å; G17-Y44 VanDerWaalsContact CA-CD2 3.42Å
18	L	92.8	Very high	89.3	Confident	89 Å²	89	65.6 Å²	65.6	47%	0.466	32%	0.315	S	S	.	.	H	α-helix	trans	-64.5	-42.8	171.9	-179.7	61.1	0	0	0	112.4	R14 R15 I16 Y21 I22	R14-L18 WeakPolarHBondContact O-CB 3.33Å; R14-L18 PolarHBondContact O-N 3.12Å; R15-L18 PolarHBondContact O-N 3.09Å; I16-L18 PolarHBondContact O-N 3.35Å; L18-Y21 WeakPolarHBondContact O-CB 3.47Å; L18-Y21 PolarHBondContact O-N 2.96Å; L18-I22 HydrophobicContact CD1-CD1 4.2Å; L18-I22 HydrophobicContact CD1-CG1 4.43Å; L18-I22 HydrophobicContact CG-CD1 4.12Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.32Å; L18-I22 PolarHBondContact O-N 2.98Å
19	K	95.1	Very high	90.9	Very high	81 Å²	81	62.5 Å²	62.5	35%	0.352	30%	0.297	S	S	.	.	H	α-helix	trans	-61.7	-44.1	174.5	-69.2	169.4	-173.3	164.5	0	111.4	R15 I16 Y21 I22 A23 L35	R15-K19 WeakPolarHBondContact O-CG 3.4Å; R15-K19 PolarHBondContact O-N 3.2Å; R15-K19 VanDerWaalsContact O-N 3.07Å; I16-K19 CarbonylContact O-C 3.54Å; I16-K19 WeakPolarHBondContact O-CB 3.19Å; I16-K19 PolarHBondContact O-N 2.88Å; K19-Y21 VanDerWaalsContact C-N 3.33Å; K19-I22 PolarHBondContact O-N 3.35Å; K19-A23 WeakPolarHBondContact O-CB 3.38Å; K19-A23 PolarHBondContact O-N 3.3Å; K19-L35 HydrophobicContact CB-CD1 3.75Å; K19-L35 HydrophobicContact CB-CD2 4.31Å; K19-L35 HydrophobicContact CD-CD2 4.05Å
20	A	95.9	Very high	92.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.1	-41.2	176.7	0	0	0	0	0	111.2	I16 G17 A23 A24 L32 L36 I41 P53	I16-A20 WeakPolarHBondContact O-CB 3.46Å; I16-A20 PolarHBondContact O-N 2.99Å; G17-A20 PolarHBondContact O-N 2.65Å; A20-A23 PolarHBondContact O-N 3.39Å; A20-A24 VanDerWaalsContact O-CB 3.31Å; A20-A24 WeakPolarHBondContact O-CB 3.44Å; A20-A24 PolarHBondContact O-N 2.76Å; A20-L32 HydrophobicContact CB-CD1 3.63Å; A20-L36 HydrophobicContact CB-CD2 4.03Å; A20-I41 HydrophobicContact CB-CD1 3.85Å; A20-P53 HydrophobicContact CB-CG 3.98Å
21	Y	94.9	Very high	93.5	Very high	46 Å²	46	64 Å²	64	18%	0.18	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-47.6	175.3	-168.6	-90.1	0	0	0	111.5	G17 L18 K19 A24 I25 M51 A56	G17-Y21 VanDerWaalsContact O-CB 3.26Å; G17-Y21 WeakPolarHBondContact O-CB 3.38Å; G17-Y21 PolarHBondContact O-N 3.22Å; L18-Y21 WeakPolarHBondContact O-CB 3.47Å; L18-Y21 PolarHBondContact O-N 2.96Å; K19-Y21 VanDerWaalsContact C-N 3.33Å; Y21-A24 WeakPolarHBondContact O-CB 3.36Å; Y21-A24 PolarHBondContact O-N 3.48Å; Y21-I25 HydrophobicContact CD1-CD1 3.74Å; Y21-I25 HydrophobicContact CD1-CG1 4.38Å; Y21-I25 HydrophobicContact CE1-CD1 3.45Å; Y21-I25 VanDerWaalsContact CE1-CD1 3.45Å; Y21-I25 HydrophobicContact CE1-CG1 4.26Å; Y21-I25 WeakPolarHBondContact O-CG1 3.39Å; Y21-I25 PolarHBondContact O-N 3.48Å; Y21-M51 HydrophobicContact CE2-CB 4.12Å; Y21-A56 HydrophobicContact CD1-CB 4.49Å; Y21-A56 HydrophobicContact CD2-CB 3.95Å; Y21-A56 HydrophobicContact CE1-CB 4.22Å; Y21-A56 HydrophobicContact CE2-CB 3.62Å; Y21-A56 HydrophobicContact CG-CB 4.37Å
22	I	96.4	Very high	94.2	Very high	81 Å²	81	59.9 Å²	59.9	42%	0.415	27%	0.272	S	S	.	.	H	α-helix	trans	-63.1	-45.2	176.2	-68.2	167.1	0	0	0	111	L18 K19 A24 I25 Y26	L18-I22 HydrophobicContact CD1-CD1 4.2Å; L18-I22 HydrophobicContact CD1-CG1 4.43Å; L18-I22 HydrophobicContact CG-CD1 4.12Å; L18-I22 VanDerWaalsContact O-CG1 3.31Å; L18-I22 WeakPolarHBondContact O-CG1 3.32Å; L18-I22 PolarHBondContact O-N 2.98Å; K19-I22 PolarHBondContact O-N 3.35Å; I22-A24 VanDerWaalsContact C-N 3.27Å; I22-A24 PolarHBondContact O-N 3.36Å; I22-I25 PolarHBondContact O-N 3.25Å; I22-Y26 HydrophobicContact CG2-CD2 3.76Å; I22-Y26 HydrophobicContact CG2-CE2 3.88Å; I22-Y26 VanDerWaalsContact O-CD2 3.28Å; I22-Y26 WeakPolarHBondContact O-CD2 3.36Å; I22-Y26 PolarHBondContact O-N 3.03Å; I22-Y26 VanDerWaalsContact O-N 3.11Å
23	A	97.7	Very high	94.8	Very high	4 Å²	4	58.7 Å²	58.7	3%	0.033	27%	0.268	C	S	.	.	H	α-helix	trans	-60.4	-37.7	177.1	0	0	0	0	0	112.1	K19 A20 G27 H28 L32	K19-A23 WeakPolarHBondContact O-CB 3.38Å; K19-A23 PolarHBondContact O-N 3.3Å; A20-A23 PolarHBondContact O-N 3.39Å; A23-G27 PolarHBondContact O-N 3.29Å; A23-G27 VanDerWaalsContact O-N 3.08Å; A23-H28 HydrophobicContact CB-CB 4.21Å; A23-H28 PolarHBondContact O-N 3.02Å; A23-L32 HydrophobicContact CB-CB 4.08Å; A23-L32 HydrophobicContact CB-CD1 4.38Å
24	A	98	Very high	95.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.7	-36.7	175.5	0	0	0	0	0	113.3	A20 Y21 I22 L32 P53 A56 A57 N62 L69	A20-A24 VanDerWaalsContact O-CB 3.31Å; A20-A24 WeakPolarHBondContact O-CB 3.44Å; A20-A24 PolarHBondContact O-N 2.76Å; Y21-A24 WeakPolarHBondContact O-CB 3.36Å; Y21-A24 PolarHBondContact O-N 3.48Å; I22-A24 VanDerWaalsContact C-N 3.27Å; I22-A24 PolarHBondContact O-N 3.36Å; A24-L32 HydrophobicContact CB-CD2 4.35Å; A24-P53 HydrophobicContact CB-CB 3.86Å; A24-P53 WeakPolarHBondContact CB-O 3.48Å; A24-A56 HydrophobicContact CB-CB 4.37Å; A24-A57 HydrophobicContact CB-CB 4.06Å; A24-N62 PolarHBondContact O-ND2 3.02Å; A24-L69 HydrophobicContact CB-CD1 4.48Å
25	I	97.6	Very high	95.7	Very high	28 Å²	28	59.3 Å²	59.3	14%	0.144	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-46	174	-71.7	177.6	0	0	0	111.1	Y21 I22 G27 A56 W60 N62	Y21-I25 HydrophobicContact CD1-CD1 3.74Å; Y21-I25 HydrophobicContact CD1-CG1 4.38Å; Y21-I25 HydrophobicContact CE1-CD1 3.45Å; Y21-I25 VanDerWaalsContact CE1-CD1 3.45Å; Y21-I25 HydrophobicContact CE1-CG1 4.26Å; Y21-I25 WeakPolarHBondContact O-CG1 3.39Å; Y21-I25 PolarHBondContact O-N 3.48Å; I22-I25 PolarHBondContact O-N 3.25Å; I25-G27 VanDerWaalsContact C-N 3.34Å; I25-A56 HydrophobicContact CG1-CB 3.85Å; I25-W60 HydrophobicContact CB-CG 4.38Å; I25-W60 HydrophobicContact CG1-CG 4.41Å; I25-W60 HydrophobicContact CG2-CD2 3.89Å; I25-W60 HydrophobicContact CG2-CG 3.93Å; I25-W60 HydrophobicContact CG2-CZ2 4.47Å; I25-W60 WeakPolarHBondContact O-CB 3.37Å; I25-N62 PolarHBondContact O-ND2 2.65Å
26	Y	98	Very high	95.9	Very high	157 Å²	157	52.7 Å²	52.7	62%	0.616	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	8.6	-174.4	-64.5	-67.2	0	0	0	114.1	I22 H28	I22-Y26 HydrophobicContact CG2-CD2 3.76Å; I22-Y26 HydrophobicContact CG2-CE2 3.88Å; I22-Y26 VanDerWaalsContact O-CD2 3.28Å; I22-Y26 WeakPolarHBondContact O-CD2 3.36Å; I22-Y26 PolarHBondContact O-N 3.03Å; I22-Y26 VanDerWaalsContact O-N 3.11Å; Y26-H28 VanDerWaalsContact C-N 3.27Å; Y26-H28 PolarHBondContact O-CE1 2.9Å; Y26-H28 PolarHBondContact O-N 3.39Å; Y26-H28 PolarHBondContact O-ND1 3.08Å
27	G	97.6	Very high	96.1	Very high	20 Å²	20	57.8 Å²	57.8	21%	0.206	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	19.4	175.1	0	0	0	0	0	114.6	A23 I25 H29 N62 C65	A23-G27 PolarHBondContact O-N 3.29Å; A23-G27 VanDerWaalsContact O-N 3.08Å; I25-G27 VanDerWaalsContact C-N 3.34Å; G27-H29 PolarHBondContact O-N 3.13Å; G27-N62 VanDerWaalsContact CA-CG 3.42Å; G27-N62 WeakPolarHBondContact CA-OD1 3.38Å; G27-N62 PolarHBondContact N-ND2 2.81Å; G27-C65 VanDerWaalsContact C-SG 3.53Å; G27-C65 VanDerWaalsContact CA-SG 3.58Å
28	H	98.3	Very high	95.9	Very high	94 Å²	94	65.1 Å²	65.1	44%	0.435	31%	0.312	S	S	.	.			trans	-80.7	62.3	-176.5	-64.1	-0.2	0	0	0	111.5	A23 Y26 E30 I31 L32	A23-H28 HydrophobicContact CB-CB 4.21Å; A23-H28 PolarHBondContact O-N 3.02Å; Y26-H28 VanDerWaalsContact C-N 3.27Å; Y26-H28 PolarHBondContact O-CE1 2.9Å; Y26-H28 PolarHBondContact O-N 3.39Å; Y26-H28 PolarHBondContact O-ND1 3.08Å; H28-E30 VanDerWaalsContact C-N 3.28Å; H28-E30 PolarHBondContact O-N 3.23Å; H28-I31 HydrophobicContact CB-CB 4.15Å; H28-I31 HydrophobicContact CB-CD1 4.13Å; H28-I31 HydrophobicContact CB-CG1 4.35Å; H28-I31 PolarHBondContact O-N 3.25Å; H28-I31 VanDerWaalsContact O-N 3.1Å; H28-L32 WeakPolarHBondContact O-CB 3.47Å; H28-L32 PolarHBondContact O-N 3.11Å
29	H	98	Very high	95.6	Very high	53 Å²	53	63.5 Å²	63.5	25%	0.245	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-31.9	-171.5	68.4	82.8	0	0	0	114	G27 D33 K64 V68	G27-H29 PolarHBondContact O-N 3.13Å; H29-D33 WeakPolarHBondContact O-CB 3.41Å; H29-D33 PolarHBondContact O-N 3.07Å; H29-K64 HydrophobicContact CB-CB 3.94Å; H29-K64 VanDerWaalsContact CD2-CD 3.44Å; H29-K64 WeakPolarHBondContact CD2-CD 3.32Å; H29-K64 WeakPolarHBondContact NE2-CD 3.42Å; H29-V68 HydrophobicContact CB-CG2 4.13Å
30	E	97.9	Very high	95.4	Very high	127 Å²	127	63.5 Å²	63.5	59%	0.593	31%	0.305	S	S	*	.	H	α-helix	trans	-71.8	-36.5	177	-60.1	-179.6	177.7	0	0	112.8	H28 K34	H28-E30 VanDerWaalsContact C-N 3.28Å; H28-E30 PolarHBondContact O-N 3.23Å; E30-K34 WeakPolarHBondContact O-CG 3.41Å; E30-K34 PolarHBondContact O-N 3.41Å
31	I	96.8	Very high	95.1	Very high	92 Å²	92	63.6 Å²	63.6	47%	0.472	31%	0.305	S	S	.	.	H	α-helix	trans	-70.8	-43.3	174.6	-62.6	178.2	0	0	0	108.8	H28 D33 K34 L35	H28-I31 HydrophobicContact CB-CB 4.15Å; H28-I31 HydrophobicContact CB-CD1 4.13Å; H28-I31 HydrophobicContact CB-CG1 4.35Å; H28-I31 PolarHBondContact O-N 3.25Å; H28-I31 VanDerWaalsContact O-N 3.1Å; I31-D33 VanDerWaalsContact C-N 3.33Å; I31-D33 PolarHBondContact O-N 3.24Å; I31-K34 PolarHBondContact O-N 3.3Å; I31-L35 HydrophobicContact CG2-CD1 3.93Å; I31-L35 HydrophobicContact CG2-CG 4.32Å; I31-L35 VanDerWaalsContact O-CG 3.28Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.34Å
32	L	97.3	Very high	94.9	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-55.3	-50.7	175	-176.1	57.7	0	0	0	110.3	A20 A23 A24 H28 K34 L35 L36 C65 V68 L69	A20-L32 HydrophobicContact CB-CD1 3.63Å; A23-L32 HydrophobicContact CB-CB 4.08Å; A23-L32 HydrophobicContact CB-CD1 4.38Å; A24-L32 HydrophobicContact CB-CD2 4.35Å; H28-L32 WeakPolarHBondContact O-CB 3.47Å; H28-L32 PolarHBondContact O-N 3.11Å; L32-K34 PolarHBondContact O-N 2.89Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 2.98Å; L32-L35 VanDerWaalsContact O-N 3.09Å; L32-L36 HydrophobicContact CD1-CD1 4.03Å; L32-L36 HydrophobicContact CD1-CD2 4.34Å; L32-L36 HydrophobicContact CD1-CG 4.11Å; L32-L36 HydrophobicContact CG-CD1 4.17Å; L32-L36 HydrophobicContact CG-CG 4.48Å; L32-L36 VanDerWaalsContact O-CG 3.29Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 3.01Å; L32-L36 VanDerWaalsContact O-N 3.08Å; L32-C65 HydrophobicContact CD2-CB 3.75Å; L32-V68 HydrophobicContact CB-CG1 4.47Å; L32-V68 HydrophobicContact CD2-CB 4.49Å; L32-V68 HydrophobicContact CD2-CG1 4.32Å; L32-V68 HydrophobicContact CG-CG1 4.03Å; L32-L69 HydrophobicContact CD1-CD2 4.33Å; L32-L69 HydrophobicContact CD2-CD1 4.05Å; L32-L69 HydrophobicContact CD2-CD2 4.24Å; L32-L69 HydrophobicContact CD2-CG 3.85Å
