A0A5K4FB87_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FB87, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 276 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

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	38.8	Very low	45.1	Very low	222 Å²	222	144.3 Å²	144.3	100%	1.094	70%	0.701	S	S	*	*				0	89.3	0	-168.6	174.9	171.2	0	0	106.9	L3	M1-L3 PolarHBondContact O-N 3.2Å
2	T	38.9	Very low	45.9	Very low	127 Å²	127	141.3 Å²	141.3	78%	0.779	68%	0.684	S	S	*	*			trans	-85.9	102.8	-174.7	-47.3	0	0	0	0	108.1	Y4	T2-Y4 HydrophobicContact CG2-CD2 4.28Å; T2-Y4 HydrophobicContact CG2-CE2 4.37Å; T2-Y4 PolarHBondContact O-N 3.29Å
3	L	37.6	Very low	46.4	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	67%	0.674	S	S	*	*			trans	-73.4	103.9	177	-80.6	158.3	0	0	0	109.3	M1 F5	M1-L3 PolarHBondContact O-N 3.2Å; L3-F5 PolarHBondContact O-N 3.38Å
4	Y	38.9	Very low	46.9	Very low	205 Å²	205	134.5 Å²	134.5	80%	0.804	66%	0.656	S	S	*	*			trans	-85.9	85.7	170.6	-104.7	-94.4	0	0	0	109.8	T2	T2-Y4 HydrophobicContact CG2-CD2 4.28Å; T2-Y4 HydrophobicContact CG2-CE2 4.37Å; T2-Y4 PolarHBondContact O-N 3.29Å
5	F	41.1	Very low	47.4	Very low	189 Å²	189	133.4 Å²	133.4	83%	0.829	65%	0.649	S	S	*	*			trans	-157.5	138.5	160.9	-89.7	-82.3	0	0	0	106.5	L3	L3-F5 PolarHBondContact O-N 3.38Å
6	P	47.8	Very low	47.8	Very low	69 Å²	69	130.9 Å²	130.9	45%	0.448	64%	0.638	S	S	.	*			cis	-147.3	108.3	6.9	23.5	5.4	0	0	0	114.2	Y8 S9	P6-Y8 PolarHBondContact O-N 2.94Å; P6-S9 WeakPolarHBondContact CB-OG 3.42Å; P6-S9 VanDerWaalsContact CG-OG 3.22Å; P6-S9 WeakPolarHBondContact CG-OG 3.39Å; P6-S9 PolarHBondContact O-N 2.91Å; P6-S9 PolarHBondContact O-OG 3.24Å; P6-S9 VanDerWaalsContact O-OG 3.06Å
7	I	48.7	Very low	48	Very low	153 Å²	153	127.5 Å²	127.5	79%	0.785	63%	0.631	S	S	*	*	H	α-helix	trans	-65.8	-25.6	162.1	-62.3	172.8	0	0	0	110.1	H10	I7-H10 PolarHBondContact O-N 3.03Å
8	Y	42.6	Very low	48.3	Very low	195 Å²	195	124.8 Å²	124.8	77%	0.765	62%	0.622	S	S	*	*	H	α-helix	trans	-69.8	-30.2	177.7	-116.5	-88.4	0	0	0	114.3	P6 H12	P6-Y8 PolarHBondContact O-N 2.94Å; Y8-H12 PolarHBondContact O-N 3.35Å
9	S	56.8	Low	48.5	Very low	46 Å²	46	122.8 Å²	122.8	32%	0.322	61%	0.614	S	S	.	*	H	α-helix	trans	-71.8	-35.5	177.3	68	0	0	0	0	110.9	P6 H12 I13	P6-S9 WeakPolarHBondContact CB-OG 3.42Å; P6-S9 VanDerWaalsContact CG-OG 3.22Å; P6-S9 WeakPolarHBondContact CG-OG 3.39Å; P6-S9 PolarHBondContact O-N 2.91Å; P6-S9 PolarHBondContact O-OG 3.24Å; P6-S9 VanDerWaalsContact O-OG 3.06Å; S9-H12 PolarHBondContact O-N 3.41Å; S9-I13 WeakPolarHBondContact O-CB 3.47Å; S9-I13 WeakPolarHBondContact O-CD1 3.27Å; S9-I13 WeakPolarHBondContact O-CG1 3.47Å; S9-I13 PolarHBondContact O-N 3.17Å
10	H	51.5	Low	48.6	Very low	119 Å²	119	124.3 Å²	124.3	55%	0.551	61%	0.613	S	S	*	*	H	α-helix	trans	-68.3	-39.9	-176.1	-139.3	-61.5	0	0	0	111.6	I7 L14	I7-H10 PolarHBondContact O-N 3.03Å; H10-L14 VanDerWaalsContact O-CB 3.29Å; H10-L14 WeakPolarHBondContact O-CB 3.48Å; H10-L14 WeakPolarHBondContact O-CD1 3.3Å; H10-L14 VanDerWaalsContact O-CG 3.23Å; H10-L14 WeakPolarHBondContact O-CG 3.39Å; H10-L14 PolarHBondContact O-N 3.42Å
11	M	53.6	Low	48.7	Very low	117 Å²	117	121.3 Å²	121.3	58%	0.576	61%	0.609	S	S	*	*	H	α-helix	trans	-67.3	-41.4	174.3	-70.3	-77.2	95.5	0	0	112	L14 Q15	M11-L14 HydrophobicContact CE-CD1 3.63Å; M11-L14 PolarHBondContact O-N 2.92Å; M11-Q15 VanDerWaalsContact O-CB 3.24Å; M11-Q15 WeakPolarHBondContact O-CB 3.33Å; M11-Q15 PolarHBondContact O-N 3.41Å
12	H	54.7	Low	49.4	Very low	108 Å²	108	120.1 Å²	120.1	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-65.2	-41.1	175.7	-112.3	-84.7	0	0	0	112.5	Y8 S9 Q15 I16	Y8-H12 PolarHBondContact O-N 3.35Å; S9-H12 PolarHBondContact O-N 3.41Å; H12-Q15 PolarHBondContact O-N 3.17Å; H12-I16 WeakPolarHBondContact O-CB 3.45Å; H12-I16 WeakPolarHBondContact O-CD1 3.37Å; H12-I16 WeakPolarHBondContact O-CG1 3.12Å; H12-I16 PolarHBondContact O-N 3.36Å
13	I	52.5	Low	50.6	Low	107 Å²	107	122.8 Å²	122.8	55%	0.549	59%	0.589	S	S	.	*	H	α-helix	trans	-65.4	-44.2	176.7	-70.2	163.9	0	0	0	110.2	S9 S17	S9-I13 WeakPolarHBondContact O-CB 3.47Å; S9-I13 WeakPolarHBondContact O-CD1 3.27Å; S9-I13 WeakPolarHBondContact O-CG1 3.47Å; S9-I13 PolarHBondContact O-N 3.17Å; I13-S17 WeakPolarHBondContact O-CB 3.45Å; I13-S17 PolarHBondContact O-N 3Å
14	L	53.3	Low	52.2	Low	81 Å²	81	125.3 Å²	125.3	42%	0.424	59%	0.589	S	S	.	*	H	α-helix	trans	-63.9	-43	176.2	-77.3	163.3	0	0	0	111.6	H10 M11 S17 V18	H10-L14 VanDerWaalsContact O-CB 3.29Å; H10-L14 WeakPolarHBondContact O-CB 3.48Å; H10-L14 WeakPolarHBondContact O-CD1 3.3Å; H10-L14 VanDerWaalsContact O-CG 3.23Å; H10-L14 WeakPolarHBondContact O-CG 3.39Å; H10-L14 PolarHBondContact O-N 3.42Å; M11-L14 HydrophobicContact CE-CD1 3.63Å; M11-L14 PolarHBondContact O-N 2.92Å; L14-S17 PolarHBondContact O-N 3.47Å; L14-V18 WeakPolarHBondContact O-CB 3.15Å; L14-V18 VanDerWaalsContact O-CG2 3.23Å; L14-V18 WeakPolarHBondContact O-CG2 3.39Å; L14-V18 PolarHBondContact O-N 2.95Å
15	Q	53.7	Low	54	Low	118 Å²	118	117.4 Å²	117.4	55%	0.551	56%	0.56	S	S	*	*	H	α-helix	trans	-66.4	-44	178.3	-172.2	168.7	-7.7	0	0	112	M11 H12 S17 V18 D19	M11-Q15 VanDerWaalsContact O-CB 3.24Å; M11-Q15 WeakPolarHBondContact O-CB 3.33Å; M11-Q15 PolarHBondContact O-N 3.41Å; H12-Q15 PolarHBondContact O-N 3.17Å; Q15-S17 VanDerWaalsContact C-N 3.3Å; Q15-S17 PolarHBondContact O-N 3.07Å; Q15-V18 PolarHBondContact O-N 2.85Å; Q15-D19 VanDerWaalsContact O-CB 3.27Å; Q15-D19 WeakPolarHBondContact O-CB 3.5Å; Q15-D19 PolarHBondContact O-N 3.23Å
16	I	53.5	Low	56	Low	93 Å²	93	112.9 Å²	112.9	48%	0.477	54%	0.544	S	S	.	.	H	α-helix	trans	-61.5	-42	172.8	-68.7	164.7	0	0	0	110.1	H12 D19 Y20	H12-I16 WeakPolarHBondContact O-CB 3.45Å; H12-I16 WeakPolarHBondContact O-CD1 3.37Å; H12-I16 WeakPolarHBondContact O-CG1 3.12Å; H12-I16 PolarHBondContact O-N 3.36Å; I16-D19 PolarHBondContact O-N 3.16Å; I16-Y20 HydrophobicContact CG2-CD2 4.31Å; I16-Y20 VanDerWaalsContact O-CB 3.3Å; I16-Y20 WeakPolarHBondContact O-CB 3.44Å; I16-Y20 PolarHBondContact O-N 2.88Å
17	S	51.7	Low	57.8	Low	73 Å²	73	111.4 Å²	111.4	51%	0.51	53%	0.534	S	S	.	.	H	α-helix	trans	-66.2	-37.9	179.6	-160	0	0	0	0	112.2	I13 L14 Q15 A21	I13-S17 WeakPolarHBondContact O-CB 3.45Å; I13-S17 PolarHBondContact O-N 3Å; L14-S17 PolarHBondContact O-N 3.47Å; Q15-S17 VanDerWaalsContact C-N 3.3Å; Q15-S17 PolarHBondContact O-N 3.07Å; S17-A21 WeakPolarHBondContact O-CB 3.49Å; S17-A21 PolarHBondContact O-N 2.89Å
18	V	53.6	Low	59.5	Low	79 Å²	79	109.7 Å²	109.7	48%	0.479	53%	0.527	S	S	.	.	H	α-helix	trans	-71.4	-43.8	175.2	171.2	0	0	0	0	110.7	L14 Q15 Y20 A21 Y22	L14-V18 WeakPolarHBondContact O-CB 3.15Å; L14-V18 VanDerWaalsContact O-CG2 3.23Å; L14-V18 WeakPolarHBondContact O-CG2 3.39Å; L14-V18 PolarHBondContact O-N 2.95Å; Q15-V18 PolarHBondContact O-N 2.85Å; V18-Y20 VanDerWaalsContact C-N 3.35Å; V18-Y20 PolarHBondContact O-N 3.03Å; V18-A21 PolarHBondContact O-N 3.13Å; V18-Y22 HydrophobicContact CG1-CD2 4.21Å; V18-Y22 PolarHBondContact O-N 3.36Å; V18-Y22 VanDerWaalsContact O-N 3.15Å
19	D	51.7	Low	61.7	Low	87 Å²	87	102 Å²	102	47%	0.465	50%	0.501	S	S	.	.	H	α-helix	trans	-66.9	-34.3	178.8	-78.1	-21.2	0	0	0	112.4	Q15 I16 R23	Q15-D19 VanDerWaalsContact O-CB 3.27Å; Q15-D19 WeakPolarHBondContact O-CB 3.5Å; Q15-D19 PolarHBondContact O-N 3.23Å; I16-D19 PolarHBondContact O-N 3.16Å; D19-R23 WeakPolarHBondContact O-CB 3.06Å
20	Y	51	Low	63.2	Low	152 Å²	152	105.5 Å²	105.5	60%	0.596	52%	0.521	S	S	*	.	H	α-helix	trans	-77.6	-36.3	174.4	-113	-92.4	0	0	0	112.9	I16 V18	I16-Y20 HydrophobicContact CG2-CD2 4.31Å; I16-Y20 VanDerWaalsContact O-CB 3.3Å; I16-Y20 WeakPolarHBondContact O-CB 3.44Å; I16-Y20 PolarHBondContact O-N 2.88Å; V18-Y20 VanDerWaalsContact C-N 3.35Å; V18-Y20 PolarHBondContact O-N 3.03Å
21	A	50.5	Low	64.9	Low	63 Å²	63	106.3 Å²	106.3	52%	0.521	53%	0.527	S	S	.	.	H	α-helix	trans	-72.1	-28.8	-177.6	0	0	0	0	0	112.9	S17 V18	S17-A21 WeakPolarHBondContact O-CB 3.49Å; S17-A21 PolarHBondContact O-N 2.89Å; V18-A21 PolarHBondContact O-N 3.13Å
22	Y	54.2	Low	66.5	Low	196 Å²	196	101.1 Å²	101.1	77%	0.769	50%	0.501	S	S	*	.	H	α-helix	trans	-100.2	-12.3	-176.3	-84.3	-80.3	0	0	0	115.3	V18 R24	V18-Y22 HydrophobicContact CG1-CD2 4.21Å; V18-Y22 PolarHBondContact O-N 3.36Å; V18-Y22 VanDerWaalsContact O-N 3.15Å; Y22-R24 PolarHBondContact O-N 3.22Å; Y22-R24 VanDerWaalsContact O-N 3.16Å
23	R	64.4	Low	68.2	Low	183 Å²	183	101.4 Å²	101.4	69%	0.691	50%	0.501	S	S	*	.			trans	-77.6	107.3	-179.9	-168.3	175.5	-73.5	-166.2	-1.7	108.9	D19 P105	D19-R23 WeakPolarHBondContact O-CB 3.06Å; R23-P105 WeakPolarHBondContact O-CD 3.35Å; R23-P105 WeakPolarHBondContact O-CG 3.47Å
24	R	70.9	Confident	70	Confident	199 Å²	199	102.5 Å²	102.5	75%	0.751	50%	0.502	S	S	*	.			trans	-65.6	150.8	171.2	-69.2	-169.9	167.9	-158	-6	111	Y22 D26	Y22-R24 PolarHBondContact O-N 3.22Å; Y22-R24 VanDerWaalsContact O-N 3.16Å; R24-D26 PolarHBondContact O-N 3.15Å
25	L	76.5	Confident	71.6	Confident	38 Å²	38	100 Å²	100	20%	0.199	49%	0.49	C	S	.	.			trans	-62.8	127.9	172.2	-171.1	62.2	0	0	0	109.4	T27 F32 P105 F108	L25-T27 PolarHBondContact O-N 3.18Å; L25-F32 HydrophobicContact CD1-CD2 4.37Å; L25-F32 HydrophobicContact CD2-CD2 3.37Å; L25-F32 HydrophobicContact CD2-CE2 3.26Å; L25-F32 HydrophobicContact CD2-CZ 4.37Å; L25-F32 HydrophobicContact CG-CD2 3.77Å; L25-F32 HydrophobicContact CG-CE2 4.08Å; L25-P105 HydrophobicContact CB-CG 4.46Å; L25-F108 HydrophobicContact CD1-CD1 4.3Å; L25-F108 HydrophobicContact CD1-CG 4.46Å; L25-F108 HydrophobicContact CD2-CB 4.06Å; L25-F108 HydrophobicContact CD2-CD1 4.25Å; L25-F108 HydrophobicContact CD2-CD2 3.64Å; L25-F108 HydrophobicContact CD2-CE2 4.09Å; L25-F108 HydrophobicContact CD2-CG 3.72Å
26	D	83.3	Confident	73.2	Confident	94 Å²	94	94.8 Å²	94.8	50%	0.503	47%	0.467	S	S	.	.			trans	-75.4	92.1	174.2	179.6	9.2	0	0	0	109.7	R24 N28 S29 F32	R24-D26 PolarHBondContact O-N 3.15Å; D26-N28 PolarHBondContact O-N 3.46Å; D26-N28 WeakPolarHBondContact OD1-CA 3.39Å; D26-N28 WeakPolarHBondContact OD1-CB 3.39Å; D26-N28 PolarHBondContact OD1-N 3.23Å; D26-S29 VanDerWaalsContact O-CB 3.3Å; D26-S29 WeakPolarHBondContact O-CB 3.4Å; D26-S29 PolarHBondContact O-N 3.34Å; D26-S29 VanDerWaalsContact O-N 3.13Å; D26-S29 PolarHBondContact O-OG 3.46Å; D26-S29 PolarHBondContact OD1-N 3.05Å; D26-F32 WeakPolarHBondContact O-CB 3.38Å
27	T	84.5	Confident	74.8	Confident	38 Å²	38	97.4 Å²	97.4	23%	0.233	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-15.4	179.1	58.9	0	0	0	0	112.9	L25 F32	L25-T27 PolarHBondContact O-N 3.18Å; T27-F32 VanDerWaalsContact CA-CD1 3.44Å; T27-F32 HydrophobicContact CG2-CD1 4.35Å; T27-F32 HydrophobicContact CG2-CE1 3.92Å; T27-F32 HydrophobicContact CG2-CE2 4.49Å; T27-F32 HydrophobicContact CG2-CZ 3.99Å; T27-F32 WeakPolarHBondContact O-CD1 3.26Å
28	N	85.5	Confident	76.5	Confident	117 Å²	117	97.9 Å²	97.9	63%	0.626	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-16.6	175.5	-70.4	-56.7	0	0	0	113	D26 K33	D26-N28 PolarHBondContact O-N 3.46Å; D26-N28 WeakPolarHBondContact OD1-CA 3.39Å; D26-N28 WeakPolarHBondContact OD1-CB 3.39Å; D26-N28 PolarHBondContact OD1-N 3.23Å; N28-K33 WeakPolarHBondContact O-CE 3.25Å; N28-K33 PolarHBondContact O-NZ 3.49Å
29	S	87.7	Confident	78.1	Confident	33 Å²	33	94.6 Å²	94.6	23%	0.231	45%	0.45	C	S	.	.	S	Bend	trans	-60.3	142.1	179.3	73.5	0	0	0	0	112.2	D26 M31 F32 K33	D26-S29 VanDerWaalsContact O-CB 3.3Å; D26-S29 WeakPolarHBondContact O-CB 3.4Å; D26-S29 PolarHBondContact O-N 3.34Å; D26-S29 VanDerWaalsContact O-N 3.13Å; D26-S29 PolarHBondContact O-OG 3.46Å; D26-S29 PolarHBondContact OD1-N 3.05Å; S29-M31 PolarHBondContact O-N 3.41Å; S29-F32 PolarHBondContact O-N 3.49Å; S29-F32 VanDerWaalsContact OG-CB 3.24Å; S29-F32 WeakPolarHBondContact OG-CB 3.5Å; S29-F32 PolarHBondContact OG-N 2.89Å; S29-F32 VanDerWaalsContact OG-N 3.07Å; S29-K33 PolarHBondContact O-N 3.31Å; S29-K33 VanDerWaalsContact O-N 3.1Å
30	T	89.9	Confident	79.6	Confident	121 Å²	121	92.2 Å²	92.2	74%	0.742	44%	0.436	S	S	*	.	H	α-helix	trans	-58.7	-35	174.3	-54.2	0	0	0	0	111.4	F34	T30-F34 VanDerWaalsContact O-CB 3.25Å; T30-F34 WeakPolarHBondContact O-CB 3.44Å; T30-F34 PolarHBondContact O-N 3.3Å
31	M	86.6	Confident	81.1	Confident	136 Å²	136	87.9 Å²	87.9	67%	0.67	43%	0.427	S	S	*	.	H	α-helix	trans	-64.9	-45.3	178.1	-74.9	-60.7	-62.2	0	0	112.2	S29 T35	S29-M31 PolarHBondContact O-N 3.41Å; M31-T35 WeakPolarHBondContact O-CB 3.47Å; M31-T35 PolarHBondContact O-N 3.27Å; M31-T35 PolarHBondContact O-OG1 2.95Å
32	F	87.8	Confident	82.7	Confident	8 Å²	8	87 Å²	87	4%	0.035	41%	0.413	C	S	.	.	H	α-helix	trans	-62.6	-49.7	175.9	176.1	-97.9	0	0	0	111.1	L25 D26 T27 S29 F34 T35 S36 L100 H101 F108	L25-F32 HydrophobicContact CD1-CD2 4.37Å; L25-F32 HydrophobicContact CD2-CD2 3.37Å; L25-F32 HydrophobicContact CD2-CE2 3.26Å; L25-F32 HydrophobicContact CD2-CZ 4.37Å; L25-F32 HydrophobicContact CG-CD2 3.77Å; L25-F32 HydrophobicContact CG-CE2 4.08Å; D26-F32 WeakPolarHBondContact O-CB 3.38Å; T27-F32 VanDerWaalsContact CA-CD1 3.44Å; T27-F32 HydrophobicContact CG2-CD1 4.35Å; T27-F32 HydrophobicContact CG2-CE1 3.92Å; T27-F32 HydrophobicContact CG2-CE2 4.49Å; T27-F32 HydrophobicContact CG2-CZ 3.99Å; T27-F32 WeakPolarHBondContact O-CD1 3.26Å; S29-F32 PolarHBondContact O-N 3.49Å; S29-F32 VanDerWaalsContact OG-CB 3.24Å; S29-F32 WeakPolarHBondContact OG-CB 3.5Å; S29-F32 PolarHBondContact OG-N 2.89Å; S29-F32 VanDerWaalsContact OG-N 3.07Å; F32-F34 VanDerWaalsContact C-N 3.32Å; F32-F34 PolarHBondContact O-N 3.47Å; F32-T35 PolarHBondContact O-N 2.89Å; F32-T35 VanDerWaalsContact O-N 3.14Å; F32-S36 WeakPolarHBondContact O-CB 3.45Å; F32-S36 PolarHBondContact O-N 2.92Å; F32-L100 HydrophobicContact CE2-CB 4.34Å; F32-L100 HydrophobicContact CZ-CB 4.12Å; F32-H101 AromaticContact CE1-CE1 3.88Å; F32-H101 AromaticContact CE1-NE2 3.71Å; F32-F108 HydrophobicContact CD2-CE2 4.08Å; F32-F108 HydrophobicContact CD2-CZ 4.1Å; F32-F108 HydrophobicContact CE2-CD2 4.37Å; F32-F108 AromaticContact CE2-CE2 3.8Å; F32-F108 HydrophobicContact CE2-CE2 3.8Å; F32-F108 HydrophobicContact CE2-CZ 4.29Å
33	K	89.6	Confident	83.9	Confident	114 Å²	114	78 Å²	78	50%	0.496	38%	0.378	S	S	.	.	H	α-helix	trans	-58.6	-42.6	179.4	-71.1	171.3	176.9	159.7	0	112.3	N28 S29 K37	N28-K33 WeakPolarHBondContact O-CE 3.25Å; N28-K33 PolarHBondContact O-NZ 3.49Å; S29-K33 PolarHBondContact O-N 3.31Å; S29-K33 VanDerWaalsContact O-N 3.1Å; K33-K37 WeakPolarHBondContact O-CB 3.3Å; K33-K37 PolarHBondContact O-N 3.42Å
34	F	90	Very high	84.4	Confident	129 Å²	129	72.6 Å²	72.6	57%	0.566	36%	0.361	S	S	*	.	H	α-helix	trans	-64.1	-46.7	175.3	176.6	-97.9	0	0	0	111.6	T30 F32 K37 L38	T30-F34 VanDerWaalsContact O-CB 3.25Å; T30-F34 WeakPolarHBondContact O-CB 3.44Å; T30-F34 PolarHBondContact O-N 3.3Å; F32-F34 VanDerWaalsContact C-N 3.32Å; F32-F34 PolarHBondContact O-N 3.47Å; F34-K37 PolarHBondContact O-N 3.33Å; F34-L38 HydrophobicContact CE1-CD2 4.27Å; F34-L38 WeakPolarHBondContact O-CB 3.41Å; F34-L38 PolarHBondContact O-N 2.82Å
35	T	87.3	Confident	84.8	Confident	30 Å²	30	66.8 Å²	66.8	18%	0.184	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-46.9	-179.1	-54.6	0	0	0	0	111.1	M31 F32 K37 L38 L39 F108 I112	M31-T35 WeakPolarHBondContact O-CB 3.47Å; M31-T35 PolarHBondContact O-N 3.27Å; M31-T35 PolarHBondContact O-OG1 2.95Å; F32-T35 PolarHBondContact O-N 2.89Å; F32-T35 VanDerWaalsContact O-N 3.14Å; T35-K37 PolarHBondContact O-N 3Å; T35-L38 PolarHBondContact O-N 3.21Å; T35-L39 WeakPolarHBondContact O-CG 3.37Å; T35-L39 PolarHBondContact O-N 3.09Å; T35-F108 HydrophobicContact CG2-CE1 4.13Å; T35-F108 HydrophobicContact CG2-CZ 3.7Å; T35-I112 HydrophobicContact CG2-CD1 3.52Å; T35-I112 HydrophobicContact CG2-CG1 4.31Å