33	D	97.1	Very high	94.3	Very high	40 Å²	40	66.4 Å²	66.4	21%	0.214	33%	0.326	C	S	.	.	H	α-helix	trans	-55.6	-49.6	-179.6	-158.4	28.2	0	0	0	112.5	H29 I31 L35 L36 D37 V68 R71 H72	H29-D33 WeakPolarHBondContact O-CB 3.41Å; H29-D33 PolarHBondContact O-N 3.07Å; I31-D33 VanDerWaalsContact C-N 3.33Å; I31-D33 PolarHBondContact O-N 3.24Å; D33-L35 VanDerWaalsContact C-N 3.3Å; D33-L35 PolarHBondContact O-N 3.23Å; D33-L36 PolarHBondContact O-N 2.94Å; D33-L36 VanDerWaalsContact O-N 3.1Å; D33-D37 PolarHBondContact O-N 3.44Å; D33-D37 VanDerWaalsContact O-N 3.09Å; D33-V68 HydrophobicContact CB-CG1 3.9Å; D33-V68 HydrophobicContact CB-CG2 4.39Å; D33-R71 IonicContact OD1-CZ 3.62Å; D33-R71 IonicContact OD1-NH2 2.65Å; D33-R71 PolarHBondContact OD1-NH2 2.96Å; D33-R71 IonicContact OD2-CZ 3.73Å; D33-R71 IonicContact OD2-NH2 2.67Å; D33-R71 PolarHBondContact OD2-NH2 3.46Å; D33-H72 IonicContact OD1-CD2 3.61Å; D33-H72 IonicContact OD1-NE2 2.88Å; D33-H72 PolarHBondContact OD1-NE2 3.48Å
34	K	95.7	Very high	93.9	Very high	147 Å²	147	67.3 Å²	67.3	64%	0.639	33%	0.329	S	S	*	.	H	α-helix	trans	-62.2	-34.8	177.4	-70.3	174.4	-178.4	174.9	0	113.4	E30 I31 L32 L36	E30-K34 WeakPolarHBondContact O-CG 3.41Å; E30-K34 PolarHBondContact O-N 3.41Å; I31-K34 PolarHBondContact O-N 3.3Å; L32-K34 PolarHBondContact O-N 2.89Å; K34-L36 VanDerWaalsContact C-N 3.3Å
35	L	94.2	Very high	93.6	Very high	37 Å²	37	70.5 Å²	70.5	19%	0.194	35%	0.351	C	S	.	.	H	α-helix	trans	-69.2	-31.7	177	-73.5	169.2	0	0	0	111.7	K19 I31 L32 D33	K19-L35 HydrophobicContact CB-CD1 3.75Å; K19-L35 HydrophobicContact CB-CD2 4.31Å; K19-L35 HydrophobicContact CD-CD2 4.05Å; I31-L35 HydrophobicContact CG2-CD1 3.93Å; I31-L35 HydrophobicContact CG2-CG 4.32Å; I31-L35 VanDerWaalsContact O-CG 3.28Å; I31-L35 WeakPolarHBondContact O-CG 3.4Å; I31-L35 PolarHBondContact O-N 3.34Å; L32-L35 WeakPolarHBondContact O-CB 3.49Å; L32-L35 PolarHBondContact O-N 2.98Å; L32-L35 VanDerWaalsContact O-N 3.09Å; D33-L35 VanDerWaalsContact C-N 3.3Å; D33-L35 PolarHBondContact O-N 3.23Å
36	L	94.4	Very high	93.2	Very high	5 Å²	5	71.7 Å²	71.7	3%	0.026	36%	0.358	C	S	.	.	H	α-helix	trans	-88.1	-19	-175.8	-59.3	-169.9	0	0	0	113.5	A20 L32 D33 K34 E38 F39 I41 V68 L69 H72	A20-L36 HydrophobicContact CB-CD2 4.03Å; L32-L36 HydrophobicContact CD1-CD1 4.03Å; L32-L36 HydrophobicContact CD1-CD2 4.34Å; L32-L36 HydrophobicContact CD1-CG 4.11Å; L32-L36 HydrophobicContact CG-CD1 4.17Å; L32-L36 HydrophobicContact CG-CG 4.48Å; L32-L36 VanDerWaalsContact O-CG 3.29Å; L32-L36 WeakPolarHBondContact O-CG 3.46Å; L32-L36 PolarHBondContact O-N 3.01Å; L32-L36 VanDerWaalsContact O-N 3.08Å; D33-L36 PolarHBondContact O-N 2.94Å; D33-L36 VanDerWaalsContact O-N 3.1Å; K34-L36 VanDerWaalsContact C-N 3.3Å; L36-E38 PolarHBondContact O-N 3.43Å; L36-E38 VanDerWaalsContact O-N 3.12Å; L36-F39 PolarHBondContact O-N 3.31Å; L36-F39 VanDerWaalsContact O-O 3.05Å; L36-I41 HydrophobicContact CD1-CB 4.26Å; L36-I41 HydrophobicContact CD1-CG1 4.5Å; L36-I41 HydrophobicContact CD1-CG2 4.11Å; L36-I41 HydrophobicContact CD2-CB 3.66Å; L36-I41 HydrophobicContact CD2-CD1 3.81Å; L36-I41 HydrophobicContact CD2-CG1 3.81Å; L36-I41 HydrophobicContact CD2-CG2 4.41Å; L36-V68 HydrophobicContact CD1-CG1 4.35Å; L36-L69 HydrophobicContact CD1-CD2 3.72Å; L36-H72 HydrophobicContact CB-CB 4.22Å; L36-H72 HydrophobicContact CD1-CB 3.84Å
37	D	93.3	Very high	92.7	Very high	112 Å²	112	70.7 Å²	70.7	60%	0.599	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-27.2	173.8	-75.2	-23.8	0	0	0	113.2	D33 H72	D33-D37 PolarHBondContact O-N 3.44Å; D33-D37 VanDerWaalsContact O-N 3.09Å; D37-H72 IonicContact OD1-CE1 3.45Å; D37-H72 PolarHBondContact OD1-CE1 2.61Å; D37-H72 IonicContact OD1-NE2 3.87Å
38	E	87.2	Confident	92.4	Very high	154 Å²	154	77 Å²	77	72%	0.72	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-9	-176.9	-64.9	177	-166.3	0	0	113.1	L36	L36-E38 PolarHBondContact O-N 3.43Å; L36-E38 VanDerWaalsContact O-N 3.12Å
39	F	86.9	Confident	92.1	Very high	56 Å²	56	75 Å²	75	25%	0.246	38%	0.382	C	S	.	.	S	Bend	trans	-143.2	131.9	-168.3	-66.9	-86.1	0	0	0	113.1	I16 L36 I41	I16-F39 HydrophobicContact CB-CG 4.36Å; I16-F39 HydrophobicContact CD1-CD1 3.64Å; I16-F39 HydrophobicContact CD1-CD2 3.33Å; I16-F39 HydrophobicContact CD1-CE1 3.32Å; I16-F39 HydrophobicContact CD1-CE2 3.02Å; I16-F39 HydrophobicContact CD1-CG 3.66Å; I16-F39 HydrophobicContact CD1-CZ 3.01Å; I16-F39 HydrophobicContact CG1-CD2 4.45Å; I16-F39 HydrophobicContact CG1-CE2 4.41Å; I16-F39 HydrophobicContact CG1-CZ 4.49Å; I16-F39 HydrophobicContact CG2-CB 3.99Å; I16-F39 HydrophobicContact CG2-CD1 4.47Å; I16-F39 HydrophobicContact CG2-CD2 3.82Å; I16-F39 HydrophobicContact CG2-CG 3.79Å; L36-F39 PolarHBondContact O-N 3.31Å; L36-F39 VanDerWaalsContact O-O 3.05Å; F39-I41 PolarHBondContact O-N 2.95Å; F39-I41 VanDerWaalsContact O-N 3.1Å
40	D	89.9	Confident	92	Very high	80 Å²	80	73 Å²	73	43%	0.428	38%	0.376	S	S	.	.			trans	-73.5	104.1	173.1	-173.5	-9	0	0	0	110.3	Q13 T42 L43	Q13-D40 PolarHBondContact NE2-O 3.46Å; D40-T42 VanDerWaalsContact CG-OG1 3.23Å; D40-T42 PolarHBondContact O-N 3.22Å; D40-T42 VanDerWaalsContact OD1-CB 3.27Å; D40-T42 WeakPolarHBondContact OD1-CB 3.4Å; D40-T42 WeakPolarHBondContact OD1-CG2 3.39Å; D40-T42 PolarHBondContact OD1-N 3.36Å; D40-T42 PolarHBondContact OD1-OG1 3.11Å; D40-T42 PolarHBondContact OD2-OG1 2.92Å; D40-L43 HydrophobicContact CB-CD1 4.18Å; D40-L43 HydrophobicContact CB-CG 4.21Å; D40-L43 PolarHBondContact O-N 3.24Å
41	I	90.6	Very high	91.9	Very high	2 Å²	2	68.2 Å²	68.2	1%	0.01	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-70	-18	-179.2	-161	55	0	0	0	113.3	A20 L36 F39 L43 Y44 M52 P53 L69 H72 C74	A20-I41 HydrophobicContact CB-CD1 3.85Å; L36-I41 HydrophobicContact CD1-CB 4.26Å; L36-I41 HydrophobicContact CD1-CG1 4.5Å; L36-I41 HydrophobicContact CD1-CG2 4.11Å; L36-I41 HydrophobicContact CD2-CB 3.66Å; L36-I41 HydrophobicContact CD2-CD1 3.81Å; L36-I41 HydrophobicContact CD2-CG1 3.81Å; L36-I41 HydrophobicContact CD2-CG2 4.41Å; F39-I41 PolarHBondContact O-N 2.95Å; F39-I41 VanDerWaalsContact O-N 3.1Å; I41-L43 PolarHBondContact O-N 3.11Å; I41-Y44 PolarHBondContact O-N 3.14Å; I41-Y44 VanDerWaalsContact O-N 3.11Å; I41-M52 WeakPolarHBondContact O-CE 3.41Å; I41-P53 HydrophobicContact CD1-CG 3.84Å; I41-P53 HydrophobicContact CG1-CG 3.94Å; I41-L69 HydrophobicContact CG1-CD2 4.22Å; I41-L69 HydrophobicContact CG2-CD2 4.39Å; I41-H72 HydrophobicContact CG2-CB 4.43Å; I41-C74 WeakPolarHBondContact CG2-SG 3.44Å
42	T	89.2	Confident	91.9	Very high	61 Å²	61	64.2 Å²	64.2	37%	0.374	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-68.6	-18	-179.4	72.8	0	0	0	0	112.4	D40	D40-T42 VanDerWaalsContact CG-OG1 3.23Å; D40-T42 PolarHBondContact O-N 3.22Å; D40-T42 VanDerWaalsContact OD1-CB 3.27Å; D40-T42 WeakPolarHBondContact OD1-CB 3.4Å; D40-T42 WeakPolarHBondContact OD1-CG2 3.39Å; D40-T42 PolarHBondContact OD1-N 3.36Å; D40-T42 PolarHBondContact OD1-OG1 3.11Å; D40-T42 PolarHBondContact OD2-OG1 2.92Å
43	L	85.2	Confident	91.9	Very high	125 Å²	125	64.2 Å²	64.2	65%	0.654	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-85.3	-6.6	175.9	-55.1	-177.3	0	0	0	113.5	D40 I41	D40-L43 HydrophobicContact CB-CD1 4.18Å; D40-L43 HydrophobicContact CB-CG 4.21Å; D40-L43 PolarHBondContact O-N 3.24Å; I41-L43 PolarHBondContact O-N 3.11Å
44	Y	89.1	Confident	91.9	Very high	24 Å²	24	62.3 Å²	62.3	9%	0.094	32%	0.323	C	S	.	.			trans	-100.1	130.2	-179.8	177.3	-93.8	0	0	0	111.9	G17 I41 M52 P53	G17-Y44 VanDerWaalsContact C-CZ 3.42Å; G17-Y44 VanDerWaalsContact CA-CD2 3.42Å; I41-Y44 PolarHBondContact O-N 3.14Å; I41-Y44 VanDerWaalsContact O-N 3.11Å; Y44-M52 WeakPolarHBondContact O-CE 3.32Å; Y44-M52 VanDerWaalsContact O-CG 3.28Å; Y44-M52 WeakPolarHBondContact O-CG 3.44Å; Y44-P53 HydrophobicContact CD1-CG 4.44Å
45	S	91	Very high	92.1	Very high	67 Å²	67	55.3 Å²	55.3	47%	0.469	29%	0.292	S	S	.	.			trans	-145.5	150	162.5	57.2	0	0	0	0	109.8	E47 M51	S45-E47 PolarHBondContact O-N 3.5Å; S45-M51 CarbonylContact C-O 3.4Å; S45-M51 WeakPolarHBondContact CA-O 3.36Å
46	D	90.3	Very high	92.3	Very high	53 Å²	53	53.6 Å²	53.6	28%	0.283	28%	0.283	S	S	.	.			trans	-66.2	127.7	170.5	173.8	75.7	0	0	0	109.8	L48 T49 G50 M51	D46-L48 PolarHBondContact O-N 3.45Å; D46-L48 PolarHBondContact OD2-N 3.1Å; D46-T49 WeakPolarHBondContact CB-OG1 3.31Å; D46-T49 PolarHBondContact O-N 2.96Å; D46-T49 WeakPolarHBondContact OD2-CB 3.34Å; D46-T49 PolarHBondContact OD2-N 3.08Å; D46-T49 PolarHBondContact OD2-OG1 3.39Å; D46-G50 VanDerWaalsContact O-CA 3.23Å; D46-G50 WeakPolarHBondContact O-CA 3.17Å; D46-G50 PolarHBondContact O-N 3.09Å; D46-M51 HydrophobicContact CB-CB 4.5Å; D46-M51 PolarHBondContact N-O 3.36Å
47	E	87.3	Confident	92.5	Very high	136 Å²	136	53.4 Å²	53.4	64%	0.636	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-29.3	-172.5	-62.9	-176.1	160.5	0	0	113.5	R14 S45	R14-E47 IonicContact CZ-OE1 3.45Å; R14-E47 IonicContact NH1-OE1 2.76Å; R14-E47 PolarHBondContact NH1-OE1 3.37Å; R14-E47 IonicContact NH2-OE1 3.81Å; R14-E47 PolarHBondContact NH2-OE1 3.39Å; S45-E47 PolarHBondContact O-N 3.5Å
48	L	90.3	Very high	92.7	Very high	151 Å²	151	48 Å²	48	79%	0.791	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-39.6	-174.4	-62.9	177.7	0	0	0	111.9	D46	D46-L48 PolarHBondContact O-N 3.45Å; D46-L48 PolarHBondContact OD2-N 3.1Å
49	T	93	Very high	93.3	Very high	54 Å²	54	41 Å²	41	33%	0.331	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-15.2	-170.9	61.7	0	0	0	0	113.3	D46 M51 D80 S81	D46-T49 WeakPolarHBondContact CB-OG1 3.31Å; D46-T49 PolarHBondContact O-N 2.96Å; D46-T49 WeakPolarHBondContact OD2-CB 3.34Å; D46-T49 PolarHBondContact OD2-N 3.08Å; D46-T49 PolarHBondContact OD2-OG1 3.39Å; T49-M51 PolarHBondContact O-N 3.33Å; T49-M51 VanDerWaalsContact OG1-CB 3.3Å; T49-M51 WeakPolarHBondContact OG1-CB 3.3Å; T49-M51 VanDerWaalsContact OG1-CG 3.32Å; T49-M51 WeakPolarHBondContact OG1-CG 3.47Å; T49-M51 PolarHBondContact OG1-N 2.99Å; T49-D80 WeakPolarHBondContact O-CB 3.35Å; T49-S81 VanDerWaalsContact C-OG 3.31Å; T49-S81 VanDerWaalsContact O-CB 3.24Å; T49-S81 WeakPolarHBondContact O-CB 3.45Å; T49-S81 PolarHBondContact O-N 2.88Å; T49-S81 PolarHBondContact O-OG 3.33Å
50	G	94.7	Very high	93.8	Very high	11 Å²	11	45.5 Å²	45.5	11%	0.113	24%	0.237	C	C	.	.			trans	66.3	9.9	-168.8	0	0	0	0	0	112.8	D46 S81	D46-G50 VanDerWaalsContact O-CA 3.23Å; D46-G50 WeakPolarHBondContact O-CA 3.17Å; D46-G50 PolarHBondContact O-N 3.09Å; G50-S81 VanDerWaalsContact CA-OG 3.28Å; G50-S81 WeakPolarHBondContact CA-OG 3.24Å; G50-S81 PolarHBondContact N-OG 2.81Å
51	M	96.2	Very high	94.2	Very high	25 Å²	25	42.6 Å²	42.6	12%	0.123	23%	0.226	C	C	.	.			trans	-70.5	149.2	-178.2	-72.1	-176.2	76.1	0	0	111	Y21 S45 D46 T49 H55 D80	Y21-M51 HydrophobicContact CE2-CB 4.12Å; S45-M51 CarbonylContact C-O 3.4Å; S45-M51 WeakPolarHBondContact CA-O 3.36Å; D46-M51 HydrophobicContact CB-CB 4.5Å; D46-M51 PolarHBondContact N-O 3.36Å; T49-M51 PolarHBondContact O-N 3.33Å; T49-M51 VanDerWaalsContact OG1-CB 3.3Å; T49-M51 WeakPolarHBondContact OG1-CB 3.3Å; T49-M51 VanDerWaalsContact OG1-CG 3.32Å; T49-M51 WeakPolarHBondContact OG1-CG 3.47Å; T49-M51 PolarHBondContact OG1-N 2.99Å; M51-H55 HydrophobicContact CB-CB 4.31Å; M51-H55 HydrophobicContact CE-CB 3.67Å; M51-H55 HydrophobicContact CG-CB 4.27Å; M51-D80 HydrophobicContact CG-CB 4.2Å