36	S	86.3	Confident	84.9	Confident	8 Å²	8	65.1 Å²	65.1	6%	0.056	34%	0.339	C	S	.	.	H	α-helix	trans	-57.7	-48.4	176.1	177.2	0	0	0	0	111.2	F32 L38 L39 F40	F32-S36 WeakPolarHBondContact O-CB 3.45Å; F32-S36 PolarHBondContact O-N 2.92Å; S36-L38 PolarHBondContact O-N 3.42Å; S36-L39 WeakPolarHBondContact O-CB 3.32Å; S36-L39 PolarHBondContact O-N 2.91Å; S36-F40 WeakPolarHBondContact O-CD2 3.28Å; S36-F40 WeakPolarHBondContact O-CG 3.29Å; S36-F40 PolarHBondContact O-N 3.19Å; S36-F40 WeakPolarHBondContact OG-CE2 3.45Å; S36-F40 WeakPolarHBondContact OG-CZ 3.45Å
37	K	87.2	Confident	84.5	Confident	148 Å²	148	61.2 Å²	61.2	64%	0.643	32%	0.319	S	S	*	.	H	α-helix	trans	-59.6	-43.4	175.6	-173.2	173.8	-178.2	177	0	112.8	K33 F34 T35 L39 F40 C41	K33-K37 WeakPolarHBondContact O-CB 3.3Å; K33-K37 PolarHBondContact O-N 3.42Å; F34-K37 PolarHBondContact O-N 3.33Å; T35-K37 PolarHBondContact O-N 3Å; K37-L39 VanDerWaalsContact C-N 3.35Å; K37-F40 PolarHBondContact O-N 3.03Å; K37-C41 PolarHBondContact O-N 3.31Å; K37-C41 VanDerWaalsContact O-N 3.08Å; K37-C41 PolarHBondContact O-SG 3.38Å; K37-C41 VanDerWaalsContact O-SG 3.38Å
38	L	88.1	Confident	83.9	Confident	83 Å²	83	61.5 Å²	61.5	44%	0.435	32%	0.319	S	S	.	.	H	α-helix	trans	-62.9	-42.3	177.5	179.9	63.2	0	0	0	111.4	F34 T35 S36 F40 C41 L42	F34-L38 HydrophobicContact CE1-CD2 4.27Å; F34-L38 WeakPolarHBondContact O-CB 3.41Å; F34-L38 PolarHBondContact O-N 2.82Å; T35-L38 PolarHBondContact O-N 3.21Å; S36-L38 PolarHBondContact O-N 3.42Å; L38-F40 PolarHBondContact O-N 3.19Å; L38-C41 PolarHBondContact O-N 3.26Å; L38-L42 HydrophobicContact CD1-CD1 4.35Å; L38-L42 HydrophobicContact CD1-CG 4.31Å; L38-L42 HydrophobicContact CG-CD1 4.04Å; L38-L42 HydrophobicContact CG-CG 4.43Å; L38-L42 WeakPolarHBondContact O-CB 3.38Å; L38-L42 VanDerWaalsContact O-CG 3.32Å; L38-L42 WeakPolarHBondContact O-CG 3.48Å; L38-L42 PolarHBondContact O-N 3.28Å
39	L	86.4	Confident	83.5	Confident	9 Å²	9	59.1 Å²	59.1	5%	0.047	30%	0.304	C	S	.	.	H	α-helix	trans	-59.5	-44.6	175.9	-73.7	-178.4	0	0	0	111.8	T35 S36 K37 L42 M43 L100 I112 I115	T35-L39 WeakPolarHBondContact O-CG 3.37Å; T35-L39 PolarHBondContact O-N 3.09Å; S36-L39 WeakPolarHBondContact O-CB 3.32Å; S36-L39 PolarHBondContact O-N 2.91Å; K37-L39 VanDerWaalsContact C-N 3.35Å; L39-L42 PolarHBondContact O-N 3.15Å; L39-M43 VanDerWaalsContact O-CB 3.3Å; L39-M43 WeakPolarHBondContact O-CB 3.41Å; L39-M43 PolarHBondContact O-N 3.47Å; L39-L100 HydrophobicContact CD1-CD1 3.92Å; L39-L100 HydrophobicContact CD1-CD2 3.99Å; L39-I112 HydrophobicContact CD1-CD1 3.63Å; L39-I112 HydrophobicContact CD2-CD1 3.89Å; L39-I112 HydrophobicContact CG-CD1 4.01Å; L39-I115 HydrophobicContact CD1-CD1 4.34Å; L39-I115 HydrophobicContact CD2-CB 4.44Å; L39-I115 HydrophobicContact CD2-CD1 3.57Å; L39-I115 HydrophobicContact CD2-CG2 3.85Å
40	F	83.9	Confident	82.9	Confident	38 Å²	38	59.8 Å²	59.8	17%	0.167	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-44.1	177.4	-62.6	-45.3	0	0	0	112.3	S36 K37 L38 L42 M43 E44 C93 L96 D97 L100	S36-F40 WeakPolarHBondContact O-CD2 3.28Å; S36-F40 WeakPolarHBondContact O-CG 3.29Å; S36-F40 PolarHBondContact O-N 3.19Å; S36-F40 WeakPolarHBondContact OG-CE2 3.45Å; S36-F40 WeakPolarHBondContact OG-CZ 3.45Å; K37-F40 PolarHBondContact O-N 3.03Å; L38-F40 PolarHBondContact O-N 3.19Å; F40-L42 PolarHBondContact O-N 3.31Å; F40-M43 HydrophobicContact CD1-CE 4.24Å; F40-M43 PolarHBondContact O-N 3.35Å; F40-E44 WeakPolarHBondContact O-CB 3.23Å; F40-E44 PolarHBondContact O-N 3.29Å; F40-C93 HydrophobicContact CD1-CB 4.16Å; F40-C93 HydrophobicContact CE1-CB 4.35Å; F40-L96 HydrophobicContact CD1-CD2 4.11Å; F40-L96 HydrophobicContact CE1-CB 4.15Å; F40-L96 HydrophobicContact CE1-CD2 3.91Å; F40-L96 HydrophobicContact CE1-CG 3.99Å; F40-D97 HydrophobicContact CE1-CB 4.25Å; F40-D97 HydrophobicContact CE2-CB 4.37Å; F40-D97 HydrophobicContact CZ-CB 3.53Å; F40-D97 WeakPolarHBondContact CZ-OD1 3.48Å; F40-L100 HydrophobicContact CE1-CD1 4.46Å; F40-L100 HydrophobicContact CZ-CD1 4.15Å
41	C	82.8	Confident	82	Confident	60 Å²	60	54.3 Å²	54.3	41%	0.405	27%	0.272	S	S	.	.	H	α-helix	trans	-62.1	-43.3	175.6	-67.3	0	0	0	0	112.1	K37 L38 M43 E44 V45	K37-C41 PolarHBondContact O-N 3.31Å; K37-C41 VanDerWaalsContact O-N 3.08Å; K37-C41 PolarHBondContact O-SG 3.38Å; K37-C41 VanDerWaalsContact O-SG 3.38Å; L38-C41 PolarHBondContact O-N 3.26Å; C41-M43 VanDerWaalsContact C-N 3.35Å; C41-E44 PolarHBondContact O-N 2.92Å; C41-V45 WeakPolarHBondContact O-CG2 2.89Å; C41-V45 PolarHBondContact O-N 3.2Å; C41-V45 VanDerWaalsContact O-N 3.13Å
42	L	84.1	Confident	81.4	Confident	44 Å²	44	51.7 Å²	51.7	23%	0.23	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-40.7	177.9	-74.3	172.8	0	0	0	111.9	L38 L39 F40 V45 C46 L119 F164	L38-L42 HydrophobicContact CD1-CD1 4.35Å; L38-L42 HydrophobicContact CD1-CG 4.31Å; L38-L42 HydrophobicContact CG-CD1 4.04Å; L38-L42 HydrophobicContact CG-CG 4.43Å; L38-L42 WeakPolarHBondContact O-CB 3.38Å; L38-L42 VanDerWaalsContact O-CG 3.32Å; L38-L42 WeakPolarHBondContact O-CG 3.48Å; L38-L42 PolarHBondContact O-N 3.28Å; L39-L42 PolarHBondContact O-N 3.15Å; F40-L42 PolarHBondContact O-N 3.31Å; L42-V45 PolarHBondContact O-N 3.15Å; L42-C46 VanDerWaalsContact O-CB 3.31Å; L42-C46 WeakPolarHBondContact O-CB 3.43Å; L42-C46 PolarHBondContact O-N 2.76Å; L42-C46 PolarHBondContact O-SG 2.9Å; L42-L119 HydrophobicContact CD1-CD2 4.14Å; L42-L119 HydrophobicContact CD2-CD1 4.36Å; L42-L119 HydrophobicContact CD2-CD2 3.92Å; L42-F164 HydrophobicContact CB-CE2 4.03Å; L42-F164 HydrophobicContact CB-CZ 3.99Å
43	M	78.4	Confident	80.7	Confident	7 Å²	7	52.7 Å²	52.7	3%	0.034	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-43.5	177.5	-172.2	173.5	64.9	0	0	111.4	L39 F40 C41 V45 C46 C47 W92 L96 F164	L39-M43 VanDerWaalsContact O-CB 3.3Å; L39-M43 WeakPolarHBondContact O-CB 3.41Å; L39-M43 PolarHBondContact O-N 3.47Å; F40-M43 HydrophobicContact CD1-CE 4.24Å; F40-M43 PolarHBondContact O-N 3.35Å; C41-M43 VanDerWaalsContact C-N 3.35Å; M43-V45 PolarHBondContact O-N 3.24Å; M43-C46 PolarHBondContact O-N 2.84Å; M43-C47 WeakPolarHBondContact O-CB 3.36Å; M43-C47 PolarHBondContact O-N 3.34Å; M43-W92 HydrophobicContact CE-CB 4.08Å; M43-W92 HydrophobicContact SD-CE3 4.34Å; M43-L96 HydrophobicContact CE-CD2 3.71Å; M43-L96 HydrophobicContact SD-CD2 3.49Å; M43-L96 WeakPolarHBondContact SD-CD2 3.27Å; M43-F164 HydrophobicContact CB-CD1 3.98Å; M43-F164 HydrophobicContact CB-CE1 3.51Å; M43-F164 HydrophobicContact CB-CZ 4.02Å; M43-F164 HydrophobicContact CG-CD1 3.79Å; M43-F164 HydrophobicContact CG-CE1 3.8Å; M43-F164 HydrophobicContact SD-CD1 4.48Å; M43-F164 HydrophobicContact SD-CE1 4.42Å
44	E	76.6	Confident	79.9	Confident	70 Å²	70	50.8 Å²	50.8	33%	0.327	26%	0.256	S	S	.	.	H	α-helix	trans	-56.2	-50.3	174.5	176	171.3	-162.8	0	0	111.1	F40 C41 C46 C47 L48 I89	F40-E44 WeakPolarHBondContact O-CB 3.23Å; F40-E44 PolarHBondContact O-N 3.29Å; C41-E44 PolarHBondContact O-N 2.92Å; E44-C46 PolarHBondContact O-N 3.46Å; E44-C47 PolarHBondContact O-N 3.48Å; E44-L48 HydrophobicContact CG-CD1 4.21Å; E44-L48 VanDerWaalsContact O-CG 3.27Å; E44-L48 WeakPolarHBondContact O-CG 3.29Å; E44-L48 PolarHBondContact O-N 3.22Å; E44-I89 HydrophobicContact CB-CG2 3.88Å; E44-I89 HydrophobicContact CG-CD1 3.82Å; E44-I89 HydrophobicContact CG-CG2 3.95Å
45	V	77.9	Confident	78.9	Confident	78 Å²	78	45.8 Å²	45.8	47%	0.473	24%	0.235	S	C	.	.	H	α-helix	trans	-60.7	-44.8	176.8	176.1	0	0	0	0	111.5	C41 L42 M43 L48 Q49	C41-V45 WeakPolarHBondContact O-CG2 2.89Å; C41-V45 PolarHBondContact O-N 3.2Å; C41-V45 VanDerWaalsContact O-N 3.13Å; L42-V45 PolarHBondContact O-N 3.15Å; M43-V45 PolarHBondContact O-N 3.24Å; V45-L48 PolarHBondContact O-N 2.87Å; V45-Q49 WeakPolarHBondContact O-CG 3.5Å; V45-Q49 PolarHBondContact O-N 3.44Å
46	C	79.3	Confident	78.2	Confident	2 Å²	2	50 Å²	50	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-64.8	-39.9	-179.5	-74.9	0	0	0	0	112.3	L42 M43 E44 Q49 D50 R122 F164	L42-C46 VanDerWaalsContact O-CB 3.31Å; L42-C46 WeakPolarHBondContact O-CB 3.43Å; L42-C46 PolarHBondContact O-N 2.76Å; L42-C46 PolarHBondContact O-SG 2.9Å; M43-C46 PolarHBondContact O-N 2.84Å; E44-C46 PolarHBondContact O-N 3.46Å; C46-Q49 WeakPolarHBondContact O-CB 3.31Å; C46-Q49 PolarHBondContact O-N 3.44Å; C46-D50 VanDerWaalsContact O-CG 3.24Å; C46-D50 PolarHBondContact O-N 3.47Å; C46-R122 VanDerWaalsContact CB-NH1 3.27Å; C46-R122 PolarHBondContact O-NH1 2.85Å; C46-R122 VanDerWaalsContact O-NH1 3.14Å; C46-F164 HydrophobicContact CB-CB 4.08Å; C46-F164 HydrophobicContact CB-CD2 3.76Å; C46-F164 HydrophobicContact CB-CE2 4.44Å; C46-F164 HydrophobicContact CB-CG 4.02Å; C46-F164 WeakPolarHBondContact SG-CD2 3.26Å
47	C	74.5	Confident	77.5	Confident	13 Å²	13	54.4 Å²	54.4	9%	0.088	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-43.6	176.2	-174.8	0	0	0	0	111.4	M43 E44 Q49 D50 C51 L197	M43-C47 WeakPolarHBondContact O-CB 3.36Å; M43-C47 PolarHBondContact O-N 3.34Å; E44-C47 PolarHBondContact O-N 3.48Å; C47-Q49 VanDerWaalsContact C-N 3.27Å; C47-Q49 PolarHBondContact O-N 2.69Å; C47-D50 PolarHBondContact O-N 3.32Å; C47-C51 PolarHBondContact O-N 3.08Å; C47-C51 PolarHBondContact O-SG 2.91Å; C47-C51 VanDerWaalsContact O-SG 3.33Å; C47-L197 HydrophobicContact CB-CD1 4.36Å; C47-L197 WeakPolarHBondContact SG-CD1 2.96Å
48	L	73	Confident	76.7	Confident	43 Å²	43	50.3 Å²	50.3	23%	0.225	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-42.2	175.6	-71.2	170.7	0	0	0	111	E44 V45 C51 L52 I82 I89	E44-L48 HydrophobicContact CG-CD1 4.21Å; E44-L48 VanDerWaalsContact O-CG 3.27Å; E44-L48 WeakPolarHBondContact O-CG 3.29Å; E44-L48 PolarHBondContact O-N 3.22Å; V45-L48 PolarHBondContact O-N 2.87Å; L48-C51 PolarHBondContact O-N 2.97Å; L48-L52 WeakPolarHBondContact O-CB 3.42Å; L48-L52 VanDerWaalsContact O-CG 3.25Å; L48-L52 WeakPolarHBondContact O-CG 3.35Å; L48-L52 PolarHBondContact O-N 3.35Å; L48-I82 HydrophobicContact CD2-CG2 3.46Å; L48-I82 VanDerWaalsContact CD2-CG2 3.46Å; L48-I89 HydrophobicContact CD2-CD1 4.18Å; L48-I89 HydrophobicContact CG-CD1 4.22Å
49	Q	76.7	Confident	75.7	Confident	67 Å²	67	49.4 Å²	49.4	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-48.3	173.4	-74.9	175.1	-22.5	0	0	112	V45 C46 C47 C51 L52 E53	V45-Q49 WeakPolarHBondContact O-CG 3.5Å; V45-Q49 PolarHBondContact O-N 3.44Å; C46-Q49 WeakPolarHBondContact O-CB 3.31Å; C46-Q49 PolarHBondContact O-N 3.44Å; C47-Q49 VanDerWaalsContact C-N 3.27Å; C47-Q49 PolarHBondContact O-N 2.69Å; Q49-C51 VanDerWaalsContact C-N 3.34Å; Q49-C51 PolarHBondContact O-N 3.39Å; Q49-L52 PolarHBondContact O-N 2.87Å; Q49-E53 WeakPolarHBondContact O-CG 3.33Å; Q49-E53 PolarHBondContact O-N 2.72Å
50	D	75	Confident	74.7	Confident	47 Å²	47	55.8 Å²	55.8	25%	0.251	28%	0.279	S	S	.	.	H	α-helix	trans	-63.6	-39	-179.6	-66.6	-6.3	0	0	0	111.9	C46 C47 E53 K54 R122	C46-D50 VanDerWaalsContact O-CG 3.24Å; C46-D50 PolarHBondContact O-N 3.47Å; C47-D50 PolarHBondContact O-N 3.32Å; D50-E53 PolarHBondContact O-N 2.97Å; D50-K54 WeakPolarHBondContact O-CG 3.43Å; D50-K54 PolarHBondContact O-N 2.8Å; D50-R122 IonicContact OD1-CZ 3.6Å; D50-R122 IonicContact OD1-NH1 3.94Å; D50-R122 PolarHBondContact OD1-NH1 3.35Å; D50-R122 IonicContact OD1-NH2 2.8Å; D50-R122 PolarHBondContact OD1-NH2 2.96Å; D50-R122 VanDerWaalsContact OD1-NH2 3.09Å; D50-R122 IonicContact OD2-CZ 3.17Å; D50-R122 IonicContact OD2-NH1 2.78Å; D50-R122 PolarHBondContact OD2-NH1 3.07Å; D50-R122 IonicContact OD2-NH2 3.82Å; D50-R122 PolarHBondContact OD2-NH2 3.48Å
51	C	70.6	Confident	73.5	Confident	7 Å²	7	58.6 Å²	58.6	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-62.3	-46.4	173.9	-71.4	0	0	0	0	111.5	C47 L48 Q49 K54 I55	C47-C51 PolarHBondContact O-N 3.08Å; C47-C51 PolarHBondContact O-SG 2.91Å; C47-C51 VanDerWaalsContact O-SG 3.33Å; L48-C51 PolarHBondContact O-N 2.97Å; Q49-C51 VanDerWaalsContact C-N 3.34Å; Q49-C51 PolarHBondContact O-N 3.39Å; C51-K54 PolarHBondContact O-N 2.78Å; C51-I55 VanDerWaalsContact O-CG1 3.31Å; C51-I55 WeakPolarHBondContact O-CG1 3.5Å; C51-I55 PolarHBondContact O-N 3.04Å
52	L	73.3	Confident	72.2	Confident	81 Å²	81	59.3 Å²	59.3	42%	0.424	30%	0.299	S	S	.	.	H	α-helix	trans	-62.7	-42.4	177.5	-72.2	171.8	0	0	0	111.9	L48 Q49 K54 I55 Q56 I82	L48-L52 WeakPolarHBondContact O-CB 3.42Å; L48-L52 VanDerWaalsContact O-CG 3.25Å; L48-L52 WeakPolarHBondContact O-CG 3.35Å; L48-L52 PolarHBondContact O-N 3.35Å; Q49-L52 PolarHBondContact O-N 2.87Å; L52-K54 PolarHBondContact O-N 2.75Å; L52-I55 PolarHBondContact O-N 3.34Å; L52-Q56 WeakPolarHBondContact O-CG 3.47Å; L52-Q56 PolarHBondContact O-N 3.39Å; L52-I82 HydrophobicContact CD2-CD1 3.76Å
53	E	73.8	Confident	70.7	Confident	28 Å²	28	64.5 Å²	64.5	13%	0.131	32%	0.32	C	S	.	.	H	α-helix	trans	-61.9	-42.1	176.5	-73.8	-168.4	177.5	0	0	112	Q49 D50 Q56 Q57 K129 T161	Q49-E53 WeakPolarHBondContact O-CG 3.33Å; Q49-E53 PolarHBondContact O-N 2.72Å; D50-E53 PolarHBondContact O-N 2.97Å; E53-Q56 PolarHBondContact O-N 2.85Å; E53-Q57 WeakPolarHBondContact O-CB 3.43Å; E53-Q57 WeakPolarHBondContact O-CG 3.47Å; E53-Q57 PolarHBondContact O-N 3.4Å; E53-K129 IonicContact OE1-NZ 3.44Å; E53-K129 PolarHBondContact OE1-NZ 2.85Å; E53-K129 IonicContact OE2-NZ 3.7Å; E53-K129 PolarHBondContact OE2-NZ 3.42Å; E53-T161 VanDerWaalsContact CD-OG1 3.26Å; E53-T161 PolarHBondContact OE1-OG1 2.81Å; E53-T161 WeakPolarHBondContact OE2-CB 3.32Å; E53-T161 PolarHBondContact OE2-OG1 2.67Å; E53-T161 VanDerWaalsContact OE2-OG1 3.04Å
54	K	72.5	Confident	69.3	Low	74 Å²	74	73.7 Å²	73.7	32%	0.322	36%	0.36	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175.9	-76.7	179.7	175.7	-179.5	0	112.5	D50 C51 L52 Q57 Q58 T198 P201	D50-K54 WeakPolarHBondContact O-CG 3.43Å; D50-K54 PolarHBondContact O-N 2.8Å; C51-K54 PolarHBondContact O-N 2.78Å; L52-K54 PolarHBondContact O-N 2.75Å; K54-Q57 PolarHBondContact O-N 3.5Å; K54-Q58 WeakPolarHBondContact O-CB 3.31Å; K54-Q58 PolarHBondContact O-N 3.4Å; K54-T198 PolarHBondContact NZ-O 3.41Å; K54-P201 HydrophobicContact CB-CG 4.16Å; K54-P201 HydrophobicContact CD-CG 4.03Å
55	I	70.3	Confident	67.9	Low	25 Å²	25	74.7 Å²	74.7	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-61.5	-47.7	175.9	-67.1	164.9	0	0	0	109.6	C51 L52 Q57 Q58 E59	C51-I55 VanDerWaalsContact O-CG1 3.31Å; C51-I55 WeakPolarHBondContact O-CG1 3.5Å; C51-I55 PolarHBondContact O-N 3.04Å; L52-I55 PolarHBondContact O-N 3.34Å; I55-Q57 PolarHBondContact O-N 3.42Å; I55-Q58 PolarHBondContact O-N 3.26Å; I55-E59 WeakPolarHBondContact O-CG 3.36Å; I55-E59 PolarHBondContact O-N 3.44Å
56	Q	71.7	Confident	66.2	Low	117 Å²	117	78.4 Å²	78.4	55%	0.547	38%	0.384	S	S	.	.	H	α-helix	trans	-61.1	-42	177.9	-72.4	178.5	-2.9	0	0	112.9	L52 E53 Q58 E59 Q60	L52-Q56 WeakPolarHBondContact O-CG 3.47Å; L52-Q56 PolarHBondContact O-N 3.39Å; E53-Q56 PolarHBondContact O-N 2.85Å; Q56-Q58 VanDerWaalsContact C-N 3.35Å; Q56-E59 PolarHBondContact O-N 3.13Å; Q56-Q60 WeakPolarHBondContact O-CG 3.44Å; Q56-Q60 PolarHBondContact O-N 3.39Å