52	M	96.8	Very high	94.6	Very high	9 Å²	9	44.1 Å²	44.1	4%	0.044	23%	0.234	C	C	.	.			trans	-128.5	163.2	-179	-63.2	-176.1	65.8	0	0	106.5	I41 Y44 I54 H55 A56 Q78	I41-M52 WeakPolarHBondContact O-CE 3.41Å; Y44-M52 WeakPolarHBondContact O-CE 3.32Å; Y44-M52 VanDerWaalsContact O-CG 3.28Å; Y44-M52 WeakPolarHBondContact O-CG 3.44Å; M52-I54 HydrophobicContact CB-CG2 4.14Å; M52-I54 PolarHBondContact O-N 3.38Å; M52-H55 PolarHBondContact N-ND1 3.1Å; M52-H55 WeakPolarHBondContact O-CB 3.14Å; M52-H55 PolarHBondContact O-N 3.27Å; M52-A56 PolarHBondContact O-N 3.16Å; M52-Q78 HydrophobicContact SD-CG 3.48Å; M52-Q78 WeakPolarHBondContact SD-CG 3.47Å
53	P	97.3	Very high	95	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-54.9	-26.5	177.8	-26.8	34.3	0	0	0	113.7	A20 A24 I41 Y44 A56 A57 L69	A20-P53 HydrophobicContact CB-CG 3.98Å; A24-P53 HydrophobicContact CB-CB 3.86Å; A24-P53 WeakPolarHBondContact CB-O 3.48Å; I41-P53 HydrophobicContact CD1-CG 3.84Å; I41-P53 HydrophobicContact CG1-CG 3.94Å; Y44-P53 HydrophobicContact CD1-CG 4.44Å; P53-A56 PolarHBondContact O-N 2.98Å; P53-A57 WeakPolarHBondContact O-CB 3.31Å; P53-A57 PolarHBondContact O-N 3.33Å; P53-L69 HydrophobicContact CB-CD1 3.99Å; P53-L69 HydrophobicContact CB-CD2 3.77Å; P53-L69 HydrophobicContact CG-CD2 4.49Å
54	I	98.4	Very high	95.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.9	-37.1	175.2	-162	177.2	0	0	0	112.6	M52 A58 L66 L69 I70 C74 N75 Q78 P86	M52-I54 HydrophobicContact CB-CG2 4.14Å; M52-I54 PolarHBondContact O-N 3.38Å; I54-A58 WeakPolarHBondContact O-CB 3.42Å; I54-A58 PolarHBondContact O-N 3.49Å; I54-A58 VanDerWaalsContact O-N 3.16Å; I54-L66 HydrophobicContact CD1-CD2 4.45Å; I54-L66 HydrophobicContact CG1-CD2 3.51Å; I54-L66 WeakPolarHBondContact O-CD2 3.4Å; I54-L69 HydrophobicContact CB-CB 4.49Å; I54-L69 HydrophobicContact CB-CD1 4.1Å; I54-I70 HydrophobicContact CD1-CG1 4.1Å; I54-C74 HydrophobicContact CB-CB 4.41Å; I54-C74 HydrophobicContact CD1-CB 3.87Å; I54-N75 VanDerWaalsContact CD1-O 3.31Å; I54-N75 WeakPolarHBondContact CD1-O 3.46Å; I54-Q78 HydrophobicContact CG2-CB 4.12Å; I54-Q78 HydrophobicContact CG2-CG 4.41Å; I54-P86 HydrophobicContact CB-CG 4.47Å; I54-P86 HydrophobicContact CD1-CG 4.02Å; I54-P86 HydrophobicContact CG1-CB 4.48Å; I54-P86 HydrophobicContact CG1-CG 3.84Å; I54-P86 HydrophobicContact CG2-CG 4.09Å
55	H	98.6	Very high	96.1	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-65.2	-42.7	172.1	-57.1	120.7	0	0	0	110.5	M51 M52 A58 A59 Q78 D80 C84	M51-H55 HydrophobicContact CB-CB 4.31Å; M51-H55 HydrophobicContact CE-CB 3.67Å; M51-H55 HydrophobicContact CG-CB 4.27Å; M52-H55 PolarHBondContact N-ND1 3.1Å; M52-H55 WeakPolarHBondContact O-CB 3.14Å; M52-H55 PolarHBondContact O-N 3.27Å; H55-A58 PolarHBondContact O-N 3.46Å; H55-A59 VanDerWaalsContact O-CB 3.27Å; H55-A59 WeakPolarHBondContact O-CB 3.18Å; H55-A59 PolarHBondContact O-N 2.88Å; H55-Q78 PolarHBondContact NE2-O 3.39Å; H55-D80 PolarHBondContact NE2-N 3.5Å; H55-C84 PolarHBondContact NE2-O 2.92Å
56	A	97.9	Very high	96.5	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-66.2	-45.6	178.8	0	0	0	0	0	113	Y21 A24 I25 M52 P53 A58 A59 W60	Y21-A56 HydrophobicContact CD1-CB 4.49Å; Y21-A56 HydrophobicContact CD2-CB 3.95Å; Y21-A56 HydrophobicContact CE1-CB 4.22Å; Y21-A56 HydrophobicContact CE2-CB 3.62Å; Y21-A56 HydrophobicContact CG-CB 4.37Å; A24-A56 HydrophobicContact CB-CB 4.37Å; I25-A56 HydrophobicContact CG1-CB 3.85Å; M52-A56 PolarHBondContact O-N 3.16Å; P53-A56 PolarHBondContact O-N 2.98Å; A56-A58 VanDerWaalsContact C-N 3.25Å; A56-A58 PolarHBondContact O-N 3.02Å; A56-A59 PolarHBondContact O-N 2.7Å; A56-W60 PolarHBondContact O-N 3.27Å
57	A	98.6	Very high	96.9	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58	-40.3	175.7	0	0	0	0	0	111.4	A24 P53 G61 N62 C65 L66 L69	A24-A57 HydrophobicContact CB-CB 4.06Å; P53-A57 WeakPolarHBondContact O-CB 3.31Å; P53-A57 PolarHBondContact O-N 3.33Å; A57-G61 PolarHBondContact O-N 3.4Å; A57-G61 VanDerWaalsContact O-N 3.1Å; A57-N62 HydrophobicContact CB-CB 4.46Å; A57-N62 PolarHBondContact O-N 3.2Å; A57-C65 HydrophobicContact CB-CB 3.76Å; A57-L66 HydrophobicContact CB-CD2 3.7Å; A57-L66 HydrophobicContact CB-CG 3.97Å; A57-L69 HydrophobicContact CB-CD1 4.08Å
58	A	98.8	Very high	97.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-71.4	-43.7	176.4	0	0	0	0	0	112.7	I54 H55 A56 W60 G61 L66 P86 A90 T98 L102	I54-A58 WeakPolarHBondContact O-CB 3.42Å; I54-A58 PolarHBondContact O-N 3.49Å; I54-A58 VanDerWaalsContact O-N 3.16Å; H55-A58 PolarHBondContact O-N 3.46Å; A56-A58 VanDerWaalsContact C-N 3.25Å; A56-A58 PolarHBondContact O-N 3.02Å; A58-W60 PolarHBondContact O-N 3.11Å; A58-G61 PolarHBondContact O-N 3.28Å; A58-L66 HydrophobicContact CB-CD1 4.47Å; A58-L66 HydrophobicContact CB-CD2 4.16Å; A58-P86 HydrophobicContact CB-CB 3.7Å; A58-P86 WeakPolarHBondContact CB-O 3.49Å; A58-A90 HydrophobicContact CB-CB 4.19Å; A58-A90 WeakPolarHBondContact O-CA 3.3Å; A58-A90 WeakPolarHBondContact O-CB 3.43Å; A58-T98 HydrophobicContact CB-CG2 4.46Å; A58-L102 HydrophobicContact CB-CD1 4.2Å
59	A	98.5	Very high	97.8	Very high	7 Å²	7	28.7 Å²	28.7	6%	0.058	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-29.1	178.1	0	0	0	0	0	113	H55 A56 H89 N93 H95	H55-A59 VanDerWaalsContact O-CB 3.27Å; H55-A59 WeakPolarHBondContact O-CB 3.18Å; H55-A59 PolarHBondContact O-N 2.88Å; A56-A59 PolarHBondContact O-N 2.7Å; A59-H89 HydrophobicContact CB-CB 3.96Å; A59-N93 PolarHBondContact O-ND2 3Å; A59-H95 PolarHBondContact O-CD2 3.47Å; A59-H95 PolarHBondContact O-NE2 3.1Å
60	W	98.5	Very high	98	Very high	150 Å²	150	28.7 Å²	28.7	57%	0.568	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.6	7.8	-178.6	-71.8	91	0	0	0	114.2	I25 A56 A58	I25-W60 HydrophobicContact CB-CG 4.38Å; I25-W60 HydrophobicContact CG1-CG 4.41Å; I25-W60 HydrophobicContact CG2-CD2 3.89Å; I25-W60 HydrophobicContact CG2-CG 3.93Å; I25-W60 HydrophobicContact CG2-CZ2 4.47Å; I25-W60 WeakPolarHBondContact O-CB 3.37Å; A56-W60 PolarHBondContact O-N 3.27Å; A58-W60 PolarHBondContact O-N 3.11Å
61	G	98.4	Very high	98.1	Very high	19 Å²	19	35.8 Å²	35.8	20%	0.196	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	36.8	169.3	0	0	0	0	0	115.3	A57 A58 P63 H95 T98	A57-G61 PolarHBondContact O-N 3.4Å; A57-G61 VanDerWaalsContact O-N 3.1Å; A58-G61 PolarHBondContact O-N 3.28Å; G61-P63 WeakPolarHBondContact O-CD 3.42Å; G61-H95 PolarHBondContact N-CD2 2.86Å; G61-H95 VanDerWaalsContact N-CD2 3.34Å; G61-T98 VanDerWaalsContact C-OG1 3.23Å; G61-T98 WeakPolarHBondContact CA-OG1 3.37Å; G61-T98 PolarHBondContact O-OG1 3.25Å
62	N	98.5	Very high	98.1	Very high	33 Å²	33	36.8 Å²	36.8	18%	0.176	17%	0.169	C	C	.	.			trans	-110.1	78.7	-174.6	-66.2	-50.1	0	0	0	112.8	A24 I25 G27 A57 K64 C65 L66	A24-N62 PolarHBondContact O-ND2 3.02Å; I25-N62 PolarHBondContact O-ND2 2.65Å; G27-N62 VanDerWaalsContact CA-CG 3.42Å; G27-N62 WeakPolarHBondContact CA-OD1 3.38Å; G27-N62 PolarHBondContact N-ND2 2.81Å; A57-N62 HydrophobicContact CB-CB 4.46Å; A57-N62 PolarHBondContact O-N 3.2Å; N62-K64 VanDerWaalsContact C-N 3.3Å; N62-K64 PolarHBondContact O-N 2.81Å; N62-C65 HydrophobicContact CB-CB 4.01Å; N62-C65 WeakPolarHBondContact O-CB 3.28Å; N62-C65 PolarHBondContact O-N 2.8Å; N62-L66 PolarHBondContact O-N 3.4Å; N62-L66 VanDerWaalsContact O-N 3.16Å
63	P	98.3	Very high	98.1	Very high	39 Å²	39	38.9 Å²	38.9	25%	0.253	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-30.4	-176.3	24.8	-33.9	0	0	0	113.8	G61 C65 L66 E67 W101	G61-P63 WeakPolarHBondContact O-CD 3.42Å; P63-C65 VanDerWaalsContact C-N 3.31Å; P63-C65 PolarHBondContact O-N 2.75Å; P63-L66 WeakPolarHBondContact O-CB 3.38Å; P63-L66 PolarHBondContact O-N 3.1Å; P63-E67 PolarHBondContact O-N 2.93Å; P63-W101 HydrophobicContact CB-CB 4.12Å; P63-W101 HydrophobicContact CB-CD2 4.24Å; P63-W101 HydrophobicContact CB-CG 3.85Å
64	K	98.5	Very high	98.1	Very high	127 Å²	127	39.2 Å²	39.2	55%	0.552	20%	0.195	S	C	*	.	H	α-helix	trans	-64.7	-35.2	174	-64.8	-173.3	179.1	-178.9	0	112.5	H29 N62 V68	H29-K64 HydrophobicContact CB-CB 3.94Å; H29-K64 VanDerWaalsContact CD2-CD 3.44Å; H29-K64 WeakPolarHBondContact CD2-CD 3.32Å; H29-K64 WeakPolarHBondContact NE2-CD 3.42Å; N62-K64 VanDerWaalsContact C-N 3.3Å; N62-K64 PolarHBondContact O-N 2.81Å; K64-V68 WeakPolarHBondContact O-CG2 3.22Å; K64-V68 PolarHBondContact O-N 2.9Å
65	C	98.7	Very high	98.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-70.5	-37.9	173.8	-71.2	0	0	0	0	111.1	G27 L32 A57 N62 P63 E67 V68 L69	G27-C65 VanDerWaalsContact C-SG 3.53Å; G27-C65 VanDerWaalsContact CA-SG 3.58Å; L32-C65 HydrophobicContact CD2-CB 3.75Å; A57-C65 HydrophobicContact CB-CB 3.76Å; N62-C65 HydrophobicContact CB-CB 4.01Å; N62-C65 WeakPolarHBondContact O-CB 3.28Å; N62-C65 PolarHBondContact O-N 2.8Å; P63-C65 VanDerWaalsContact C-N 3.31Å; P63-C65 PolarHBondContact O-N 2.75Å; C65-E67 VanDerWaalsContact C-N 3.31Å; C65-E67 PolarHBondContact O-N 3.47Å; C65-V68 PolarHBondContact O-N 3.42Å; C65-L69 WeakPolarHBondContact O-CB 3.44Å; C65-L69 WeakPolarHBondContact O-CD1 3.4Å; C65-L69 WeakPolarHBondContact O-CG 3.44Å; C65-L69 PolarHBondContact O-N 3.49Å
66	L	98.7	Very high	98.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-43.6	173.1	-65.7	175.3	0	0	0	111.8	I54 A57 A58 N62 P63 L69 I70 T98 W101 L102	I54-L66 HydrophobicContact CD1-CD2 4.45Å; I54-L66 HydrophobicContact CG1-CD2 3.51Å; I54-L66 WeakPolarHBondContact O-CD2 3.4Å; A57-L66 HydrophobicContact CB-CD2 3.7Å; A57-L66 HydrophobicContact CB-CG 3.97Å; A58-L66 HydrophobicContact CB-CD1 4.47Å; A58-L66 HydrophobicContact CB-CD2 4.16Å; N62-L66 PolarHBondContact O-N 3.4Å; N62-L66 VanDerWaalsContact O-N 3.16Å; P63-L66 WeakPolarHBondContact O-CB 3.38Å; P63-L66 PolarHBondContact O-N 3.1Å; L66-L69 PolarHBondContact O-N 2.83Å; L66-I70 WeakPolarHBondContact O-CG1 3.16Å; L66-I70 PolarHBondContact O-N 3.01Å; L66-T98 HydrophobicContact CD1-CG2 3.59Å; L66-W101 HydrophobicContact CB-CE3 4.01Å; L66-W101 HydrophobicContact CB-CH2 3.76Å; L66-W101 HydrophobicContact CB-CZ3 3.46Å; L66-W101 VanDerWaalsContact CB-CZ3 3.46Å; L66-W101 HydrophobicContact CD1-CE3 3.86Å; L66-W101 HydrophobicContact CD1-CZ3 4.04Å; L66-W101 HydrophobicContact CG-CZ3 4.38Å; L66-L102 HydrophobicContact CD1-CD1 4.23Å; L66-L102 HydrophobicContact CD1-CD2 3.82Å; L66-L102 HydrophobicContact CD1-CG 3.87Å
67	E	98.4	Very high	98.1	Very high	120 Å²	120	45.7 Å²	45.7	56%	0.561	23%	0.231	S	C	*	.	H	α-helix	trans	-57.6	-50	176.4	-173.2	178.4	175.3	0	0	112	P63 C65 L69 I70 R71 W101	P63-E67 PolarHBondContact O-N 2.93Å; C65-E67 VanDerWaalsContact C-N 3.31Å; C65-E67 PolarHBondContact O-N 3.47Å; E67-L69 PolarHBondContact O-N 3.29Å; E67-I70 PolarHBondContact O-N 3.06Å; E67-R71 WeakPolarHBondContact O-CB 3.42Å; E67-R71 PolarHBondContact O-N 2.9Å; E67-W101 HydrophobicContact CB-CH2 4.29Å; E67-W101 HydrophobicContact CB-CZ2 3.74Å; E67-W101 HydrophobicContact CG-CZ2 4.32Å