57	Q	71.1	Confident	64.3	Low	102 Å²	102	85 Å²	85	48%	0.477	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-40.8	175.1	-73.9	176.1	-0.2	0	0	111.6	E53 K54 I55 E59 Q60 T61	E53-Q57 WeakPolarHBondContact O-CB 3.43Å; E53-Q57 WeakPolarHBondContact O-CG 3.47Å; E53-Q57 PolarHBondContact O-N 3.4Å; K54-Q57 PolarHBondContact O-N 3.5Å; I55-Q57 PolarHBondContact O-N 3.42Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 2.96Å; Q57-Q60 PolarHBondContact O-N 3.19Å; Q57-T61 WeakPolarHBondContact O-CG2 3.41Å; Q57-T61 PolarHBondContact O-N 2.97Å; Q57-T61 PolarHBondContact O-OG1 3.38Å
58	Q	70.9	Confident	62.9	Low	61 Å²	61	87.8 Å²	87.8	29%	0.285	44%	0.444	S	S	.	.	H	α-helix	trans	-67.5	-33.8	176.9	-161.9	-176.5	29.6	0	0	112.1	K54 I55 Q56 T61 N62	K54-Q58 WeakPolarHBondContact O-CB 3.31Å; K54-Q58 PolarHBondContact O-N 3.4Å; I55-Q58 PolarHBondContact O-N 3.26Å; Q56-Q58 VanDerWaalsContact C-N 3.35Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.27Å; Q58-T61 PolarHBondContact O-OG1 3.22Å; Q58-N62 WeakPolarHBondContact O-CB 3.27Å; Q58-N62 VanDerWaalsContact O-CG 3.29Å; Q58-N62 PolarHBondContact O-N 3.42Å; Q58-N62 VanDerWaalsContact O-N 3.08Å; Q58-N62 PolarHBondContact O-ND2 2.9Å
59	E	67.2	Low	61.7	Low	65 Å²	65	93.5 Å²	93.5	30%	0.304	48%	0.475	S	S	.	.	H	α-helix	trans	-68.6	-39.5	172.7	-73.1	-176.4	172.4	0	0	112.1	I55 Q56 Q57 N62 K63	I55-E59 WeakPolarHBondContact O-CG 3.36Å; I55-E59 PolarHBondContact O-N 3.44Å; Q56-E59 PolarHBondContact O-N 3.13Å; Q57-E59 VanDerWaalsContact C-N 3.33Å; Q57-E59 PolarHBondContact O-N 2.96Å; E59-N62 PolarHBondContact O-N 2.89Å; E59-K63 VanDerWaalsContact O-CB 3.3Å; E59-K63 WeakPolarHBondContact O-CB 3.35Å; E59-K63 VanDerWaalsContact O-CG 3.26Å; E59-K63 WeakPolarHBondContact O-CG 3.47Å; E59-K63 PolarHBondContact O-N 3.36Å
60	Q	64.3	Low	60.5	Low	142 Å²	142	96.7 Å²	96.7	66%	0.664	48%	0.484	S	S	*	.	H	α-helix	trans	-65.6	-38.8	176.3	-74	-177.6	11.2	0	0	112.4	Q56 Q57	Q56-Q60 WeakPolarHBondContact O-CG 3.44Å; Q56-Q60 PolarHBondContact O-N 3.39Å; Q57-Q60 PolarHBondContact O-N 3.19Å
61	T	60.1	Low	59.2	Low	97 Å²	97	97.1 Å²	97.1	60%	0.595	49%	0.49	S	S	*	.	H	α-helix	trans	-68.9	-37.6	175.7	53.9	0	0	0	0	111.9	Q57 Q58	Q57-T61 WeakPolarHBondContact O-CG2 3.41Å; Q57-T61 PolarHBondContact O-N 2.97Å; Q57-T61 PolarHBondContact O-OG1 3.38Å; Q58-T61 WeakPolarHBondContact CA-OG1 3.27Å; Q58-T61 PolarHBondContact O-OG1 3.22Å
62	N	54.8	Low	58.2	Low	76 Å²	76	101.6 Å²	101.6	41%	0.406	52%	0.519	S	S	.	.	H	α-helix	trans	-77.8	-23.3	176.7	-71.3	-47.6	0	0	0	114.1	Q58 E59 K64 S65 F66	Q58-N62 WeakPolarHBondContact O-CB 3.27Å; Q58-N62 VanDerWaalsContact O-CG 3.29Å; Q58-N62 PolarHBondContact O-N 3.42Å; Q58-N62 VanDerWaalsContact O-N 3.08Å; Q58-N62 PolarHBondContact O-ND2 2.9Å; E59-N62 PolarHBondContact O-N 2.89Å; N62-K64 PolarHBondContact O-N 3.04Å; N62-S65 PolarHBondContact O-N 3.34Å; N62-S65 PolarHBondContact O-OG 2.91Å; N62-S65 VanDerWaalsContact O-OG 3.09Å; N62-F66 PolarHBondContact O-N 3.34Å
63	K	52.6	Low	57	Low	152 Å²	152	105.8 Å²	105.8	66%	0.661	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.3	176.7	-88.4	173.6	179.7	172.4	0	113.6	E59 S65	E59-K63 VanDerWaalsContact O-CB 3.3Å; E59-K63 WeakPolarHBondContact O-CB 3.35Å; E59-K63 VanDerWaalsContact O-CG 3.26Å; E59-K63 WeakPolarHBondContact O-CG 3.47Å; E59-K63 PolarHBondContact O-N 3.36Å; K63-S65 PolarHBondContact O-N 3.48Å
64	K	49	Very low	55.8	Low	201 Å²	201	108.9 Å²	108.9	87%	0.874	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.3	166.6	-75.9	-173.7	177.3	-178.9	0	113.5	N62	N62-K64 PolarHBondContact O-N 3.04Å
65	S	46.6	Very low	54.7	Low	90 Å²	90	110.5 Å²	110.5	63%	0.629	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.4	-2.7	-176	63.9	0	0	0	0	116.3	N62 K63	N62-S65 PolarHBondContact O-N 3.34Å; N62-S65 PolarHBondContact O-OG 2.91Å; N62-S65 VanDerWaalsContact O-OG 3.09Å; K63-S65 PolarHBondContact O-N 3.48Å
66	F	42.1	Very low	53.6	Low	156 Å²	156	115.1 Å²	115.1	68%	0.684	58%	0.582	S	S	*	*			trans	-155.8	118.6	179.1	-135.8	-101.2	0	0	0	112.7	N62 S68	N62-F66 PolarHBondContact O-N 3.34Å; F66-S68 VanDerWaalsContact C-N 3.3Å; F66-S68 PolarHBondContact O-N 3.48Å
67	V	40.9	Very low	52.6	Low	142 Å²	142	115.8 Å²	115.8	86%	0.861	59%	0.585	S	S	*	*			trans	-70.8	90.4	161.4	178.6	0	0	0	0	106.3
68	S	45	Very low	51.8	Low	70 Å²	70	113.5 Å²	113.5	49%	0.49	57%	0.574	S	S	.	*			trans	-99.9	105.3	175.8	-166.1	0	0	0	0	109.5	F66 R70	F66-S68 VanDerWaalsContact C-N 3.3Å; F66-S68 PolarHBondContact O-N 3.48Å; S68-R70 PolarHBondContact O-N 3.31Å; S68-R70 WeakPolarHBondContact OG-CG 3.44Å
69	D	47	Very low	50.9	Low	164 Å²	164	114.5 Å²	114.5	88%	0.877	58%	0.584	S	S	*	*			trans	-65.6	68.5	163	-93.3	-26.8	0	0	0	109.9	S71	D69-S71 PolarHBondContact O-N 2.98Å
70	R	52.8	Low	50.1	Low	134 Å²	134	115.8 Å²	115.8	51%	0.506	59%	0.593	S	S	.	*			trans	-79.9	116.4	170.2	-71.4	-154.7	174.3	167.5	-4.4	109.6	S68 E74	S68-R70 PolarHBondContact O-N 3.31Å; S68-R70 WeakPolarHBondContact OG-CG 3.44Å; R70-E74 WeakPolarHBondContact CB-OE2 3.06Å; R70-E74 VanDerWaalsContact CD-OE2 3.27Å; R70-E74 WeakPolarHBondContact CD-OE2 3.43Å; R70-E74 WeakPolarHBondContact CG-OE2 3.37Å; R70-E74 IonicContact NE-OE2 3.09Å
71	S	46.3	Very low	49.8	Very low	55 Å²	55	113.2 Å²	113.2	39%	0.385	58%	0.58	S	S	.	*			trans	-62.2	149.1	176.4	76	0	0	0	0	110.9	D69 K73 E74	D69-S71 PolarHBondContact O-N 2.98Å; S71-K73 PolarHBondContact O-N 2.93Å; S71-E74 PolarHBondContact O-N 3.03Å
72	P	49.4	Very low	49.6	Very low	101 Å²	101	109.7 Å²	109.7	66%	0.656	56%	0.557	S	S	*	*	H	α-helix	trans	-57.3	-15.6	178	18.8	-30.3	0	0	0	114	L76	P72-L76 PolarHBondContact O-N 3.17Å
73	K	48.4	Very low	49.3	Very low	170 Å²	170	114.5 Å²	114.5	74%	0.739	57%	0.569	S	S	*	*	H	α-helix	trans	-71.5	-30.4	172.8	-73.6	-175.8	175.4	179.7	0	113.5	S71 L76 Q77	S71-K73 PolarHBondContact O-N 2.93Å; K73-L76 PolarHBondContact O-N 3.43Å; K73-Q77 PolarHBondContact O-N 3.43Å
74	E	50	Low	49.3	Very low	92 Å²	92	114.6 Å²	114.6	43%	0.43	57%	0.572	S	S	.	*	H	α-helix	trans	-74.7	-33.4	177.7	-68.4	-178.1	162.3	0	0	111.7	R70 S71 L76 Q77 E78	R70-E74 WeakPolarHBondContact CB-OE2 3.06Å; R70-E74 VanDerWaalsContact CD-OE2 3.27Å; R70-E74 WeakPolarHBondContact CD-OE2 3.43Å; R70-E74 WeakPolarHBondContact CG-OE2 3.37Å; R70-E74 IonicContact NE-OE2 3.09Å; S71-E74 PolarHBondContact O-N 3.03Å; E74-L76 VanDerWaalsContact C-N 3.32Å; E74-Q77 PolarHBondContact O-N 3.5Å; E74-E78 PolarHBondContact O-N 2.98Å
75	Q	48.1	Very low	49.6	Very low	109 Å²	109	106.3 Å²	106.3	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-36.9	171.2	-67.3	-179.6	7.2	0	0	111.5	E78 V79	Q75-E78 WeakPolarHBondContact O-CB 3.46Å; Q75-E78 PolarHBondContact O-N 3.44Å; Q75-V79 WeakPolarHBondContact O-CG2 3.1Å; Q75-V79 PolarHBondContact O-N 3.04Å; Q75-V79 VanDerWaalsContact O-N 3.15Å
76	L	46.7	Very low	49.9	Very low	122 Å²	122	105.4 Å²	105.4	64%	0.639	53%	0.525	S	S	*	.	H	α-helix	trans	-66.2	-36.9	175.3	-116.8	83.3	0	0	0	113	P72 K73 E74 E78 V79 D80	P72-L76 PolarHBondContact O-N 3.17Å; K73-L76 PolarHBondContact O-N 3.43Å; E74-L76 VanDerWaalsContact C-N 3.32Å; L76-E78 VanDerWaalsContact C-N 3.29Å; L76-E78 PolarHBondContact O-N 3.25Å; L76-V79 WeakPolarHBondContact O-CB 2.98Å; L76-V79 PolarHBondContact O-N 2.88Å; L76-D80 PolarHBondContact O-N 2.79Å; L76-D80 VanDerWaalsContact O-N 3.13Å
77	Q	52.3	Low	50.3	Low	130 Å²	130	105.5 Å²	105.5	61%	0.607	53%	0.525	S	S	*	.	H	α-helix	trans	-67.8	-28.6	173.4	-85.4	-176.2	-5.6	0	0	112.8	K73 E74 V79 D80 K81	K73-Q77 PolarHBondContact O-N 3.43Å; E74-Q77 PolarHBondContact O-N 3.5Å; Q77-V79 VanDerWaalsContact C-N 3.34Å; Q77-D80 PolarHBondContact O-N 3.08Å; Q77-K81 WeakPolarHBondContact O-CG 3.43Å; Q77-K81 PolarHBondContact O-N 3Å
78	E	54	Low	51	Low	54 Å²	54	100.4 Å²	100.4	25%	0.252	49%	0.493	S	S	.	.	H	α-helix	trans	-70.1	-33.2	173.1	-160.2	150	-158	0	0	111.3	E74 Q75 L76 K81 I82	E74-E78 PolarHBondContact O-N 2.98Å; Q75-E78 WeakPolarHBondContact O-CB 3.46Å; Q75-E78 PolarHBondContact O-N 3.44Å; L76-E78 VanDerWaalsContact C-N 3.29Å; L76-E78 PolarHBondContact O-N 3.25Å; E78-K81 WeakPolarHBondContact O-CB 3.43Å; E78-K81 PolarHBondContact O-N 2.9Å; E78-I82 VanDerWaalsContact O-CG1 3.29Å; E78-I82 WeakPolarHBondContact O-CG1 3.45Å; E78-I82 PolarHBondContact O-N 2.98Å
79	V	50.5	Low	51.6	Low	82 Å²	82	97.5 Å²	97.5	50%	0.497	47%	0.472	S	S	.	.	H	α-helix	trans	-66.8	-34.7	170.1	179.4	0	0	0	0	112.5	Q75 L76 Q77 I82 R83	Q75-V79 WeakPolarHBondContact O-CG2 3.1Å; Q75-V79 PolarHBondContact O-N 3.04Å; Q75-V79 VanDerWaalsContact O-N 3.15Å; L76-V79 WeakPolarHBondContact O-CB 2.98Å; L76-V79 PolarHBondContact O-N 2.88Å; Q77-V79 VanDerWaalsContact C-N 3.34Å; V79-I82 CarbonylContact O-C 3.53Å; V79-I82 WeakPolarHBondContact O-CA 3Å; V79-I82 VanDerWaalsContact O-CB 3.28Å; V79-I82 WeakPolarHBondContact O-CB 3.38Å; V79-I82 PolarHBondContact O-N 3.33Å; V79-R83 PolarHBondContact O-N 2.86Å
80	D	50.9	Low	52.2	Low	93 Å²	93	93.8 Å²	93.8	50%	0.497	46%	0.455	S	S	.	.	H	α-helix	trans	-72.5	-30.2	172.7	-84.2	-31.6	0	0	0	112.9	L76 Q77 I82 R83 Q84	L76-D80 PolarHBondContact O-N 2.79Å; L76-D80 VanDerWaalsContact O-N 3.13Å; Q77-D80 PolarHBondContact O-N 3.08Å; D80-I82 VanDerWaalsContact C-N 3.28Å; D80-R83 WeakPolarHBondContact O-CB 3.37Å; D80-R83 PolarHBondContact O-N 3.13Å; D80-Q84 PolarHBondContact O-N 3.42Å
81	K	58.1	Low	52.6	Low	88 Å²	88	91.2 Å²	91.2	38%	0.383	45%	0.449	S	S	.	.	H	α-helix	trans	-66.3	-34	166.7	-70.6	174.8	-175.3	173.9	0	111.4	Q77 E78 R83 Q84 Q85 L208	Q77-K81 WeakPolarHBondContact O-CG 3.43Å; Q77-K81 PolarHBondContact O-N 3Å; E78-K81 WeakPolarHBondContact O-CB 3.43Å; E78-K81 PolarHBondContact O-N 2.9Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 2.94Å; K81-Q84 WeakPolarHBondContact O-CB 3.24Å; K81-Q84 PolarHBondContact O-N 3.24Å; K81-Q84 VanDerWaalsContact O-N 3.15Å; K81-Q85 PolarHBondContact O-N 3.31Å; K81-L208 VanDerWaalsContact NZ-CD1 3.33Å
82	I	55.6	Low	53.4	Low	23 Å²	23	89.8 Å²	89.8	12%	0.118	44%	0.435	C	S	.	.	H	α-helix	trans	-63.1	-34.5	171	-69.2	162.5	0	0	0	111	L48 L52 E78 V79 D80 Q84 Q85	L48-I82 HydrophobicContact CD2-CG2 3.46Å; L48-I82 VanDerWaalsContact CD2-CG2 3.46Å; L52-I82 HydrophobicContact CD2-CD1 3.76Å; E78-I82 VanDerWaalsContact O-CG1 3.29Å; E78-I82 WeakPolarHBondContact O-CG1 3.45Å; E78-I82 PolarHBondContact O-N 2.98Å; V79-I82 CarbonylContact O-C 3.53Å; V79-I82 WeakPolarHBondContact O-CA 3Å; V79-I82 VanDerWaalsContact O-CB 3.28Å; V79-I82 WeakPolarHBondContact O-CB 3.38Å; V79-I82 PolarHBondContact O-N 3.33Å; D80-I82 VanDerWaalsContact C-N 3.28Å; I82-Q84 VanDerWaalsContact C-N 3.35Å; I82-Q84 PolarHBondContact O-N 3.09Å; I82-Q85 WeakPolarHBondContact O-CA 3.45Å; I82-Q85 WeakPolarHBondContact O-CB 3.32Å; I82-Q85 PolarHBondContact O-N 2.91Å
83	R	48.3	Very low	54.3	Low	176 Å²	176	86.4 Å²	86.4	66%	0.664	41%	0.414	S	S	*	.	H	α-helix	trans	-64.6	-33.4	171	-90.2	-176.4	177.4	-177	0.7	114.2	V79 D80 K81 Q85 N86	V79-R83 PolarHBondContact O-N 2.86Å; D80-R83 WeakPolarHBondContact O-CB 3.37Å; D80-R83 PolarHBondContact O-N 3.13Å; K81-R83 VanDerWaalsContact C-N 3.29Å; K81-R83 PolarHBondContact O-N 2.94Å; R83-Q85 PolarHBondContact O-N 3.34Å; R83-N86 VanDerWaalsContact O-CB 3.27Å; R83-N86 WeakPolarHBondContact O-CB 3.38Å; R83-N86 PolarHBondContact O-N 3.39Å; R83-N86 VanDerWaalsContact O-N 3.09Å
84	Q	52.9	Low	55.4	Low	154 Å²	154	81.8 Å²	81.8	72%	0.72	40%	0.403	S	S	*	.	H	α-helix	trans	-65.8	-20.1	170.6	-67.3	-175.9	-11.4	0	0	111.9	D80 K81 I82 N86 F87	D80-Q84 PolarHBondContact O-N 3.42Å; K81-Q84 WeakPolarHBondContact O-CB 3.24Å; K81-Q84 PolarHBondContact O-N 3.24Å; K81-Q84 VanDerWaalsContact O-N 3.15Å; I82-Q84 VanDerWaalsContact C-N 3.35Å; I82-Q84 PolarHBondContact O-N 3.09Å; Q84-N86 PolarHBondContact O-N 3.35Å; Q84-F87 WeakPolarHBondContact O-CB 3.27Å; Q84-F87 PolarHBondContact O-N 3.47Å
85	Q	55.7	Low	56.5	Low	27 Å²	27	78 Å²	78	13%	0.126	39%	0.386	C	S	.	.	H	α-helix	trans	-68.4	-16.4	171.7	-55.3	167.8	-14.3	0	0	112.8	K81 I82 R83 F87 L88 I89	K81-Q85 PolarHBondContact O-N 3.31Å; I82-Q85 WeakPolarHBondContact O-CA 3.45Å; I82-Q85 WeakPolarHBondContact O-CB 3.32Å; I82-Q85 PolarHBondContact O-N 2.91Å; R83-Q85 PolarHBondContact O-N 3.34Å; Q85-F87 PolarHBondContact O-N 3.19Å; Q85-F87 VanDerWaalsContact O-N 3.13Å; Q85-L88 HydrophobicContact CG-CD1 4.49Å; Q85-L88 WeakPolarHBondContact O-CA 3.38Å; Q85-L88 WeakPolarHBondContact O-CB 3.25Å; Q85-L88 PolarHBondContact O-N 3.45Å; Q85-I89 WeakPolarHBondContact O-CG1 3.33Å; Q85-I89 PolarHBondContact O-N 3.42Å
86	N	52.3	Low	57.9	Low	71 Å²	71	73 Å²	73	38%	0.38	36%	0.363	S	S	.	.	H	α-helix	trans	-56	-31.2	171	-69.7	-4.8	0	0	0	111.5	R83 Q84 I89 T90	R83-N86 VanDerWaalsContact O-CB 3.27Å; R83-N86 WeakPolarHBondContact O-CB 3.38Å; R83-N86 PolarHBondContact O-N 3.39Å; R83-N86 VanDerWaalsContact O-N 3.09Å; Q84-N86 PolarHBondContact O-N 3.35Å; N86-I89 PolarHBondContact O-N 3.15Å; N86-T90 WeakPolarHBondContact O-CG2 3.3Å; N86-T90 PolarHBondContact O-N 3.42Å; N86-T90 VanDerWaalsContact O-N 3.14Å; N86-T90 PolarHBondContact O-OG1 3.1Å
87	F	51.5	Low	59.6	Low	158 Å²	158	69.8 Å²	69.8	69%	0.693	35%	0.346	S	S	*	.	H	α-helix	trans	-67.5	-36.7	173.1	-173.4	-97.7	0	0	0	112.6	Q84 Q85 T90 Q91	Q84-F87 WeakPolarHBondContact O-CB 3.27Å; Q84-F87 PolarHBondContact O-N 3.47Å; Q85-F87 PolarHBondContact O-N 3.19Å; Q85-F87 VanDerWaalsContact O-N 3.13Å; F87-T90 PolarHBondContact O-OG1 2.85Å; F87-Q91 PolarHBondContact O-N 2.83Å
88	L	55.3	Low	61	Low	36 Å²	36	66.3 Å²	66.3	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-75	-33	177.5	-63.7	166.3	0	0	0	111.8	Q85 T90 Q91 V196 L197 C200	Q85-L88 HydrophobicContact CG-CD1 4.49Å; Q85-L88 WeakPolarHBondContact O-CA 3.38Å; Q85-L88 WeakPolarHBondContact O-CB 3.25Å; Q85-L88 PolarHBondContact O-N 3.45Å; L88-T90 VanDerWaalsContact C-N 3.32Å; L88-T90 PolarHBondContact O-N 3.49Å; L88-Q91 WeakPolarHBondContact O-CB 3.46Å; L88-Q91 PolarHBondContact O-N 3.28Å; L88-V196 HydrophobicContact CD2-CG1 4.21Å; L88-L197 HydrophobicContact CB-CD2 3.41Å; L88-L197 VanDerWaalsContact CB-CD2 3.41Å; L88-L197 HydrophobicContact CD1-CD2 4.31Å; L88-L197 HydrophobicContact CG-CD2 4.43Å; L88-C200 HydrophobicContact CD1-CB 4.39Å; L88-C200 WeakPolarHBondContact CD1-SG 3.26Å
89	I	57.5	Low	62.2	Low	9 Å²	9	63.8 Å²	63.8	5%	0.046	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-40.2	174.5	-62.5	165.4	0	0	0	109.9	E44 L48 Q85 N86 Q91 W92 C93	E44-I89 HydrophobicContact CB-CG2 3.88Å; E44-I89 HydrophobicContact CG-CD1 3.82Å; E44-I89 HydrophobicContact CG-CG2 3.95Å; L48-I89 HydrophobicContact CD2-CD1 4.18Å; L48-I89 HydrophobicContact CG-CD1 4.22Å; Q85-I89 WeakPolarHBondContact O-CG1 3.33Å; Q85-I89 PolarHBondContact O-N 3.42Å; N86-I89 PolarHBondContact O-N 3.15Å; I89-Q91 PolarHBondContact O-N 3.16Å; I89-W92 PolarHBondContact O-N 3.12Å; I89-W92 VanDerWaalsContact O-N 3.13Å; I89-C93 PolarHBondContact O-N 3.23Å; I89-C93 PolarHBondContact O-SG 3.35Å; I89-C93 VanDerWaalsContact O-SG 3.33Å
90	T	59.2	Low	63.9	Low	86 Å²	86	59.9 Å²	59.9	53%	0.528	30%	0.3	S	S	.	.	H	α-helix	trans	-62.4	-27.6	175.2	51	0	0	0	0	113.9	N86 F87 L88 W92	N86-T90 WeakPolarHBondContact O-CG2 3.3Å; N86-T90 PolarHBondContact O-N 3.42Å; N86-T90 VanDerWaalsContact O-N 3.14Å; N86-T90 PolarHBondContact O-OG1 3.1Å; F87-T90 PolarHBondContact O-OG1 2.85Å; L88-T90 VanDerWaalsContact C-N 3.32Å; L88-T90 PolarHBondContact O-N 3.49Å; T90-W92 VanDerWaalsContact C-N 3.28Å; T90-W92 PolarHBondContact O-N 3.46Å