68	V	98.1	Very high	98	Very high	8 Å²	8	48.7 Å²	48.7	5%	0.048	24%	0.244	C	C	.	.	H	α-helix	trans	-58.9	-47.5	176.8	170.8	0	0	0	0	110.9	H29 L32 D33 L36 K64 C65 I70 R71 H72	H29-V68 HydrophobicContact CB-CG2 4.13Å; L32-V68 HydrophobicContact CB-CG1 4.47Å; L32-V68 HydrophobicContact CD2-CB 4.49Å; L32-V68 HydrophobicContact CD2-CG1 4.32Å; L32-V68 HydrophobicContact CG-CG1 4.03Å; D33-V68 HydrophobicContact CB-CG1 3.9Å; D33-V68 HydrophobicContact CB-CG2 4.39Å; L36-V68 HydrophobicContact CD1-CG1 4.35Å; K64-V68 WeakPolarHBondContact O-CG2 3.22Å; K64-V68 PolarHBondContact O-N 2.9Å; C65-V68 PolarHBondContact O-N 3.42Å; V68-I70 PolarHBondContact O-N 2.94Å; V68-R71 WeakPolarHBondContact O-CB 3.39Å; V68-R71 PolarHBondContact O-N 3.01Å; V68-H72 PolarHBondContact O-CD2 3.45Å; V68-H72 VanDerWaalsContact O-CD2 3.24Å; V68-H72 PolarHBondContact O-N 3.21Å
69	L	98.2	Very high	98	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-41.7	-177.8	-73.3	161.6	0	0	0	112.8	A24 L32 L36 I41 P53 I54 A57 C65 L66 E67 H72 G73 C74	A24-L69 HydrophobicContact CB-CD1 4.48Å; L32-L69 HydrophobicContact CD1-CD2 4.33Å; L32-L69 HydrophobicContact CD2-CD1 4.05Å; L32-L69 HydrophobicContact CD2-CD2 4.24Å; L32-L69 HydrophobicContact CD2-CG 3.85Å; L36-L69 HydrophobicContact CD1-CD2 3.72Å; I41-L69 HydrophobicContact CG1-CD2 4.22Å; I41-L69 HydrophobicContact CG2-CD2 4.39Å; P53-L69 HydrophobicContact CB-CD1 3.99Å; P53-L69 HydrophobicContact CB-CD2 3.77Å; P53-L69 HydrophobicContact CG-CD2 4.49Å; I54-L69 HydrophobicContact CB-CB 4.49Å; I54-L69 HydrophobicContact CB-CD1 4.1Å; A57-L69 HydrophobicContact CB-CD1 4.08Å; C65-L69 WeakPolarHBondContact O-CB 3.44Å; C65-L69 WeakPolarHBondContact O-CD1 3.4Å; C65-L69 WeakPolarHBondContact O-CG 3.44Å; C65-L69 PolarHBondContact O-N 3.49Å; L66-L69 PolarHBondContact O-N 2.83Å; E67-L69 PolarHBondContact O-N 3.29Å; L69-H72 CarbonylContact O-C 3.6Å; L69-H72 PolarHBondContact O-N 3.16Å; L69-G73 PolarHBondContact O-N 2.96Å; L69-C74 HydrophobicContact CB-CB 4.15Å; L69-C74 WeakPolarHBondContact O-CB 3.45Å; L69-C74 PolarHBondContact O-N 3.43Å; L69-C74 PolarHBondContact O-SG 3.32Å; L69-C74 VanDerWaalsContact O-SG 3.34Å
70	I	98.1	Very high	97.9	Very high	53 Å²	53	51.5 Å²	51.5	27%	0.272	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-40.1	176.4	-69.2	-179.2	0	0	0	110.8	I54 L66 E67 V68 H72 G73 V76 W101	I54-I70 HydrophobicContact CD1-CG1 4.1Å; L66-I70 WeakPolarHBondContact O-CG1 3.16Å; L66-I70 PolarHBondContact O-N 3.01Å; E67-I70 PolarHBondContact O-N 3.06Å; V68-I70 PolarHBondContact O-N 2.94Å; I70-H72 PolarHBondContact O-N 3.27Å; I70-G73 PolarHBondContact O-N 3.08Å; I70-V76 HydrophobicContact CD1-CB 3.8Å; I70-V76 HydrophobicContact CD1-CG2 3.9Å; I70-W101 HydrophobicContact CD1-CH2 3.7Å; I70-W101 HydrophobicContact CD1-CZ3 3.81Å
71	R	97.3	Very high	97.9	Very high	161 Å²	161	47.3 Å²	47.3	61%	0.608	25%	0.251	S	S	*	.	H	α-helix	trans	-60.6	-33.5	174.7	-177.8	174.8	60	173.7	-3.6	112.2	D33 E67 V68 G73	D33-R71 IonicContact OD1-CZ 3.62Å; D33-R71 IonicContact OD1-NH2 2.65Å; D33-R71 PolarHBondContact OD1-NH2 2.96Å; D33-R71 IonicContact OD2-CZ 3.73Å; D33-R71 IonicContact OD2-NH2 2.67Å; D33-R71 PolarHBondContact OD2-NH2 3.46Å; E67-R71 WeakPolarHBondContact O-CB 3.42Å; E67-R71 PolarHBondContact O-N 2.9Å; V68-R71 WeakPolarHBondContact O-CB 3.39Å; V68-R71 PolarHBondContact O-N 3.01Å; R71-G73 PolarHBondContact O-N 3.15Å
72	H	96.5	Very high	97.8	Very high	45 Å²	45	50.4 Å²	50.4	21%	0.208	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	22.5	173.8	-75.9	-78.9	0	0	0	113.6	D33 L36 D37 I41 V68 L69 I70	D33-H72 IonicContact OD1-CD2 3.61Å; D33-H72 IonicContact OD1-NE2 2.88Å; D33-H72 PolarHBondContact OD1-NE2 3.48Å; L36-H72 HydrophobicContact CB-CB 4.22Å; L36-H72 HydrophobicContact CD1-CB 3.84Å; D37-H72 IonicContact OD1-CE1 3.45Å; D37-H72 PolarHBondContact OD1-CE1 2.61Å; D37-H72 IonicContact OD1-NE2 3.87Å; I41-H72 HydrophobicContact CG2-CB 4.43Å; V68-H72 PolarHBondContact O-CD2 3.45Å; V68-H72 VanDerWaalsContact O-CD2 3.24Å; V68-H72 PolarHBondContact O-N 3.21Å; L69-H72 CarbonylContact O-C 3.6Å; L69-H72 PolarHBondContact O-N 3.16Å; I70-H72 PolarHBondContact O-N 3.27Å
73	G	96	Very high	97.8	Very high	53 Å²	53	52.2 Å²	52.2	55%	0.546	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	0.3	169.1	0	0	0	0	0	116.2	L69 I70 R71	L69-G73 PolarHBondContact O-N 2.96Å; I70-G73 PolarHBondContact O-N 3.08Å; R71-G73 PolarHBondContact O-N 3.15Å
74	C	97.1	Very high	97.8	Very high	7 Å²	7	50.6 Å²	50.6	5%	0.047	26%	0.261	C	S	.	.			trans	-64.8	138.6	174.1	-65.4	0	0	0	0	111.4	I41 I54 L69	I41-C74 WeakPolarHBondContact CG2-SG 3.44Å; I54-C74 HydrophobicContact CB-CB 4.41Å; I54-C74 HydrophobicContact CD1-CB 3.87Å; L69-C74 HydrophobicContact CB-CB 4.15Å; L69-C74 WeakPolarHBondContact O-CB 3.45Å; L69-C74 PolarHBondContact O-N 3.43Å; L69-C74 PolarHBondContact O-SG 3.32Å; L69-C74 VanDerWaalsContact O-SG 3.34Å
75	N	97.8	Very high	97.8	Very high	82 Å²	82	44.5 Å²	44.5	44%	0.439	23%	0.234	S	C	.	.			trans	-77.8	128.1	172.7	-175.5	-8.3	0	0	0	111	I54 N77 Q78	I54-N75 VanDerWaalsContact CD1-O 3.31Å; I54-N75 WeakPolarHBondContact CD1-O 3.46Å; N75-N77 PolarHBondContact O-N 3.49Å; N75-N77 VanDerWaalsContact O-N 3.1Å; N75-N77 PolarHBondContact OD1-N 2.91Å; N75-Q78 HydrophobicContact CB-CB 4.28Å; N75-Q78 WeakPolarHBondContact O-CB 3.42Å; N75-Q78 PolarHBondContact O-N 2.82Å
76	V	98.3	Very high	97.8	Very high	16 Å²	16	44.5 Å²	44.5	10%	0.097	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-26.7	174.2	71.7	0	0	0	0	113.4	I70 P86 L102 N105 A107	I70-V76 HydrophobicContact CD1-CB 3.8Å; I70-V76 HydrophobicContact CD1-CG2 3.9Å; V76-P86 WeakPolarHBondContact O-CD 3.41Å; V76-P86 WeakPolarHBondContact O-CG 3.28Å; V76-L102 HydrophobicContact CG2-CD2 3.69Å; V76-N105 HydrophobicContact CG2-CB 4.42Å; V76-A107 HydrophobicContact CG2-CB 4.44Å
77	N	98.4	Very high	97.8	Very high	40 Å²	40	44.5 Å²	44.5	21%	0.214	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	19.8	178.4	-66.5	-51.2	0	0	0	112.7	N75 M79 G106 A107 N108	N75-N77 PolarHBondContact O-N 3.49Å; N75-N77 VanDerWaalsContact O-N 3.1Å; N75-N77 PolarHBondContact OD1-N 2.91Å; N77-M79 PolarHBondContact O-N 3.32Å; N77-G106 PolarHBondContact ND2-O 3.34Å; N77-G106 VanDerWaalsContact ND2-O 3.08Å; N77-A107 VanDerWaalsContact OD1-CA 3.3Å; N77-A107 WeakPolarHBondContact OD1-CA 3.46Å; N77-N108 PolarHBondContact OD1-N 2.81Å
78	Q	97.8	Very high	97.8	Very high	62 Å²	62	38.8 Å²	38.8	29%	0.29	21%	0.208	S	C	.	.			trans	-51	136.8	174.8	-175.7	57.5	47.3	0	0	109.9	M52 I54 H55 N75 S85 P86	M52-Q78 HydrophobicContact SD-CG 3.48Å; M52-Q78 WeakPolarHBondContact SD-CG 3.47Å; I54-Q78 HydrophobicContact CG2-CB 4.12Å; I54-Q78 HydrophobicContact CG2-CG 4.41Å; H55-Q78 PolarHBondContact NE2-O 3.39Å; N75-Q78 HydrophobicContact CB-CB 4.28Å; N75-Q78 WeakPolarHBondContact O-CB 3.42Å; N75-Q78 PolarHBondContact O-N 2.82Å; Q78-S85 WeakPolarHBondContact O-CA 3.22Å; Q78-P86 WeakPolarHBondContact O-CD 3.39Å
79	M	97.7	Very high	97.9	Very high	53 Å²	53	39.4 Å²	39.4	26%	0.261	21%	0.21	S	C	.	.			trans	-105.2	139.2	177.7	-64.5	-62	-179	0	0	109.4	N77 N83 E111	N77-M79 PolarHBondContact O-N 3.32Å; M79-N83 VanDerWaalsContact SD-O 3.4Å; M79-E111 HydrophobicContact CE-CB 3.71Å; M79-E111 HydrophobicContact CE-CG 3.6Å
80	D	97.7	Very high	97.9	Very high	13 Å²	13	39.4 Å²	39.4	7%	0.07	21%	0.21	C	C	.	.			trans	-84.2	-176.4	165.1	70.9	14.1	0	0	0	111.6	T49 M51 H55 M82 N83 C84 H89	T49-D80 WeakPolarHBondContact O-CB 3.35Å; M51-D80 HydrophobicContact CG-CB 4.2Å; H55-D80 PolarHBondContact NE2-N 3.5Å; D80-M82 PolarHBondContact O-N 3.05Å; D80-M82 WeakPolarHBondContact OD1-CA 3.48Å; D80-M82 WeakPolarHBondContact OD1-CB 3.23Å; D80-M82 PolarHBondContact OD1-N 2.88Å; D80-N83 PolarHBondContact O-N 3.1Å; D80-N83 PolarHBondContact OD1-N 3.2Å; D80-C84 PolarHBondContact N-O 2.88Å; D80-C84 VanDerWaalsContact N-O 3.17Å; D80-C84 WeakPolarHBondContact OD1-CB 3.3Å; D80-C84 PolarHBondContact OD1-N 2.91Å; D80-C84 WeakPolarHBondContact OD2-CB 3.49Å; D80-H89 IonicContact OD2-CD2 3.8Å; D80-H89 IonicContact OD2-CE1 3.74Å; D80-H89 PolarHBondContact OD2-CE1 3.45Å; D80-H89 IonicContact OD2-NE2 3.93Å; D80-H89 PolarHBondContact OD2-NE2 3.43Å
81	S	97.5	Very high	97.9	Very high	62 Å²	62	36.9 Å²	36.9	43%	0.434	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-11.5	-178.7	-60.7	0	0	0	0	114	T49 G50 L114	T49-S81 VanDerWaalsContact C-OG 3.31Å; T49-S81 VanDerWaalsContact O-CB 3.24Å; T49-S81 WeakPolarHBondContact O-CB 3.45Å; T49-S81 PolarHBondContact O-N 2.88Å; T49-S81 PolarHBondContact O-OG 3.33Å; G50-S81 VanDerWaalsContact CA-OG 3.28Å; G50-S81 WeakPolarHBondContact CA-OG 3.24Å; G50-S81 PolarHBondContact N-OG 2.81Å; S81-L114 WeakPolarHBondContact O-CD1 3.28Å
82	M	97.3	Very high	98	Very high	85 Å²	85	33 Å²	33	42%	0.419	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	12.2	176.7	-62.6	-65.9	168.1	0	0	112.3	D80 C84 N113 L114 F115	D80-M82 PolarHBondContact O-N 3.05Å; D80-M82 WeakPolarHBondContact OD1-CA 3.48Å; D80-M82 WeakPolarHBondContact OD1-CB 3.23Å; D80-M82 PolarHBondContact OD1-N 2.88Å; M82-C84 PolarHBondContact O-N 2.8Å; M82-N113 WeakPolarHBondContact O-CB 3.28Å; M82-L114 PolarHBondContact O-N 3.29Å; M82-L114 HydrophobicContact SD-CD1 4.17Å; M82-F115 HydrophobicContact SD-CE2 4.36Å; M82-F115 HydrophobicContact SD-CZ 4.34Å
83	N	97.9	Very high	98.1	Very high	71 Å²	71	34.2 Å²	34.2	38%	0.38	19%	0.19	S	C	.	.	S	Bend	trans	54.4	28.5	-170.6	-69.2	-0.2	0	0	0	112.7	M79 D80 N113 L114	M79-N83 VanDerWaalsContact SD-O 3.4Å; D80-N83 PolarHBondContact O-N 3.1Å; D80-N83 PolarHBondContact OD1-N 3.2Å; N83-N113 WeakPolarHBondContact O-CA 3.31Å; N83-L114 HydrophobicContact CB-CD2 4.44Å; N83-L114 HydrophobicContact CB-CG 4.36Å
84	C	98.4	Very high	98.2	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.027	17%	0.172	C	C	.	.			trans	-90.5	120.5	172.2	-70.3	0	0	0	0	109	H55 D80 M82 H88 N113	H55-C84 PolarHBondContact NE2-O 2.92Å; D80-C84 PolarHBondContact N-O 2.88Å; D80-C84 VanDerWaalsContact N-O 3.17Å; D80-C84 WeakPolarHBondContact OD1-CB 3.3Å; D80-C84 PolarHBondContact OD1-N 2.91Å; D80-C84 WeakPolarHBondContact OD2-CB 3.49Å; M82-C84 PolarHBondContact O-N 2.8Å; C84-H88 HydrophobicContact CB-CB 3.89Å; C84-N113 VanDerWaalsContact SG-CB 3.51Å
85	S	98.4	Very high	98.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.			trans	-82.3	167	170.2	67.1	0	0	0	0	112.5	Q78 V87 H88 H89	Q78-S85 WeakPolarHBondContact O-CA 3.22Å; S85-V87 PolarHBondContact O-N 3.38Å; S85-V87 VanDerWaalsContact O-N 3.07Å; S85-V87 VanDerWaalsContact OG-CG1 3.23Å; S85-V87 WeakPolarHBondContact OG-CG1 3.24Å; S85-H88 PolarHBondContact N-ND1 3.37Å; S85-H88 VanDerWaalsContact N-ND1 3.15Å; S85-H88 WeakPolarHBondContact O-CA 3.49Å; S85-H88 VanDerWaalsContact O-CB 3.3Å; S85-H88 WeakPolarHBondContact O-CB 3.28Å; S85-H88 PolarHBondContact O-N 3.06Å; S85-H88 PolarHBondContact OG-ND1 3.22Å; S85-H89 PolarHBondContact O-N 3.47Å