91	Q	61.8	Low	65.4	Low	80 Å²	80	59.7 Å²	59.7	37%	0.374	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-30	177.5	-170.1	177	-10.3	0	0	112.1	F87 L88 I89 P95	F87-Q91 PolarHBondContact O-N 2.83Å; L88-Q91 WeakPolarHBondContact O-CB 3.46Å; L88-Q91 PolarHBondContact O-N 3.28Å; I89-Q91 PolarHBondContact O-N 3.16Å; Q91-P95 WeakPolarHBondContact O-CD 3.31Å
92	W	62.2	Low	66.4	Low	24 Å²	24	57.1 Å²	57.1	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-83.6	-31.9	-179.7	-76.3	43.9	0	0	0	113.2	M43 I89 T90 S94 P95 L96 S193 M194 L197	M43-W92 HydrophobicContact CE-CB 4.08Å; M43-W92 HydrophobicContact SD-CE3 4.34Å; I89-W92 PolarHBondContact O-N 3.12Å; I89-W92 VanDerWaalsContact O-N 3.13Å; T90-W92 VanDerWaalsContact C-N 3.28Å; T90-W92 PolarHBondContact O-N 3.46Å; W92-S94 PolarHBondContact O-N 2.77Å; W92-P95 WeakPolarHBondContact O-CD 3.39Å; W92-L96 PolarHBondContact O-N 2.99Å; W92-S193 VanDerWaalsContact CD1-CB 3.42Å; W92-S193 WeakPolarHBondContact CZ2-O 3.28Å; W92-S193 PolarHBondContact NE1-O 3.28Å; W92-M194 HydrophobicContact CE3-CG 4.15Å; W92-M194 HydrophobicContact CH2-CB 4.05Å; W92-M194 HydrophobicContact CH2-CG 3.89Å; W92-M194 WeakPolarHBondContact CH2-O 3.39Å; W92-M194 VanDerWaalsContact CZ2-C 3.42Å; W92-M194 HydrophobicContact CZ2-CB 4.25Å; W92-M194 HydrophobicContact CZ2-CG 4.37Å; W92-M194 WeakPolarHBondContact CZ2-O 3.48Å; W92-M194 HydrophobicContact CZ3-CB 4.38Å; W92-M194 HydrophobicContact CZ3-CG 3.71Å; W92-L197 HydrophobicContact CD2-CD1 3.24Å; W92-L197 HydrophobicContact CD2-CG 4.01Å; W92-L197 HydrophobicContact CE3-CD1 3.78Å; W92-L197 HydrophobicContact CG-CD1 3.65Å; W92-L197 HydrophobicContact CG-CG 4.4Å; W92-L197 HydrophobicContact CH2-CB 3.7Å; W92-L197 HydrophobicContact CH2-CD1 3.62Å; W92-L197 HydrophobicContact CH2-CG 3.97Å; W92-L197 HydrophobicContact CZ2-CB 3.09Å; W92-L197 HydrophobicContact CZ2-CD1 3.16Å; W92-L197 HydrophobicContact CZ2-CG 3.14Å; W92-L197 HydrophobicContact CZ3-CD1 3.95Å; W92-L197 VanDerWaalsContact NE1-CD1 3.26Å
93	C	68.3	Low	67.6	Low	31 Å²	31	56.2 Å²	56.2	21%	0.209	28%	0.284	C	S	.	.	H	α-helix	trans	-60.3	-35.2	-180	-66	0	0	0	0	110.9	F40 I89 D97	F40-C93 HydrophobicContact CD1-CB 4.16Å; F40-C93 HydrophobicContact CE1-CB 4.35Å; I89-C93 PolarHBondContact O-N 3.23Å; I89-C93 PolarHBondContact O-SG 3.35Å; I89-C93 VanDerWaalsContact O-SG 3.33Å; C93-D97 WeakPolarHBondContact O-CB 3.34Å; C93-D97 PolarHBondContact O-N 2.79Å
94	S	71.7	Confident	69	Low	72 Å²	72	48.2 Å²	48.2	50%	0.503	26%	0.256	S	S	.	.	H	α-helix	trans	-67	-53.2	-177.3	172.5	0	0	0	0	113.8	W92 L96 D97 C98	W92-S94 PolarHBondContact O-N 2.77Å; S94-L96 VanDerWaalsContact C-N 3.31Å; S94-L96 PolarHBondContact O-N 2.74Å; S94-D97 PolarHBondContact O-N 2.8Å; S94-C98 PolarHBondContact O-N 2.89Å; S94-C98 PolarHBondContact O-SG 3.22Å
95	P	73.1	Confident	70.3	Confident	12 Å²	12	42.3 Å²	42.3	8%	0.078	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-37	176.7	-26.8	35.7	0	0	0	113.7	Q91 W92 L99 P189 L190	Q91-P95 WeakPolarHBondContact O-CD 3.31Å; W92-P95 WeakPolarHBondContact O-CD 3.39Å; P95-L99 WeakPolarHBondContact O-CB 3.29Å; P95-L99 PolarHBondContact O-N 3.2Å; P95-P189 HydrophobicContact CB-CB 3.96Å; P95-P189 HydrophobicContact CG-CB 3.69Å; P95-L190 HydrophobicContact CB-CB 3.89Å; P95-L190 HydrophobicContact CB-CD1 4.33Å
96	L	79.1	Confident	71.4	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-67.3	-41.7	175.7	-178.6	62.7	0	0	0	110.9	F40 M43 W92 S94 L99 L100 L190	F40-L96 HydrophobicContact CD1-CD2 4.11Å; F40-L96 HydrophobicContact CE1-CB 4.15Å; F40-L96 HydrophobicContact CE1-CD2 3.91Å; F40-L96 HydrophobicContact CE1-CG 3.99Å; M43-L96 HydrophobicContact CE-CD2 3.71Å; M43-L96 HydrophobicContact SD-CD2 3.49Å; M43-L96 WeakPolarHBondContact SD-CD2 3.27Å; W92-L96 PolarHBondContact O-N 2.99Å; S94-L96 VanDerWaalsContact C-N 3.31Å; S94-L96 PolarHBondContact O-N 2.74Å; L96-L99 HydrophobicContact CD1-CD2 4.27Å; L96-L99 WeakPolarHBondContact O-CB 3.5Å; L96-L99 PolarHBondContact O-N 3.17Å; L96-L100 HydrophobicContact CD1-CG 4.46Å; L96-L100 HydrophobicContact CG-CG 4.43Å; L96-L100 VanDerWaalsContact O-CG 3.3Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.38Å; L96-L190 HydrophobicContact CB-CD1 4.15Å
97	D	82.3	Confident	72.7	Confident	56 Å²	56	47.2 Å²	47.2	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-60.7	-48.4	177	-165.7	35.9	0	0	0	111.2	F40 C93 S94 L99 L100 H101	F40-D97 HydrophobicContact CE1-CB 4.25Å; F40-D97 HydrophobicContact CE2-CB 4.37Å; F40-D97 HydrophobicContact CZ-CB 3.53Å; F40-D97 WeakPolarHBondContact CZ-OD1 3.48Å; C93-D97 WeakPolarHBondContact O-CB 3.34Å; C93-D97 PolarHBondContact O-N 2.79Å; S94-D97 PolarHBondContact O-N 2.8Å; D97-L99 VanDerWaalsContact C-N 3.28Å; D97-L99 PolarHBondContact O-N 3.09Å; D97-L100 PolarHBondContact O-N 2.89Å; D97-H101 PolarHBondContact O-N 3.47Å; D97-H101 VanDerWaalsContact O-N 3.16Å; D97-H101 PolarHBondContact O-ND1 3.33Å; D97-H101 IonicContact OD1-CE1 3.42Å; D97-H101 PolarHBondContact OD1-CE1 3.04Å; D97-H101 IonicContact OD1-ND1 3.89Å; D97-H101 PolarHBondContact OD1-ND1 3.35Å; D97-H101 IonicContact OD2-CE1 3.98Å
98	C	80.6	Confident	74.2	Confident	57 Å²	57	40.8 Å²	40.8	39%	0.385	22%	0.216	S	C	.	.	H	α-helix	trans	-57.3	-44.5	174.7	-63.2	0	0	0	0	111	S94 L100 H101 C102 C186	S94-C98 PolarHBondContact O-N 2.89Å; S94-C98 PolarHBondContact O-SG 3.22Å; C98-L100 PolarHBondContact O-N 3.39Å; C98-H101 PolarHBondContact O-N 3.14Å; C98-C102 PolarHBondContact O-N 2.91Å; C98-C102 PolarHBondContact O-SG 3.49Å; C98-C102 VanDerWaalsContact O-SG 3.38Å; C98-C186 HydrophobicContact CB-CB 4.41Å; C98-C186 WeakPolarHBondContact CB-SG 3.39Å
99	L	80.6	Confident	75.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.9	-49.1	176.6	-176.8	71.3	0	0	0	111.6	P95 L96 D97 H101 C102 L103 L173 I183 C186 L190	P95-L99 WeakPolarHBondContact O-CB 3.29Å; P95-L99 PolarHBondContact O-N 3.2Å; L96-L99 HydrophobicContact CD1-CD2 4.27Å; L96-L99 WeakPolarHBondContact O-CB 3.5Å; L96-L99 PolarHBondContact O-N 3.17Å; D97-L99 VanDerWaalsContact C-N 3.28Å; D97-L99 PolarHBondContact O-N 3.09Å; L99-H101 PolarHBondContact O-N 2.93Å; L99-H101 VanDerWaalsContact O-N 3.17Å; L99-C102 WeakPolarHBondContact O-CB 3.33Å; L99-C102 PolarHBondContact O-N 3.49Å; L99-L103 HydrophobicContact CD1-CD2 4.47Å; L99-L103 WeakPolarHBondContact O-CG 3.46Å; L99-L103 PolarHBondContact O-N 3.35Å; L99-L173 HydrophobicContact CD1-CD2 4.13Å; L99-L173 HydrophobicContact CD2-CD1 3.5Å; L99-L173 HydrophobicContact CD2-CD2 3.84Å; L99-L173 HydrophobicContact CD2-CG 4.26Å; L99-L173 HydrophobicContact CG-CD2 4.25Å; L99-I183 HydrophobicContact CD1-CG1 4.47Å; L99-I183 HydrophobicContact CD1-CG2 3.87Å; L99-C186 HydrophobicContact CB-CB 4.15Å; L99-C186 HydrophobicContact CD1-CB 4.32Å; L99-L190 HydrophobicContact CD2-CD2 3.88Å
100	L	84.3	Confident	76.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-31.6	179.8	-68.1	-177.7	0	0	0	112.5	F32 L39 F40 L96 D97 C98 L103 F108 L111	F32-L100 HydrophobicContact CE2-CB 4.34Å; F32-L100 HydrophobicContact CZ-CB 4.12Å; L39-L100 HydrophobicContact CD1-CD1 3.92Å; L39-L100 HydrophobicContact CD1-CD2 3.99Å; F40-L100 HydrophobicContact CE1-CD1 4.46Å; F40-L100 HydrophobicContact CZ-CD1 4.15Å; L96-L100 HydrophobicContact CD1-CG 4.46Å; L96-L100 HydrophobicContact CG-CG 4.43Å; L96-L100 VanDerWaalsContact O-CG 3.3Å; L96-L100 WeakPolarHBondContact O-CG 3.37Å; L96-L100 PolarHBondContact O-N 3.38Å; D97-L100 PolarHBondContact O-N 2.89Å; C98-L100 PolarHBondContact O-N 3.39Å; L100-L103 HydrophobicContact CD2-CD1 4.39Å; L100-F108 HydrophobicContact CD2-CD2 4.18Å; L100-F108 HydrophobicContact CD2-CE2 3.93Å; L100-L111 HydrophobicContact CD2-CD2 3.27Å