86	P	98.8	Very high	98.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-46.5	-40.8	174.5	-34.3	37.4	0	0	0	113.7	I54 A58 V76 Q78 H88 H89 A90 L102	I54-P86 HydrophobicContact CB-CG 4.47Å; I54-P86 HydrophobicContact CD1-CG 4.02Å; I54-P86 HydrophobicContact CG1-CB 4.48Å; I54-P86 HydrophobicContact CG1-CG 3.84Å; I54-P86 HydrophobicContact CG2-CG 4.09Å; A58-P86 HydrophobicContact CB-CB 3.7Å; A58-P86 WeakPolarHBondContact CB-O 3.49Å; V76-P86 WeakPolarHBondContact O-CD 3.41Å; V76-P86 WeakPolarHBondContact O-CG 3.28Å; Q78-P86 WeakPolarHBondContact O-CD 3.39Å; P86-H88 VanDerWaalsContact C-N 3.34Å; P86-H88 PolarHBondContact O-N 3.25Å; P86-H89 PolarHBondContact O-N 2.81Å; P86-A90 PolarHBondContact O-N 3.35Å; P86-L102 HydrophobicContact CB-CD1 4.12Å; P86-L102 HydrophobicContact CB-CD2 3.96Å
87	V	98.8	Very high	98.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-68.9	-29.3	179.4	64.3	0	0	0	0	113.2	S85 A91 V99 L102 A107 L109 P119	S85-V87 PolarHBondContact O-N 3.38Å; S85-V87 VanDerWaalsContact O-N 3.07Å; S85-V87 VanDerWaalsContact OG-CG1 3.23Å; S85-V87 WeakPolarHBondContact OG-CG1 3.24Å; V87-A91 WeakPolarHBondContact O-CB 3.23Å; V87-A91 PolarHBondContact O-N 2.86Å; V87-V99 HydrophobicContact CG2-CG1 4.28Å; V87-L102 HydrophobicContact CB-CB 4.47Å; V87-L102 HydrophobicContact CB-CD1 4.03Å; V87-A107 HydrophobicContact CB-CB 4.14Å; V87-A107 HydrophobicContact CG1-CB 4.15Å; V87-L109 HydrophobicContact CG1-CD2 4.28Å; V87-L109 HydrophobicContact CG2-CD2 3.7Å; V87-P119 HydrophobicContact CB-CG 4.47Å; V87-P119 HydrophobicContact CG1-CB 4.38Å; V87-P119 HydrophobicContact CG1-CG 3.69Å; V87-P119 HydrophobicContact CG2-CB 4.08Å; V87-P119 HydrophobicContact CG2-CG 4.26Å
88	H	98.8	Very high	98.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-44.7	171.8	-72.1	87.6	0	0	0	111.2	C84 S85 P86 R92 E111 Q117 P119 L122	C84-H88 HydrophobicContact CB-CB 3.89Å; S85-H88 PolarHBondContact N-ND1 3.37Å; S85-H88 VanDerWaalsContact N-ND1 3.15Å; S85-H88 WeakPolarHBondContact O-CA 3.49Å; S85-H88 VanDerWaalsContact O-CB 3.3Å; S85-H88 WeakPolarHBondContact O-CB 3.28Å; S85-H88 PolarHBondContact O-N 3.06Å; S85-H88 PolarHBondContact OG-ND1 3.22Å; P86-H88 VanDerWaalsContact C-N 3.34Å; P86-H88 PolarHBondContact O-N 3.25Å; H88-R92 WeakPolarHBondContact O-CB 3.16Å; H88-R92 PolarHBondContact O-N 3.06Å; H88-E111 PolarHBondContact NE2-O 3.24Å; H88-Q117 PolarHBondContact NE2-O 3.29Å; H88-P119 WeakPolarHBondContact NE2-CD 3.47Å; H88-L122 HydrophobicContact CB-CD1 3.66Å; H88-L122 WeakPolarHBondContact O-CD1 3.45Å
89	H	98.7	Very high	98.4	Very high	21 Å²	21	34.1 Å²	34.1	10%	0.097	18%	0.184	C	C	.	.	H	α-helix	trans	-67.9	-46.3	179.3	-74.2	-68.5	0	0	0	112.4	A59 D80 S85 P86 A91 R92 N93	A59-H89 HydrophobicContact CB-CB 3.96Å; D80-H89 IonicContact OD2-CD2 3.8Å; D80-H89 IonicContact OD2-CE1 3.74Å; D80-H89 PolarHBondContact OD2-CE1 3.45Å; D80-H89 IonicContact OD2-NE2 3.93Å; D80-H89 PolarHBondContact OD2-NE2 3.43Å; S85-H89 PolarHBondContact O-N 3.47Å; P86-H89 PolarHBondContact O-N 2.81Å; H89-A91 VanDerWaalsContact C-N 3.31Å; H89-A91 PolarHBondContact O-N 3.15Å; H89-R92 PolarHBondContact O-N 3.07Å; H89-N93 PolarHBondContact O-N 2.85Å
90	A	98.8	Very high	98.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-39.8	176.1	0	0	0	0	0	112.2	A58 P86 N93 G94 H95 T98 V99 L102	A58-A90 HydrophobicContact CB-CB 4.19Å; A58-A90 WeakPolarHBondContact O-CA 3.3Å; A58-A90 WeakPolarHBondContact O-CB 3.43Å; P86-A90 PolarHBondContact O-N 3.35Å; A90-N93 PolarHBondContact O-N 3.3Å; A90-G94 PolarHBondContact O-N 3.01Å; A90-G94 VanDerWaalsContact O-N 3.09Å; A90-H95 PolarHBondContact O-N 3.41Å; A90-T98 HydrophobicContact CB-CG2 3.94Å; A90-V99 HydrophobicContact CB-CG2 3.65Å; A90-L102 HydrophobicContact CB-CD1 4.04Å
91	A	98.8	Very high	98.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.6	-42.5	178.3	0	0	0	0	0	112.6	V87 H89 N93 G94 V99 P119 A123 I135	V87-A91 WeakPolarHBondContact O-CB 3.23Å; V87-A91 PolarHBondContact O-N 2.86Å; H89-A91 VanDerWaalsContact C-N 3.31Å; H89-A91 PolarHBondContact O-N 3.15Å; A91-N93 PolarHBondContact O-N 3.34Å; A91-G94 PolarHBondContact O-N 2.88Å; A91-V99 HydrophobicContact CB-CG2 4.31Å; A91-P119 HydrophobicContact CB-CB 3.89Å; A91-P119 WeakPolarHBondContact CB-O 3.39Å; A91-A123 HydrophobicContact CB-CB 4.18Å; A91-A123 WeakPolarHBondContact O-CA 3.43Å; A91-I135 HydrophobicContact CB-CD1 3.62Å
92	R	98.6	Very high	98.5	Very high	80 Å²	80	34.5 Å²	34.5	30%	0.302	18%	0.176	S	C	.	.	H	α-helix	trans	-56.2	-37.4	174.7	-179.2	-174	-69.8	-100.5	2.5	112.1	H88 H89 L122 N126 F128	H88-R92 WeakPolarHBondContact O-CB 3.16Å; H88-R92 PolarHBondContact O-N 3.06Å; H89-R92 PolarHBondContact O-N 3.07Å; R92-L122 HydrophobicContact CB-CB 4.16Å; R92-L122 HydrophobicContact CB-CD1 4.46Å; R92-N126 WeakPolarHBondContact O-CB 3.5Å; R92-F128 WeakPolarHBondContact O-CE2 3.3Å
93	N	98.6	Very high	98.6	Very high	69 Å²	69	32 Å²	32	37%	0.369	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	4.5	-176.6	-65.8	-22.2	0	0	0	113.8	A59 H89 A90 A91 H95	A59-N93 PolarHBondContact O-ND2 3Å; H89-N93 PolarHBondContact O-N 2.85Å; A90-N93 PolarHBondContact O-N 3.3Å; A91-N93 PolarHBondContact O-N 3.34Å; N93-H95 VanDerWaalsContact C-N 3.35Å; N93-H95 PolarHBondContact O-N 3.25Å
94	G	98.4	Very high	98.6	Very high	17 Å²	17	36.2 Å²	36.2	18%	0.175	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	74	19.5	172.9	0	0	0	0	0	115.3	A90 A91 S96 F128	A90-G94 PolarHBondContact O-N 3.01Å; A90-G94 VanDerWaalsContact O-N 3.09Å; A91-G94 PolarHBondContact O-N 2.88Å; G94-S96 VanDerWaalsContact C-N 3.32Å; G94-S96 PolarHBondContact O-N 3.18Å; G94-F128 VanDerWaalsContact CA-CD2 3.46Å; G94-F128 VanDerWaalsContact CA-CE2 3.46Å; G94-F128 VanDerWaalsContact N-CE2 3.29Å
95	H	98.6	Very high	98.6	Very high	61 Å²	61	39.6 Å²	39.6	28%	0.282	20%	0.196	S	C	.	.			trans	-80.3	74.8	-179	-67	-56.1	0	0	0	111.9	A59 G61 A90 N93 D97 T98 V99	A59-H95 PolarHBondContact O-CD2 3.47Å; A59-H95 PolarHBondContact O-NE2 3.1Å; G61-H95 PolarHBondContact N-CD2 2.86Å; G61-H95 VanDerWaalsContact N-CD2 3.34Å; A90-H95 PolarHBondContact O-N 3.41Å; N93-H95 VanDerWaalsContact C-N 3.35Å; N93-H95 PolarHBondContact O-N 3.25Å; H95-D97 PolarHBondContact O-N 3.42Å; H95-T98 WeakPolarHBondContact O-CB 3.27Å; H95-T98 PolarHBondContact O-N 3.17Å; H95-V99 PolarHBondContact O-N 3.48Å
96	S	98.5	Very high	98.5	Very high	51 Å²	51	41.7 Å²	41.7	36%	0.357	22%	0.219	S	C	.	.	H	α-helix	trans	-51.5	-48.6	-176.1	-60.1	0	0	0	0	113.8	G94 T98 V99 E100	G94-S96 VanDerWaalsContact C-N 3.32Å; G94-S96 PolarHBondContact O-N 3.18Å; S96-T98 PolarHBondContact O-N 3.3Å; S96-V99 PolarHBondContact O-N 2.95Å; S96-V99 VanDerWaalsContact O-N 3.16Å; S96-E100 WeakPolarHBondContact O-CG 3.38Å; S96-E100 PolarHBondContact O-N 3.23Å
97	D	98.3	Very high	98.5	Very high	127 Å²	127	41.7 Å²	41.7	68%	0.679	22%	0.219	S	C	*	.	H	α-helix	trans	-60.2	-36.3	179.6	-64.2	-10	0	0	0	112.2	H95 W101	H95-D97 PolarHBondContact O-N 3.42Å; D97-W101 WeakPolarHBondContact O-CB 3.35Å; D97-W101 PolarHBondContact O-N 2.93Å
98	T	98.8	Very high	98.5	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-74.1	-39.6	178.5	-61.2	0	0	0	0	111.3	A58 G61 L66 A90 H95 S96 W101 L102	A58-T98 HydrophobicContact CB-CG2 4.46Å; G61-T98 VanDerWaalsContact C-OG1 3.23Å; G61-T98 WeakPolarHBondContact CA-OG1 3.37Å; G61-T98 PolarHBondContact O-OG1 3.25Å; L66-T98 HydrophobicContact CD1-CG2 3.59Å; A90-T98 HydrophobicContact CB-CG2 3.94Å; H95-T98 WeakPolarHBondContact O-CB 3.27Å; H95-T98 PolarHBondContact O-N 3.17Å; S96-T98 PolarHBondContact O-N 3.3Å; T98-W101 PolarHBondContact O-N 3.48Å; T98-L102 HydrophobicContact CG2-CD1 4.13Å; T98-L102 WeakPolarHBondContact O-CB 3.18Å; T98-L102 VanDerWaalsContact O-CG 3.3Å; T98-L102 WeakPolarHBondContact O-CG 3.46Å; T98-L102 PolarHBondContact O-N 3.03Å
99	V	98.8	Very high	98.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-61.2	-45.9	172.3	170.6	0	0	0	0	110.7	V87 A90 A91 H95 S96 W101 L102 I103 L131 I135	V87-V99 HydrophobicContact CG2-CG1 4.28Å; A90-V99 HydrophobicContact CB-CG2 3.65Å; A91-V99 HydrophobicContact CB-CG2 4.31Å; H95-V99 PolarHBondContact O-N 3.48Å; S96-V99 PolarHBondContact O-N 2.95Å; S96-V99 VanDerWaalsContact O-N 3.16Å; V99-W101 VanDerWaalsContact C-N 3.31Å; V99-W101 PolarHBondContact O-N 3Å; V99-L102 PolarHBondContact O-N 2.97Å; V99-I103 HydrophobicContact CG1-CD1 3.7Å; V99-I103 HydrophobicContact CG1-CG1 4.33Å; V99-I103 VanDerWaalsContact O-CG1 3.24Å; V99-I103 WeakPolarHBondContact O-CG1 3.09Å; V99-I103 PolarHBondContact O-N 3.48Å; V99-L131 HydrophobicContact CB-CD1 3.96Å; V99-L131 HydrophobicContact CG1-CD1 3.9Å; V99-L131 HydrophobicContact CG2-CD1 4.14Å; V99-L131 HydrophobicContact CG2-CD2 4.2Å; V99-I135 HydrophobicContact CG1-CD1 3.97Å; V99-I135 HydrophobicContact CG1-CG1 3.71Å
100	E	98.4	Very high	98.4	Very high	85 Å²	85	44.3 Å²	44.3	40%	0.397	23%	0.233	S	C	.	.	H	α-helix	trans	-59.7	-43	176.4	-74.8	-170.2	-168.9	0	0	112.2	S96 I103 K104	S96-E100 WeakPolarHBondContact O-CG 3.38Å; S96-E100 PolarHBondContact O-N 3.23Å; E100-I103 PolarHBondContact O-N 3.19Å; E100-K104 VanDerWaalsContact O-CG 3.32Å; E100-K104 WeakPolarHBondContact O-CG 3.43Å; E100-K104 PolarHBondContact O-N 3.22Å; E100-K104 IonicContact OE2-NZ 2.65Å
101	W	98.6	Very high	98.4	Very high	51 Å²	51	48.4 Å²	48.4	19%	0.193	25%	0.252	C	S	.	.	H	α-helix	trans	-62	-45.7	176.4	-171.3	97.6	0	0	0	111.5	P63 L66 E67 I70 D97 T98 V99 I103 K104 N105	P63-W101 HydrophobicContact CB-CB 4.12Å; P63-W101 HydrophobicContact CB-CD2 4.24Å; P63-W101 HydrophobicContact CB-CG 3.85Å; L66-W101 HydrophobicContact CB-CE3 4.01Å; L66-W101 HydrophobicContact CB-CH2 3.76Å; L66-W101 HydrophobicContact CB-CZ3 3.46Å; L66-W101 VanDerWaalsContact CB-CZ3 3.46Å; L66-W101 HydrophobicContact CD1-CE3 3.86Å; L66-W101 HydrophobicContact CD1-CZ3 4.04Å; L66-W101 HydrophobicContact CG-CZ3 4.38Å; E67-W101 HydrophobicContact CB-CH2 4.29Å; E67-W101 HydrophobicContact CB-CZ2 3.74Å; E67-W101 HydrophobicContact CG-CZ2 4.32Å; I70-W101 HydrophobicContact CD1-CH2 3.7Å; I70-W101 HydrophobicContact CD1-CZ3 3.81Å; D97-W101 WeakPolarHBondContact O-CB 3.35Å; D97-W101 PolarHBondContact O-N 2.93Å; T98-W101 PolarHBondContact O-N 3.48Å; V99-W101 VanDerWaalsContact C-N 3.31Å; V99-W101 PolarHBondContact O-N 3Å; W101-I103 PolarHBondContact O-N 2.81Å; W101-K104 PolarHBondContact O-N 3.33Å; W101-N105 VanDerWaalsContact CD2-ND2 3.33Å; W101-N105 VanDerWaalsContact CE2-ND2 3.25Å; W101-N105 HydrophobicContact CE3-CB 4.41Å; W101-N105 HydrophobicContact CH2-CB 4.41Å; W101-N105 WeakPolarHBondContact CZ2-ND2 3.48Å; W101-N105 HydrophobicContact CZ3-CB 4.14Å; W101-N105 PolarHBondContact O-N 3.2Å; W101-N105 PolarHBondContact O-ND2 3.01Å
102	L	98.8	Very high	98.3	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.1	-43.4	177.2	-77.1	167.7	0	0	0	111.7	A58 L66 V76 P86 V87 A90 T98 V99 K104 N105 G106 A107	A58-L102 HydrophobicContact CB-CD1 4.2Å; L66-L102 HydrophobicContact CD1-CD1 4.23Å; L66-L102 HydrophobicContact CD1-CD2 3.82Å; L66-L102 HydrophobicContact CD1-CG 3.87Å; V76-L102 HydrophobicContact CG2-CD2 3.69Å; P86-L102 HydrophobicContact CB-CD1 4.12Å; P86-L102 HydrophobicContact CB-CD2 3.96Å; V87-L102 HydrophobicContact CB-CB 4.47Å; V87-L102 HydrophobicContact CB-CD1 4.03Å; A90-L102 HydrophobicContact CB-CD1 4.04Å; T98-L102 HydrophobicContact CG2-CD1 4.13Å; T98-L102 WeakPolarHBondContact O-CB 3.18Å; T98-L102 VanDerWaalsContact O-CG 3.3Å; T98-L102 WeakPolarHBondContact O-CG 3.46Å; T98-L102 PolarHBondContact O-N 3.03Å; V99-L102 PolarHBondContact O-N 2.97Å; L102-K104 PolarHBondContact O-N 2.78Å; L102-N105 CarbonylContact O-C 3.55Å; L102-N105 PolarHBondContact O-N 3.27Å; L102-N105 VanDerWaalsContact O-N 3.11Å; L102-G106 PolarHBondContact O-N 3.39Å; L102-A107 VanDerWaalsContact C-CB 3.48Å; L102-A107 HydrophobicContact CB-CB 3.84Å; L102-A107 WeakPolarHBondContact O-CB 3.26Å; L102-A107 PolarHBondContact O-N 3.1Å
103	I	98.5	Very high	98.3	Very high	31 Å²	31	48.7 Å²	48.7	16%	0.159	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-46.5	176.6	-69.6	168.8	0	0	0	110.8	V99 E100 W101 N105 G106 L109 E138	V99-I103 HydrophobicContact CG1-CD1 3.7Å; V99-I103 HydrophobicContact CG1-CG1 4.33Å; V99-I103 VanDerWaalsContact O-CG1 3.24Å; V99-I103 WeakPolarHBondContact O-CG1 3.09Å; V99-I103 PolarHBondContact O-N 3.48Å; E100-I103 PolarHBondContact O-N 3.19Å; W101-I103 PolarHBondContact O-N 2.81Å; I103-N105 PolarHBondContact O-N 2.86Å; I103-G106 PolarHBondContact O-N 2.91Å; I103-G106 VanDerWaalsContact O-N 3.13Å; I103-L109 HydrophobicContact CD1-CD1 4.07Å; I103-L109 HydrophobicContact CD1-CD2 4.4Å; I103-L109 HydrophobicContact CG1-CD1 4.04Å; I103-L109 HydrophobicContact CG1-CD2 3.97Å; I103-L109 HydrophobicContact CG1-CG 4.44Å; I103-E138 HydrophobicContact CD1-CB 4.29Å; I103-E138 HydrophobicContact CD1-CG 4.15Å; I103-E138 HydrophobicContact CG2-CB 4.3Å; I103-E138 HydrophobicContact CG2-CG 4.17Å
104	K	98.1	Very high	98.3	Very high	160 Å²	160	50.6 Å²	50.6	70%	0.696	27%	0.269	S	S	*	.	H	α-helix	trans	-60.3	-29.2	176.7	-73.8	167.8	-177.6	161.2	0	112.4	E100 W101 L102	E100-K104 VanDerWaalsContact O-CG 3.32Å; E100-K104 WeakPolarHBondContact O-CG 3.43Å; E100-K104 PolarHBondContact O-N 3.22Å; E100-K104 IonicContact OE2-NZ 2.65Å; W101-K104 PolarHBondContact O-N 3.33Å; L102-K104 PolarHBondContact O-N 2.78Å
105	N	98.2	Very high	98.2	Very high	75 Å²	75	56 Å²	56	40%	0.401	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	19.7	179.1	-71.8	-81	0	0	0	113.7	V76 W101 L102 I103	V76-N105 HydrophobicContact CG2-CB 4.42Å; W101-N105 VanDerWaalsContact CD2-ND2 3.33Å; W101-N105 VanDerWaalsContact CE2-ND2 3.25Å; W101-N105 HydrophobicContact CE3-CB 4.41Å; W101-N105 HydrophobicContact CH2-CB 4.41Å; W101-N105 WeakPolarHBondContact CZ2-ND2 3.48Å; W101-N105 HydrophobicContact CZ3-CB 4.14Å; W101-N105 PolarHBondContact O-N 3.2Å; W101-N105 PolarHBondContact O-ND2 3.01Å; L102-N105 CarbonylContact O-C 3.55Å; L102-N105 PolarHBondContact O-N 3.27Å; L102-N105 VanDerWaalsContact O-N 3.11Å; I103-N105 PolarHBondContact O-N 2.86Å
106	G	97.3	Very high	98.2	Very high	45 Å²	45	55.2 Å²	55.2	46%	0.464	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.4	23.4	169.8	0	0	0	0	0	115.4	N77 L102 I103 N108	N77-G106 PolarHBondContact ND2-O 3.34Å; N77-G106 VanDerWaalsContact ND2-O 3.08Å; L102-G106 PolarHBondContact O-N 3.39Å; I103-G106 PolarHBondContact O-N 2.91Å; I103-G106 VanDerWaalsContact O-N 3.13Å; G106-N108 PolarHBondContact O-N 3.16Å
107	A	98.5	Very high	98.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.291	C	S	.	.			trans	-60.6	130.9	172.1	0	0	0	0	0	111.8	V76 N77 V87 L102 Q142	V76-A107 HydrophobicContact CG2-CB 4.44Å; N77-A107 VanDerWaalsContact OD1-CA 3.3Å; N77-A107 WeakPolarHBondContact OD1-CA 3.46Å; V87-A107 HydrophobicContact CB-CB 4.14Å; V87-A107 HydrophobicContact CG1-CB 4.15Å; L102-A107 VanDerWaalsContact C-CB 3.48Å; L102-A107 HydrophobicContact CB-CB 3.84Å; L102-A107 WeakPolarHBondContact O-CB 3.26Å; L102-A107 PolarHBondContact O-N 3.1Å; A107-Q142 PolarHBondContact O-NE2 2.84Å
108	N	98.2	Very high	98.2	Very high	42 Å²	42	52.6 Å²	52.6	23%	0.225	27%	0.273	C	S	.	.			trans	-80.7	119.3	176.1	-174.6	-11.9	0	0	0	109.5	N77 G106 L110 E111	N77-N108 PolarHBondContact OD1-N 2.81Å; G106-N108 PolarHBondContact O-N 3.16Å; N108-L110 WeakPolarHBondContact OD1-CB 3.31Å; N108-L110 PolarHBondContact OD1-N 2.99Å; N108-E111 HydrophobicContact CB-CG 4.18Å; N108-E111 VanDerWaalsContact ND2-CG 3.31Å; N108-E111 WeakPolarHBondContact ND2-CG 3.4Å; N108-E111 PolarHBondContact ND2-OE1 3.43Å
109	L	98.6	Very high	98.2	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.272	C	S	.	.	S	Bend	trans	-96.8	-1.5	-176.5	-55.5	179.9	0	0	0	112.7	V87 I103 I135 E138 A139	V87-L109 HydrophobicContact CG1-CD2 4.28Å; V87-L109 HydrophobicContact CG2-CD2 3.7Å; I103-L109 HydrophobicContact CD1-CD1 4.07Å; I103-L109 HydrophobicContact CD1-CD2 4.4Å; I103-L109 HydrophobicContact CG1-CD1 4.04Å; I103-L109 HydrophobicContact CG1-CD2 3.97Å; I103-L109 HydrophobicContact CG1-CG 4.44Å; L109-I135 HydrophobicContact CB-CG2 4.35Å; L109-I135 HydrophobicContact CD1-CG2 4.21Å; L109-I135 HydrophobicContact CD2-CG2 4.14Å; L109-I135 HydrophobicContact CG-CG2 4.47Å; L109-E138 HydrophobicContact CD1-CB 3.51Å; L109-A139 HydrophobicContact CB-CB 3.89Å; L109-A139 HydrophobicContact CD1-CB 4.36Å
110	L	97.8	Very high	98.2	Very high	33 Å²	33	52.7 Å²	52.7	17%	0.173	27%	0.274	C	S	.	.	S	Bend	trans	-100	-20.5	-173.8	-56.2	-179.1	0	0	0	113	N108 K118 A139 Q142 I143 L146	N108-L110 WeakPolarHBondContact OD1-CB 3.31Å; N108-L110 PolarHBondContact OD1-N 2.99Å; L110-K118 PolarHBondContact O-NZ 2.97Å; L110-A139 HydrophobicContact CD2-CB 3.85Å; L110-Q142 HydrophobicContact CD1-CB 4.04Å; L110-Q142 HydrophobicContact CG-CB 4.35Å; L110-I143 HydrophobicContact CD1-CG1 3.78Å; L110-I143 HydrophobicContact CD2-CD1 3.96Å; L110-I143 HydrophobicContact CD2-CG1 3.74Å; L110-I143 HydrophobicContact CG-CG1 4.45Å; L110-L146 HydrophobicContact CD1-CD1 3.82Å
111	E	97.3	Very high	98.2	Very high	86 Å²	86	51.2 Å²	51.2	40%	0.402	27%	0.269	S	S	.	.			trans	-58.9	146.1	176.8	-63.8	-57.3	153.5	0	0	111.6	M79 H88 N108	M79-E111 HydrophobicContact CE-CB 3.71Å; M79-E111 HydrophobicContact CE-CG 3.6Å; H88-E111 PolarHBondContact NE2-O 3.24Å; N108-E111 HydrophobicContact CB-CG 4.18Å; N108-E111 VanDerWaalsContact ND2-CG 3.31Å; N108-E111 WeakPolarHBondContact ND2-CG 3.4Å; N108-E111 PolarHBondContact ND2-OE1 3.43Å
112	L	98.1	Very high	98.2	Very high	80 Å²	80	48.9 Å²	48.9	42%	0.419	26%	0.26	S	S	.	.			trans	-109.5	133.2	177.1	-59.7	176.9	0	0	0	108.9	K118	L112-K118 HydrophobicContact CD2-CD 4.39Å; L112-K118 HydrophobicContact CD2-CG 3.42Å; L112-K118 VanDerWaalsContact CD2-CG 3.42Å
113	N	98	Very high	98.1	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.032	26%	0.26	C	S	.	.			trans	-68.7	176.2	165.5	73.1	6.3	0	0	0	111.2	M82 N83 C84 F115 G116 Q117	M82-N113 WeakPolarHBondContact O-CB 3.28Å; N83-N113 WeakPolarHBondContact O-CA 3.31Å; C84-N113 VanDerWaalsContact SG-CB 3.51Å; N113-F115 PolarHBondContact O-N 3.19Å; N113-F115 WeakPolarHBondContact OD1-CA 3.45Å; N113-F115 WeakPolarHBondContact OD1-CB 3.25Å; N113-F115 PolarHBondContact OD1-N 2.8Å; N113-G116 PolarHBondContact O-N 3.35Å; N113-G116 PolarHBondContact OD1-N 2.87Å; N113-Q117 PolarHBondContact N-O 3.05Å; N113-Q117 VanDerWaalsContact N-O 3.11Å; N113-Q117 PolarHBondContact ND2-OE1 2.83Å; N113-Q117 WeakPolarHBondContact OD1-CB 3.38Å; N113-Q117 PolarHBondContact OD1-N 2.75Å; N113-Q117 PolarHBondContact OD1-O 3.03Å
114	L	97.8	Very high	98.1	Very high	108 Å²	108	51.2 Å²	51.2	57%	0.565	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-12.4	178.8	-66.9	-175.5	0	0	0	114.5	S81 M82 N83	S81-L114 WeakPolarHBondContact O-CD1 3.28Å; M82-L114 PolarHBondContact O-N 3.29Å; M82-L114 HydrophobicContact SD-CD1 4.17Å; N83-L114 HydrophobicContact CB-CD2 4.44Å; N83-L114 HydrophobicContact CB-CG 4.36Å
115	F	97.1	Very high	98.1	Very high	131 Å²	131	46.4 Å²	46.4	58%	0.575	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	6	176.4	-52.2	-77.4	0	0	0	112.9	M82 N113 Q117	M82-F115 HydrophobicContact SD-CE2 4.36Å; M82-F115 HydrophobicContact SD-CZ 4.34Å; N113-F115 PolarHBondContact O-N 3.19Å; N113-F115 WeakPolarHBondContact OD1-CA 3.45Å; N113-F115 WeakPolarHBondContact OD1-CB 3.25Å; N113-F115 PolarHBondContact OD1-N 2.8Å; F115-Q117 VanDerWaalsContact C-N 3.32Å; F115-Q117 HydrophobicContact CB-CG 4.1Å
116	G	97.9	Very high	98.1	Very high	45 Å²	45	45.6 Å²	45.6	46%	0.464	26%	0.259	S	S	.	.	S	Bend	trans	72.9	23.2	-179	0	0	0	0	0	113.7	N113	N113-G116 PolarHBondContact O-N 3.35Å; N113-G116 PolarHBondContact OD1-N 2.87Å
117	Q	98.5	Very high	98.2	Very high	53 Å²	53	51.4 Å²	51.4	25%	0.248	27%	0.273	C	S	.	.			trans	-106.8	133.6	-175.5	-56.6	177.6	-66	0	0	110.8	H88 N113 F115 D121 L122	H88-Q117 PolarHBondContact NE2-O 3.29Å; N113-Q117 PolarHBondContact N-O 3.05Å; N113-Q117 VanDerWaalsContact N-O 3.11Å; N113-Q117 PolarHBondContact ND2-OE1 2.83Å; N113-Q117 WeakPolarHBondContact OD1-CB 3.38Å; N113-Q117 PolarHBondContact OD1-N 2.75Å; N113-Q117 PolarHBondContact OD1-O 3.03Å; F115-Q117 VanDerWaalsContact C-N 3.32Å; F115-Q117 HydrophobicContact CB-CG 4.1Å; Q117-D121 HydrophobicContact CB-CB 4.1Å; Q117-L122 HydrophobicContact CB-CD2 4.22Å; Q117-L122 HydrophobicContact CB-CG 4.28Å
118	K	98.5	Very high	98.1	Very high	70 Å²	70	55 Å²	55	30%	0.304	29%	0.289	S	S	.	.			trans	-80.1	166.6	165.1	-62.2	-179.8	-166.6	-69.4	0	109.9	L110 L112 A120 D121 L122	L110-K118 PolarHBondContact O-NZ 2.97Å; L112-K118 HydrophobicContact CD2-CD 4.39Å; L112-K118 HydrophobicContact CD2-CG 3.42Å; L112-K118 VanDerWaalsContact CD2-CG 3.42Å; K118-A120 PolarHBondContact O-N 2.88Å; K118-A120 VanDerWaalsContact O-N 3.16Å; K118-D121 WeakPolarHBondContact CB-OD2 3.35Å; K118-D121 PolarHBondContact N-OD2 2.95Å; K118-D121 WeakPolarHBondContact O-CB 3.39Å; K118-D121 PolarHBondContact O-N 3.08Å; K118-L122 PolarHBondContact O-N 3.36Å
119	P	98.5	Very high	98.1	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-54.8	-36.6	174.4	-25.9	35	0	0	0	113.3	V87 H88 A91 D121 L122 A123 I135	V87-P119 HydrophobicContact CB-CG 4.47Å; V87-P119 HydrophobicContact CG1-CB 4.38Å; V87-P119 HydrophobicContact CG1-CG 3.69Å; V87-P119 HydrophobicContact CG2-CB 4.08Å; V87-P119 HydrophobicContact CG2-CG 4.26Å; H88-P119 WeakPolarHBondContact NE2-CD 3.47Å; A91-P119 HydrophobicContact CB-CB 3.89Å; A91-P119 WeakPolarHBondContact CB-O 3.39Å; P119-D121 VanDerWaalsContact C-N 3.32Å; P119-D121 PolarHBondContact O-N 3.33Å; P119-L122 PolarHBondContact O-N 2.88Å; P119-A123 PolarHBondContact O-N 3.07Å; P119-I135 HydrophobicContact CB-CD1 4.28Å; P119-I135 HydrophobicContact CB-CG2 4.28Å
120	A	98.6	Very high	98.1	Very high	4 Å²	4	62.2 Å²	62.2	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-63.5	-34.9	176.2	0	0	0	0	0	113.5	K118 L122 A123 L124 A132 I135 R136	K118-A120 PolarHBondContact O-N 2.88Å; K118-A120 VanDerWaalsContact O-N 3.16Å; A120-L122 VanDerWaalsContact C-N 3.35Å; A120-A123 PolarHBondContact O-N 3.11Å; A120-L124 WeakPolarHBondContact O-CB 3.36Å; A120-L124 PolarHBondContact O-N 3.23Å; A120-A132 HydrophobicContact CB-CB 4.45Å; A120-A132 VanDerWaalsContact O-CB 3.32Å; A120-A132 WeakPolarHBondContact O-CB 3.43Å; A120-I135 HydrophobicContact CB-CB 3.95Å; A120-I135 HydrophobicContact CB-CG2 3.72Å; A120-R136 HydrophobicContact CB-CG 3.73Å
121	D	98.6	Very high	98.2	Very high	55 Å²	55	61 Å²	61	29%	0.294	33%	0.325	S	S	.	.	H	α-helix	trans	-72.4	-35.3	-179.7	-55.3	-41.8	0	0	0	110.4	Q117 K118 P119 L124 A125 R136	Q117-D121 HydrophobicContact CB-CB 4.1Å; K118-D121 WeakPolarHBondContact CB-OD2 3.35Å; K118-D121 PolarHBondContact N-OD2 2.95Å; K118-D121 WeakPolarHBondContact O-CB 3.39Å; K118-D121 PolarHBondContact O-N 3.08Å; P119-D121 VanDerWaalsContact C-N 3.32Å; P119-D121 PolarHBondContact O-N 3.33Å; D121-L124 PolarHBondContact O-N 2.94Å; D121-A125 VanDerWaalsContact O-CB 3.29Å; D121-A125 WeakPolarHBondContact O-CB 3.39Å; D121-A125 PolarHBondContact O-N 3.34Å; D121-R136 IonicContact OD1-NH2 2.61Å
122	L	98.5	Very high	98.2	Very high	1 Å²	1	57 Å²	57	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-65.3	-44.2	171.5	-66.5	179	0	0	0	112.2	H88 R92 Q117 K118 P119 A120 L124 A125 N126	H88-L122 HydrophobicContact CB-CD1 3.66Å; H88-L122 WeakPolarHBondContact O-CD1 3.45Å; R92-L122 HydrophobicContact CB-CB 4.16Å; R92-L122 HydrophobicContact CB-CD1 4.46Å; Q117-L122 HydrophobicContact CB-CD2 4.22Å; Q117-L122 HydrophobicContact CB-CG 4.28Å; K118-L122 PolarHBondContact O-N 3.36Å; P119-L122 PolarHBondContact O-N 2.88Å; A120-L122 VanDerWaalsContact C-N 3.35Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L122-L124 PolarHBondContact O-N 2.95Å; L122-A125 PolarHBondContact O-N 3.49Å; L122-N126 PolarHBondContact O-N 3.31Å; L122-N126 VanDerWaalsContact O-N 3.11Å; L122-N126 PolarHBondContact O-ND2 3.16Å
123	A	98.7	Very high	98.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-45.6	174.5	0	0	0	0	0	111.4	A91 P119 A120 N126 H127 F128 L131 A132 I135	A91-A123 HydrophobicContact CB-CB 4.18Å; A91-A123 WeakPolarHBondContact O-CA 3.43Å; P119-A123 PolarHBondContact O-N 3.07Å; A120-A123 PolarHBondContact O-N 3.11Å; A123-N126 CarbonylContact O-C 3.37Å; A123-N126 PolarHBondContact O-N 3Å; A123-H127 PolarHBondContact O-N 2.88Å; A123-F128 HydrophobicContact CB-CB 4.22Å; A123-F128 WeakPolarHBondContact O-CA 3.2Å; A123-F128 WeakPolarHBondContact O-CB 3.41Å; A123-F128 PolarHBondContact O-N 3.41Å; A123-L131 HydrophobicContact CB-CB 4.49Å; A123-L131 HydrophobicContact CB-CD2 4.4Å; A123-L131 HydrophobicContact CB-CG 4.3Å; A123-A132 HydrophobicContact CB-CB 3.95Å; A123-I135 HydrophobicContact CB-CD1 4.4Å
124	L	98.4	Very high	98.2	Very high	80 Å²	80	58.5 Å²	58.5	42%	0.419	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-44.2	178.3	-175.9	62.2	0	0	0	112.3	A120 D121 L122 N126 H127 P129 A132	A120-L124 WeakPolarHBondContact O-CB 3.36Å; A120-L124 PolarHBondContact O-N 3.23Å; D121-L124 PolarHBondContact O-N 2.94Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L122-L124 PolarHBondContact O-N 2.95Å; L124-N126 PolarHBondContact O-N 2.99Å; L124-H127 PolarHBondContact O-N 2.99Å; L124-H127 VanDerWaalsContact O-N 3.14Å; L124-P129 HydrophobicContact CD1-CB 4.44Å; L124-A132 HydrophobicContact CB-CB 4.13Å
125	A	98.1	Very high	98.3	Very high	59 Å²	59	53.4 Å²	53.4	49%	0.488	29%	0.289	S	S	.	.	H	α-helix	trans	-63.2	-24	179.1	0	0	0	0	0	113.3	D121 L122	D121-A125 VanDerWaalsContact O-CB 3.29Å; D121-A125 WeakPolarHBondContact O-CB 3.39Å; D121-A125 PolarHBondContact O-N 3.34Å; L122-A125 PolarHBondContact O-N 3.49Å
126	N	98	Very high	98.4	Very high	59 Å²	59	51.5 Å²	51.5	32%	0.316	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	21.6	178.3	-66	-91.5	0	0	0	112.6	R92 L122 A123 L124 F128	R92-N126 WeakPolarHBondContact O-CB 3.5Å; L122-N126 PolarHBondContact O-N 3.31Å; L122-N126 VanDerWaalsContact O-N 3.11Å; L122-N126 PolarHBondContact O-ND2 3.16Å; A123-N126 CarbonylContact O-C 3.37Å; A123-N126 PolarHBondContact O-N 3Å; L124-N126 PolarHBondContact O-N 2.99Å; N126-F128 HydrophobicContact CB-CD2 3.97Å; N126-F128 HydrophobicContact CB-CE2 3.78Å; N126-F128 WeakPolarHBondContact O-CD2 3.47Å; N126-F128 WeakPolarHBondContact O-CE2 3.34Å
127	H	97.8	Very high	98.4	Very high	167 Å²	167	55.7 Å²	55.7	77%	0.773	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	33.3	171.9	-46.4	-67.3	0	0	0	115.8	A123 L124 P129	A123-H127 PolarHBondContact O-N 2.88Å; L124-H127 PolarHBondContact O-N 2.99Å; L124-H127 VanDerWaalsContact O-N 3.14Å; H127-P129 WeakPolarHBondContact O-CD 3.36Å
128	F	98.3	Very high	98.4	Very high	75 Å²	75	55.2 Å²	55.2	33%	0.329	28%	0.277	S	S	.	.			trans	-112.9	67.1	172.3	-51.6	-67.6	0	0	0	111.9	R92 G94 A123 N126 D130 L131 A132	R92-F128 WeakPolarHBondContact O-CE2 3.3Å; G94-F128 VanDerWaalsContact CA-CD2 3.46Å; G94-F128 VanDerWaalsContact CA-CE2 3.46Å; G94-F128 VanDerWaalsContact N-CE2 3.29Å; A123-F128 HydrophobicContact CB-CB 4.22Å; A123-F128 WeakPolarHBondContact O-CA 3.2Å; A123-F128 WeakPolarHBondContact O-CB 3.41Å; A123-F128 PolarHBondContact O-N 3.41Å; N126-F128 HydrophobicContact CB-CD2 3.97Å; N126-F128 HydrophobicContact CB-CE2 3.78Å; N126-F128 WeakPolarHBondContact O-CD2 3.47Å; N126-F128 WeakPolarHBondContact O-CE2 3.34Å; F128-D130 PolarHBondContact O-N 2.95Å; F128-L131 HydrophobicContact CB-CB 4.02Å; F128-L131 HydrophobicContact CB-CD2 4.42Å; F128-L131 PolarHBondContact O-N 3.11Å; F128-A132 PolarHBondContact O-N 3.4Å
129	P	97.7	Very high	98.4	Very high	64 Å²	64	52.3 Å²	52.3	42%	0.416	27%	0.267	S	S	.	.	H	α-helix	trans	-63.8	-41.4	-174.3	25.9	-34.6	0	0	0	113.2	L124 H127 L131 A132 D133	L124-P129 HydrophobicContact CD1-CB 4.44Å; H127-P129 WeakPolarHBondContact O-CD 3.36Å; P129-L131 VanDerWaalsContact C-N 3.3Å; P129-L131 PolarHBondContact O-N 3.29Å; P129-A132 WeakPolarHBondContact O-CB 3.46Å; P129-A132 PolarHBondContact O-N 3.01Å; P129-A132 VanDerWaalsContact O-N 3.16Å; P129-D133 PolarHBondContact O-N 3.24Å
130	D	98.4	Very high	98.3	Very high	131 Å²	131	59 Å²	59	70%	0.701	30%	0.296	S	S	*	.	H	α-helix	trans	-61.8	-41	179.7	-64.2	-23.9	0	0	0	111.5	F128 D133 V134	F128-D130 PolarHBondContact O-N 2.95Å; D130-D133 PolarHBondContact O-N 2.96Å; D130-V134 WeakPolarHBondContact O-CG2 3.44Å; D130-V134 PolarHBondContact O-N 3.42Å
131	L	98.6	Very high	98.3	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.042	32%	0.317	C	S	.	.	H	α-helix	trans	-66.3	-43.7	175.1	-179.4	56.6	0	0	0	111.4	V99 A123 F128 P129 D133 V134 I135	V99-L131 HydrophobicContact CB-CD1 3.96Å; V99-L131 HydrophobicContact CG1-CD1 3.9Å; V99-L131 HydrophobicContact CG2-CD1 4.14Å; V99-L131 HydrophobicContact CG2-CD2 4.2Å; A123-L131 HydrophobicContact CB-CB 4.49Å; A123-L131 HydrophobicContact CB-CD2 4.4Å; A123-L131 HydrophobicContact CB-CG 4.3Å; F128-L131 HydrophobicContact CB-CB 4.02Å; F128-L131 HydrophobicContact CB-CD2 4.42Å; F128-L131 PolarHBondContact O-N 3.11Å; P129-L131 VanDerWaalsContact C-N 3.3Å; P129-L131 PolarHBondContact O-N 3.29Å; L131-D133 PolarHBondContact O-N 3.16Å; L131-V134 PolarHBondContact O-N 3.32Å; L131-I135 HydrophobicContact CD1-CD1 4.22Å; L131-I135 HydrophobicContact CD1-CG1 4.32Å; L131-I135 HydrophobicContact CG-CD1 4.01Å; L131-I135 WeakPolarHBondContact O-CG1 3.41Å; L131-I135 PolarHBondContact O-N 2.92Å
132	A	98.6	Very high	98.2	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-57.5	-39.7	175.5	0	0	0	0	0	111.6	A120 A123 L124 F128 P129 I135 R136	A120-A132 HydrophobicContact CB-CB 4.45Å; A120-A132 VanDerWaalsContact O-CB 3.32Å; A120-A132 WeakPolarHBondContact O-CB 3.43Å; A123-A132 HydrophobicContact CB-CB 3.95Å; L124-A132 HydrophobicContact CB-CB 4.13Å; F128-A132 PolarHBondContact O-N 3.4Å; P129-A132 WeakPolarHBondContact O-CB 3.46Å; P129-A132 PolarHBondContact O-N 3.01Å; P129-A132 VanDerWaalsContact O-N 3.16Å; A132-I135 PolarHBondContact O-N 3.33Å; A132-R136 WeakPolarHBondContact O-CB 3.12Å; A132-R136 VanDerWaalsContact O-CG 3.25Å; A132-R136 WeakPolarHBondContact O-CG 3.34Å; A132-R136 PolarHBondContact O-N 2.87Å
133	D	98.4	Very high	98.1	Very high	83 Å²	83	67.2 Å²	67.2	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-69.2	-38.5	177.8	-77.2	-11.9	0	0	0	112.9	P129 D130 L131 R136 R137	P129-D133 PolarHBondContact O-N 3.24Å; D130-D133 PolarHBondContact O-N 2.96Å; L131-D133 PolarHBondContact O-N 3.16Å; D133-R136 IonicContact OD1-NH1 2.75Å; D133-R137 WeakPolarHBondContact O-CB 3.37Å; D133-R137 PolarHBondContact O-N 2.98Å
134	V	98.4	Very high	97.9	Very high	35 Å²	35	74.2 Å²	74.2	21%	0.212	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-50.9	170.9	171.4	0	0	0	0	110.3	D130 L131 R136 R137 E138	D130-V134 WeakPolarHBondContact O-CG2 3.44Å; D130-V134 PolarHBondContact O-N 3.42Å; L131-V134 PolarHBondContact O-N 3.32Å; V134-R136 PolarHBondContact O-N 3.07Å; V134-R137 WeakPolarHBondContact O-CB 3.47Å; V134-R137 PolarHBondContact O-N 3.4Å; V134-R137 VanDerWaalsContact O-N 3.16Å; V134-E138 PolarHBondContact O-N 2.95Å
135	I	98.6	Very high	97.7	Very high	1 Å²	1	74.3 Å²	74.3	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-45.8	179.9	-65.1	167.2	0	0	0	110.7	A91 V99 L109 P119 A120 A123 L131 A132 R137 E138 A139	A91-I135 HydrophobicContact CB-CD1 3.62Å; V99-I135 HydrophobicContact CG1-CD1 3.97Å; V99-I135 HydrophobicContact CG1-CG1 3.71Å; L109-I135 HydrophobicContact CB-CG2 4.35Å; L109-I135 HydrophobicContact CD1-CG2 4.21Å; L109-I135 HydrophobicContact CD2-CG2 4.14Å; L109-I135 HydrophobicContact CG-CG2 4.47Å; P119-I135 HydrophobicContact CB-CD1 4.28Å; P119-I135 HydrophobicContact CB-CG2 4.28Å; A120-I135 HydrophobicContact CB-CB 3.95Å; A120-I135 HydrophobicContact CB-CG2 3.72Å; A123-I135 HydrophobicContact CB-CD1 4.4Å; L131-I135 HydrophobicContact CD1-CD1 4.22Å; L131-I135 HydrophobicContact CD1-CG1 4.32Å; L131-I135 HydrophobicContact CG-CD1 4.01Å; L131-I135 WeakPolarHBondContact O-CG1 3.41Å; L131-I135 PolarHBondContact O-N 2.92Å; A132-I135 PolarHBondContact O-N 3.33Å; I135-R137 VanDerWaalsContact C-N 3.28Å; I135-R137 PolarHBondContact O-N 3.21Å; I135-E138 PolarHBondContact O-N 3.05Å; I135-A139 VanDerWaalsContact O-CB 3.28Å; I135-A139 WeakPolarHBondContact O-CB 3.39Å; I135-A139 PolarHBondContact O-N 3.26Å
136	R	98.6	Very high	97.4	Very high	91 Å²	91	76 Å²	76	34%	0.343	36%	0.363	S	S	.	.	H	α-helix	trans	-59.9	-38.7	177.7	-78	168.3	176.3	162.3	-0.6	112.3	A120 D121 A132 D133 V134 K140	A120-R136 HydrophobicContact CB-CG 3.73Å; D121-R136 IonicContact OD1-NH2 2.61Å; A132-R136 WeakPolarHBondContact O-CB 3.12Å; A132-R136 VanDerWaalsContact O-CG 3.25Å; A132-R136 WeakPolarHBondContact O-CG 3.34Å; A132-R136 PolarHBondContact O-N 2.87Å; D133-R136 IonicContact OD1-NH1 2.75Å; V134-R136 PolarHBondContact O-N 3.07Å; R136-K140 WeakPolarHBondContact O-CG 3.32Å; R136-K140 PolarHBondContact O-N 3.16Å
137	R	98.4	Very high	97.1	Very high	133 Å²	133	78.7 Å²	78.7	50%	0.502	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-45.6	177.7	-167.9	-169.7	-45.6	131.3	8.3	111.3	D133 V134 I135 K140 K141	D133-R137 WeakPolarHBondContact O-CB 3.37Å; D133-R137 PolarHBondContact O-N 2.98Å; V134-R137 WeakPolarHBondContact O-CB 3.47Å; V134-R137 PolarHBondContact O-N 3.4Å; V134-R137 VanDerWaalsContact O-N 3.16Å; I135-R137 VanDerWaalsContact C-N 3.28Å; I135-R137 PolarHBondContact O-N 3.21Å; R137-K140 PolarHBondContact O-N 2.76Å; R137-K141 PolarHBondContact O-N 3.18Å
138	E	98.3	Very high	96.8	Very high	43 Å²	43	74.3 Å²	74.3	20%	0.201	36%	0.362	C	S	.	.	H	α-helix	trans	-70.6	-37.3	178.1	-62.5	-52.5	132.4	0	0	112	I103 L109 V134 I135 K140 K141 Q142	I103-E138 HydrophobicContact CD1-CB 4.29Å; I103-E138 HydrophobicContact CD1-CG 4.15Å; I103-E138 HydrophobicContact CG2-CB 4.3Å; I103-E138 HydrophobicContact CG2-CG 4.17Å; L109-E138 HydrophobicContact CD1-CB 3.51Å; V134-E138 PolarHBondContact O-N 2.95Å; I135-E138 PolarHBondContact O-N 3.05Å; E138-K140 VanDerWaalsContact C-N 3.33Å; E138-K140 PolarHBondContact O-N 3.45Å; E138-K141 WeakPolarHBondContact O-CA 3.44Å; E138-K141 WeakPolarHBondContact O-CB 3.46Å; E138-K141 PolarHBondContact O-N 3.32Å; E138-K141 WeakPolarHBondContact OE1-CE 3.5Å; E138-K141 IonicContact OE1-NZ 2.8Å; E138-K141 PolarHBondContact OE1-NZ 3.43Å; E138-K141 WeakPolarHBondContact OE2-CD 3.29Å; E138-K141 WeakPolarHBondContact OE2-CE 3.32Å; E138-K141 IonicContact OE2-NZ 3.33Å; E138-K141 PolarHBondContact OE2-NZ 3.09Å; E138-Q142 PolarHBondContact O-N 3.47Å; E138-Q142 VanDerWaalsContact O-N 3.11Å
139	A	98.1	Very high	96.2	Very high	10 Å²	10	76.8 Å²	76.8	8%	0.083	37%	0.373	C	S	.	.	H	α-helix	trans	-59.1	-41.6	174	0	0	0	0	0	112	L109 L110 I135 K141 Q142 I143	L109-A139 HydrophobicContact CB-CB 3.89Å; L109-A139 HydrophobicContact CD1-CB 4.36Å; L110-A139 HydrophobicContact CD2-CB 3.85Å; I135-A139 VanDerWaalsContact O-CB 3.28Å; I135-A139 WeakPolarHBondContact O-CB 3.39Å; I135-A139 PolarHBondContact O-N 3.26Å; A139-K141 PolarHBondContact O-N 2.98Å; A139-Q142 WeakPolarHBondContact O-CB 3.42Å; A139-Q142 PolarHBondContact O-N 2.95Å; A139-Q142 VanDerWaalsContact O-N 3.1Å; A139-I143 WeakPolarHBondContact O-CG1 3.33Å; A139-I143 PolarHBondContact O-N 2.82Å
140	K	98.1	Very high	95.5	Very high	140 Å²	140	78.4 Å²	78.4	61%	0.609	38%	0.382	S	S	*	.	H	α-helix	trans	-59.3	-33	173.5	-75.3	173.9	-178.7	179.4	0	112.6	R136 R137 E138 K144	R136-K140 WeakPolarHBondContact O-CG 3.32Å; R136-K140 PolarHBondContact O-N 3.16Å; R137-K140 PolarHBondContact O-N 2.76Å; E138-K140 VanDerWaalsContact C-N 3.33Å; E138-K140 PolarHBondContact O-N 3.45Å; K140-K144 WeakPolarHBondContact O-CG 3.35Å; K140-K144 PolarHBondContact O-N 2.63Å
141	K	97.6	Very high	94.1	Very high	111 Å²	111	78.9 Å²	78.9	48%	0.483	38%	0.384	S	S	.	.	H	α-helix	trans	-70.6	-39.4	174.9	-58.7	-178.5	-165.4	162.5	0	111.4	R137 E138 A139 I143 K144 N145	R137-K141 PolarHBondContact O-N 3.18Å; E138-K141 WeakPolarHBondContact O-CA 3.44Å; E138-K141 WeakPolarHBondContact O-CB 3.46Å; E138-K141 PolarHBondContact O-N 3.32Å; E138-K141 WeakPolarHBondContact OE1-CE 3.5Å; E138-K141 IonicContact OE1-NZ 2.8Å; E138-K141 PolarHBondContact OE1-NZ 3.43Å; E138-K141 WeakPolarHBondContact OE2-CD 3.29Å; E138-K141 WeakPolarHBondContact OE2-CE 3.32Å; E138-K141 IonicContact OE2-NZ 3.33Å; E138-K141 PolarHBondContact OE2-NZ 3.09Å; A139-K141 PolarHBondContact O-N 2.98Å; K141-I143 VanDerWaalsContact C-N 3.34Å; K141-I143 PolarHBondContact O-N 3.19Å; K141-K144 PolarHBondContact O-N 3.25Å; K141-N145 WeakPolarHBondContact O-CB 3.49Å; K141-N145 PolarHBondContact O-N 2.77Å
142	Q	97	Very high	92.3	Very high	48 Å²	48	84.4 Å²	84.4	22%	0.224	41%	0.409	C	S	.	.	H	α-helix	trans	-60.8	-43.1	175	-67.8	-175.5	-10	0	0	111.6	A107 L110 E138 A139 N145 L146	A107-Q142 PolarHBondContact O-NE2 2.84Å; L110-Q142 HydrophobicContact CD1-CB 4.04Å; L110-Q142 HydrophobicContact CG-CB 4.35Å; E138-Q142 PolarHBondContact O-N 3.47Å; E138-Q142 VanDerWaalsContact O-N 3.11Å; A139-Q142 WeakPolarHBondContact O-CB 3.42Å; A139-Q142 PolarHBondContact O-N 2.95Å; A139-Q142 VanDerWaalsContact O-N 3.1Å; Q142-N145 PolarHBondContact O-N 3.06Å; Q142-L146 WeakPolarHBondContact O-CG 3.37Å; Q142-L146 PolarHBondContact O-N 3.28Å
143	I	96	Very high	90.2	Very high	74 Å²	74	91.1 Å²	91.1	38%	0.379	45%	0.453	S	S	.	.	H	α-helix	trans	-58.9	-52.5	175.8	-65.3	167.8	0	0	0	111	L110 A139 K141 N145 L146 E147	L110-I143 HydrophobicContact CD1-CG1 3.78Å; L110-I143 HydrophobicContact CD2-CD1 3.96Å; L110-I143 HydrophobicContact CD2-CG1 3.74Å; L110-I143 HydrophobicContact CG-CG1 4.45Å; A139-I143 WeakPolarHBondContact O-CG1 3.33Å; A139-I143 PolarHBondContact O-N 2.82Å; K141-I143 VanDerWaalsContact C-N 3.34Å; K141-I143 PolarHBondContact O-N 3.19Å; I143-N145 PolarHBondContact O-N 3.21Å; I143-L146 WeakPolarHBondContact O-CB 3.49Å; I143-L146 PolarHBondContact O-N 3.34Å; I143-E147 HydrophobicContact CG2-CG 4.4Å; I143-E147 WeakPolarHBondContact O-CG 3.17Å; I143-E147 PolarHBondContact O-N 2.91Å
144	K	95.4	Very high	88.4	Confident	146 Å²	146	89.9 Å²	89.9	64%	0.635	46%	0.459	S	S	*	.	H	α-helix	trans	-57.8	-38.2	178.9	-72	179	178.9	-171.8	0	112.7	K140 K141 E147 S148	K140-K144 WeakPolarHBondContact O-CG 3.35Å; K140-K144 PolarHBondContact O-N 2.63Å; K141-K144 PolarHBondContact O-N 3.25Å; K144-E147 PolarHBondContact O-N 3.44Å; K144-S148 PolarHBondContact O-N 3.45Å; K144-S148 PolarHBondContact O-OG 2.91Å
145	N	93	Very high	86.5	Confident	82 Å²	82	93.6 Å²	93.6	44%	0.439	48%	0.478	S	S	.	.	H	α-helix	trans	-66	-39.2	176.9	-174.3	33.5	0	0	0	111.7	K141 Q142 I143 S148 K149	K141-N145 WeakPolarHBondContact O-CB 3.49Å; K141-N145 PolarHBondContact O-N 2.77Å; Q142-N145 PolarHBondContact O-N 3.06Å; I143-N145 PolarHBondContact O-N 3.21Å; N145-S148 WeakPolarHBondContact CA-OG 3.16Å; N145-S148 PolarHBondContact O-N 3Å; N145-S148 PolarHBondContact O-OG 3.44Å; N145-K149 WeakPolarHBondContact O-CG 3.2Å; N145-K149 PolarHBondContact O-N 3.36Å
146	L	91.7	Very high	84.5	Confident	94 Å²	94	98.6 Å²	98.6	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-64.6	-47.4	174.6	-68.7	169.6	0	0	0	111.2	L110 Q142 I143 S148 K149 T150	L110-L146 HydrophobicContact CD1-CD1 3.82Å; Q142-L146 WeakPolarHBondContact O-CG 3.37Å; Q142-L146 PolarHBondContact O-N 3.28Å; I143-L146 WeakPolarHBondContact O-CB 3.49Å; I143-L146 PolarHBondContact O-N 3.34Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.46Å; L146-K149 PolarHBondContact O-N 2.93Å; L146-T150 PolarHBondContact O-N 3.16Å; L146-T150 VanDerWaalsContact O-N 3.09Å; L146-T150 PolarHBondContact O-OG1 3.48Å
147	E	92.7	Very high	82.4	Confident	116 Å²	116	100.8 Å²	100.8	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-57.7	-41.9	176.7	-67.9	171.5	162.3	0	0	112	I143 K144 K149 T150 L151	I143-E147 HydrophobicContact CG2-CG 4.4Å; I143-E147 WeakPolarHBondContact O-CG 3.17Å; I143-E147 PolarHBondContact O-N 2.91Å; K144-E147 PolarHBondContact O-N 3.44Å; E147-K149 VanDerWaalsContact C-N 3.26Å; E147-K149 PolarHBondContact O-N 2.99Å; E147-T150 PolarHBondContact O-N 3.37Å; E147-T150 PolarHBondContact O-OG1 3.38Å; E147-L151 PolarHBondContact O-N 2.83Å; E147-L151 VanDerWaalsContact O-N 3.17Å
148	S	90.4	Very high	80	Confident	76 Å²	76	103.3 Å²	103.3	53%	0.531	55%	0.547	S	S	.	.	H	α-helix	trans	-66.4	-25.3	176.8	65.8	0	0	0	0	114	K144 N145 L146	K144-S148 PolarHBondContact O-N 3.45Å; K144-S148 PolarHBondContact O-OG 2.91Å; N145-S148 WeakPolarHBondContact CA-OG 3.16Å; N145-S148 PolarHBondContact O-N 3Å; N145-S148 PolarHBondContact O-OG 3.44Å; L146-S148 VanDerWaalsContact C-N 3.3Å; L146-S148 PolarHBondContact O-N 3.46Å
149	K	85.6	Confident	77.6	Confident	126 Å²	126	108.7 Å²	108.7	55%	0.548	58%	0.577	S	S	.	*	H	α-helix	trans	-83.4	-30.6	177.6	-74.5	175.5	-179.8	-175.3	0	112.4	N145 L146 E147 H152	N145-K149 WeakPolarHBondContact O-CG 3.2Å; N145-K149 PolarHBondContact O-N 3.36Å; L146-K149 PolarHBondContact O-N 2.93Å; E147-K149 VanDerWaalsContact C-N 3.26Å; E147-K149 PolarHBondContact O-N 2.99Å; K149-H152 PolarHBondContact O-CE1 3.37Å; K149-H152 PolarHBondContact O-NE2 3.29Å
150	T	82.8	Confident	75.6	Confident	99 Å²	99	116.2 Å²	116.2	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-80.4	-27.7	179.3	53.5	0	0	0	0	112.7	L146 E147 H152	L146-T150 PolarHBondContact O-N 3.16Å; L146-T150 VanDerWaalsContact O-N 3.09Å; L146-T150 PolarHBondContact O-OG1 3.48Å; E147-T150 PolarHBondContact O-N 3.37Å; E147-T150 PolarHBondContact O-OG1 3.38Å; T150-H152 PolarHBondContact O-N 3.11Å; T150-H152 VanDerWaalsContact O-N 3.1Å
151	L	69.6	Low	74.4	Confident	140 Å²	140	115.1 Å²	115.1	73%	0.733	64%	0.641	S	S	*	*			trans	-84.5	75.7	178.2	-167.6	68.5	0	0	0	110.5	E147	E147-L151 PolarHBondContact O-N 2.83Å; E147-L151 VanDerWaalsContact O-N 3.17Å
152	H	61.3	Low	73.2	Confident	125 Å²	125	115.3 Å²	115.3	58%	0.579	65%	0.649	S	S	*	*			trans	-74.9	137.1	168.4	-69.8	-53.6	0	0	0	110.2	K149 T150 G154 D155	K149-H152 PolarHBondContact O-CE1 3.37Å; K149-H152 PolarHBondContact O-NE2 3.29Å; T150-H152 PolarHBondContact O-N 3.11Å; T150-H152 VanDerWaalsContact O-N 3.1Å; H152-G154 PolarHBondContact O-N 3.23Å; H152-D155 PolarHBondContact O-N 3.29Å
153	P	53.8	Low	71.9	Confident	141 Å²	141	119 Å²	119	92%	0.916	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	79.9	174.7	29.2	-31.6	0	0	0	109.3
154	G	60.8	Low	70.5	Confident	56 Å²	56	121.6 Å²	121.6	58%	0.577	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.3	-24	-176.3	0	0	0	0	0	112.2	H152 S156	H152-G154 PolarHBondContact O-N 3.23Å; G154-S156 PolarHBondContact O-N 2.84Å
155	D	58.2	Low	68.9	Low	113 Å²	113	120.1 Å²	120.1	60%	0.604	69%	0.693	S	S	*	*			trans	-78.6	24.2	176.1	-65	-22.9	0	0	0	113.5	H152 I157	H152-D155 PolarHBondContact O-N 3.29Å; D155-I157 PolarHBondContact O-N 3.31Å
156	S	56.3	Low	67.3	Low	106 Å²	106	122.7 Å²	122.7	74%	0.741	71%	0.71	S	S	*	*			trans	-65.1	86.5	150.9	-64.6	0	0	0	0	106.8	G154 E158	G154-S156 PolarHBondContact O-N 2.84Å; S156-E158 PolarHBondContact O-N 3.36Å
157	I	55.4	Low	65.6	Low	137 Å²	137	124.7 Å²	124.7	70%	0.703	73%	0.726	S	S	*	*			trans	-58.7	96.8	162.8	-49.3	174	0	0	0	104.9	D155 L159	D155-I157 PolarHBondContact O-N 3.31Å; I157-L159 HydrophobicContact CG2-CD1 4.37Å; I157-L159 HydrophobicContact CG2-CG 3.9Å; I157-L159 PolarHBondContact O-N 3.24Å
158	E	47.6	Very low	63.5	Low	186 Å²	186	125.4 Å²	125.4	87%	0.869	74%	0.74	S	S	*	*			trans	-60.2	88.3	156.9	-86.4	-170.5	150.9	0	0	106.2	S156 A160	S156-E158 PolarHBondContact O-N 3.36Å; E158-A160 PolarHBondContact O-N 3.14Å
159	L	47.5	Very low	61.3	Low	156 Å²	156	129.5 Å²	129.5	82%	0.817	76%	0.758	S	S	*	*			trans	-75.7	100	155.5	-83.2	160.2	0	0	0	105.7	I157	I157-L159 HydrophobicContact CG2-CD1 4.37Å; I157-L159 HydrophobicContact CG2-CG 3.9Å; I157-L159 PolarHBondContact O-N 3.24Å
160	A	56.4	Low	59	Low	169 Å²	169	129.8 Å²	129.8	100%	1.397	78%	0.777	S	S	*	*			trans	-53.7	0	168.7	0	0	0	0	0	112.5	E158	E158-A160 PolarHBondContact O-N 3.14Å

Retrieved 160 of 160 residues in 34.6 ms (Link to these results)

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