101	H	84.2	Confident	77.8	Confident	89 Å²	89	41.2 Å²	41.2	41%	0.412	22%	0.223	S	C	.	.	H	α-helix	trans	-77.8	-19.9	176.9	-72.6	81.3	0	0	0	113.5	F32 D97 C98 L99	F32-H101 AromaticContact CE1-CE1 3.88Å; F32-H101 AromaticContact CE1-NE2 3.71Å; D97-H101 PolarHBondContact O-N 3.47Å; D97-H101 VanDerWaalsContact O-N 3.16Å; D97-H101 PolarHBondContact O-ND1 3.33Å; D97-H101 IonicContact OD1-CE1 3.42Å; D97-H101 PolarHBondContact OD1-CE1 3.04Å; D97-H101 IonicContact OD1-ND1 3.89Å; D97-H101 PolarHBondContact OD1-ND1 3.35Å; D97-H101 IonicContact OD2-CE1 3.98Å; C98-H101 PolarHBondContact O-N 3.14Å; L99-H101 PolarHBondContact O-N 2.93Å; L99-H101 VanDerWaalsContact O-N 3.17Å
102	C	78.8	Confident	79	Confident	34 Å²	34	39.6 Å²	39.6	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-89.5	-13.7	177.1	-68.2	0	0	0	0	113.7	C98 L99 I183	C98-C102 PolarHBondContact O-N 2.91Å; C98-C102 PolarHBondContact O-SG 3.49Å; C98-C102 VanDerWaalsContact O-SG 3.38Å; L99-C102 WeakPolarHBondContact O-CB 3.33Å; L99-C102 PolarHBondContact O-N 3.49Å; C102-I183 HydrophobicContact CB-CG1 3.76Å
103	L	79.8	Confident	80.1	Confident	5 Å²	5	41 Å²	41	3%	0.026	23%	0.229	C	C	.	.			trans	-79	133.1	-175.5	-62.9	175.9	0	0	0	112.2	L99 L100 E107 F108 L111 L173 I183	L99-L103 HydrophobicContact CD1-CD2 4.47Å; L99-L103 WeakPolarHBondContact O-CG 3.46Å; L99-L103 PolarHBondContact O-N 3.35Å; L100-L103 HydrophobicContact CD2-CD1 4.39Å; L103-E107 HydrophobicContact CB-CB 4.23Å; L103-E107 HydrophobicContact CD2-CB 3.92Å; L103-F108 HydrophobicContact CB-CB 4.18Å; L103-F108 HydrophobicContact CD1-CD2 4.45Å; L103-L111 HydrophobicContact CD1-CB 4.39Å; L103-L111 HydrophobicContact CD1-CD2 3.48Å; L103-L111 VanDerWaalsContact CD1-CD2 3.48Å; L103-L173 HydrophobicContact CD1-CD2 4.33Å; L103-L173 HydrophobicContact CD2-CD2 3.63Å; L103-I183 HydrophobicContact CD2-CD1 3.99Å
104	A	77.8	Confident	80.9	Confident	8 Å²	8	41.1 Å²	41.1	7%	0.066	23%	0.228	C	C	.	.			trans	-68.5	159.4	162.9	0	0	0	0	0	110.7	R106 E107 F108 E180	A104-R106 PolarHBondContact O-N 3.03Å; A104-R106 VanDerWaalsContact O-N 3.12Å; A104-E107 VanDerWaalsContact C-OE2 3.28Å; A104-E107 WeakPolarHBondContact CA-OE2 3.25Å; A104-E107 WeakPolarHBondContact CB-OE2 3.41Å; A104-E107 PolarHBondContact O-N 2.88Å; A104-E107 VanDerWaalsContact O-N 3.14Å; A104-F108 WeakPolarHBondContact O-CB 3.47Å; A104-F108 PolarHBondContact O-N 3.35Å; A104-E180 WeakPolarHBondContact CB-OE1 3.43Å
105	P	80.2	Confident	81.5	Confident	30 Å²	30	38 Å²	38	20%	0.195	21%	0.206	C	C	.	.	H	α-helix	trans	-58.6	-29.7	-172.4	-28	36	0	0	0	114.1	R23 L25 A109	R23-P105 WeakPolarHBondContact O-CD 3.35Å; R23-P105 WeakPolarHBondContact O-CG 3.47Å; L25-P105 HydrophobicContact CB-CG 4.46Å; P105-A109 VanDerWaalsContact O-CB 3.31Å; P105-A109 WeakPolarHBondContact O-CB 3.29Å; P105-A109 PolarHBondContact O-N 3.08Å
106	R	78.8	Confident	82.2	Confident	164 Å²	164	43.5 Å²	43.5	62%	0.619	23%	0.225	S	C	*	.	H	α-helix	trans	-67.4	-48.9	177.5	178.6	176.4	178.4	-119.2	2.3	110.7	A104 A109 I110	A104-R106 PolarHBondContact O-N 3.03Å; A104-R106 VanDerWaalsContact O-N 3.12Å; R106-A109 PolarHBondContact O-N 2.87Å; R106-I110 HydrophobicContact CG-CD1 4.17Å; R106-I110 VanDerWaalsContact O-CG1 3.3Å; R106-I110 WeakPolarHBondContact O-CG1 3.42Å; R106-I110 PolarHBondContact O-N 3.19Å
107	E	80.3	Confident	82.5	Confident	37 Å²	37	48.5 Å²	48.5	17%	0.173	24%	0.244	C	C	.	.	H	α-helix	trans	-66.9	-41.4	-180	-63.5	65.9	-147	0	0	110.2	L103 A104 A109 I110 L111 A176	L103-E107 HydrophobicContact CB-CB 4.23Å; L103-E107 HydrophobicContact CD2-CB 3.92Å; A104-E107 VanDerWaalsContact C-OE2 3.28Å; A104-E107 WeakPolarHBondContact CA-OE2 3.25Å; A104-E107 WeakPolarHBondContact CB-OE2 3.41Å; A104-E107 PolarHBondContact O-N 2.88Å; A104-E107 VanDerWaalsContact O-N 3.14Å; E107-A109 PolarHBondContact O-N 3.38Å; E107-I110 PolarHBondContact O-N 3.14Å; E107-L111 WeakPolarHBondContact O-CB 3.34Å; E107-L111 PolarHBondContact O-N 3.35Å; E107-A176 HydrophobicContact CG-CB 3.88Å
108	F	83.4	Confident	82.6	Confident	22 Å²	22	46.2 Å²	46.2	10%	0.096	23%	0.231	C	C	.	.	H	α-helix	trans	-60.5	-43.6	172.9	-173.9	-96.3	0	0	0	111.6	L25 F32 T35 L100 L103 A104 I110 L111 I112	L25-F108 HydrophobicContact CD1-CD1 4.3Å; L25-F108 HydrophobicContact CD1-CG 4.46Å; L25-F108 HydrophobicContact CD2-CB 4.06Å; L25-F108 HydrophobicContact CD2-CD1 4.25Å; L25-F108 HydrophobicContact CD2-CD2 3.64Å; L25-F108 HydrophobicContact CD2-CE2 4.09Å; L25-F108 HydrophobicContact CD2-CG 3.72Å; F32-F108 HydrophobicContact CD2-CE2 4.08Å; F32-F108 HydrophobicContact CD2-CZ 4.1Å; F32-F108 HydrophobicContact CE2-CD2 4.37Å; F32-F108 AromaticContact CE2-CE2 3.8Å; F32-F108 HydrophobicContact CE2-CE2 3.8Å; F32-F108 HydrophobicContact CE2-CZ 4.29Å; T35-F108 HydrophobicContact CG2-CE1 4.13Å; T35-F108 HydrophobicContact CG2-CZ 3.7Å; L100-F108 HydrophobicContact CD2-CD2 4.18Å; L100-F108 HydrophobicContact CD2-CE2 3.93Å; L103-F108 HydrophobicContact CB-CB 4.18Å; L103-F108 HydrophobicContact CD1-CD2 4.45Å; A104-F108 WeakPolarHBondContact O-CB 3.47Å; A104-F108 PolarHBondContact O-N 3.35Å; F108-I110 PolarHBondContact O-N 3.44Å; F108-L111 WeakPolarHBondContact O-CB 3.07Å; F108-L111 PolarHBondContact O-N 2.96Å; F108-I112 HydrophobicContact CD1-CG1 4.03Å; F108-I112 HydrophobicContact CE1-CD1 4.18Å; F108-I112 HydrophobicContact CE1-CG1 3.71Å; F108-I112 HydrophobicContact CE2-CD1 4.49Å; F108-I112 HydrophobicContact CZ-CD1 3.99Å; F108-I112 HydrophobicContact CZ-CG1 4.02Å; F108-I112 VanDerWaalsContact O-CG1 3.29Å; F108-I112 WeakPolarHBondContact O-CG1 3.31Å; F108-I112 PolarHBondContact O-N 3.33Å
109	A	83	Confident	82.8	Confident	57 Å²	57	45.6 Å²	45.6	47%	0.471	22%	0.224	S	C	.	.	H	α-helix	trans	-64.4	-39.6	177	0	0	0	0	0	112.6	P105 R106 E107 I112 S113	P105-A109 VanDerWaalsContact O-CB 3.31Å; P105-A109 WeakPolarHBondContact O-CB 3.29Å; P105-A109 PolarHBondContact O-N 3.08Å; R106-A109 PolarHBondContact O-N 2.87Å; E107-A109 PolarHBondContact O-N 3.38Å; A109-I112 PolarHBondContact O-N 3.35Å; A109-S113 WeakPolarHBondContact O-CB 3.3Å; A109-S113 PolarHBondContact O-N 3.14Å
110	I	81.9	Confident	83.1	Confident	80 Å²	80	52.3 Å²	52.3	41%	0.41	25%	0.249	S	C	.	.	H	α-helix	trans	-61.6	-48.4	174.2	-68.4	164.1	0	0	0	110	R106 E107 F108 I112 S113 D114	R106-I110 HydrophobicContact CG-CD1 4.17Å; R106-I110 VanDerWaalsContact O-CG1 3.3Å; R106-I110 WeakPolarHBondContact O-CG1 3.42Å; R106-I110 PolarHBondContact O-N 3.19Å; E107-I110 PolarHBondContact O-N 3.14Å; F108-I110 PolarHBondContact O-N 3.44Å; I110-I112 PolarHBondContact O-N 2.78Å; I110-S113 PolarHBondContact O-N 3.5Å; I110-D114 PolarHBondContact O-N 2.82Å
111	L	82.7	Confident	83.1	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-54.9	-51.6	176.6	170.4	68.4	0	0	0	111.7	L100 L103 E107 F108 S113 D114 I115 L169	L100-L111 HydrophobicContact CD2-CD2 3.27Å; L103-L111 HydrophobicContact CD1-CB 4.39Å; L103-L111 HydrophobicContact CD1-CD2 3.48Å; L103-L111 VanDerWaalsContact CD1-CD2 3.48Å; E107-L111 WeakPolarHBondContact O-CB 3.34Å; E107-L111 PolarHBondContact O-N 3.35Å; F108-L111 WeakPolarHBondContact O-CB 3.07Å; F108-L111 PolarHBondContact O-N 2.96Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 3.3Å; L111-D114 PolarHBondContact O-N 3.13Å; L111-I115 HydrophobicContact CD1-CD1 3.7Å; L111-I115 HydrophobicContact CD1-CG1 4.17Å; L111-I115 HydrophobicContact CG-CD1 3.98Å; L111-I115 WeakPolarHBondContact O-CG1 3.37Å; L111-I115 PolarHBondContact O-N 3.5Å; L111-L169 HydrophobicContact CB-CD1 4.11Å; L111-L169 HydrophobicContact CD1-CD1 3.48Å; L111-L169 VanDerWaalsContact CD1-CD1 3.48Å; L111-L169 HydrophobicContact CD1-CD2 3.23Å; L111-L169 HydrophobicContact CD1-CG 3.8Å; L111-L169 HydrophobicContact CG-CD1 4.42Å
112	I	85.1	Confident	83.2	Confident	46 Å²	46	50.6 Å²	50.6	24%	0.236	24%	0.243	C	C	.	.	H	α-helix	trans	-62	-40	179.2	-65.1	-61.7	0	0	0	111.4	T35 L39 F108 A109 I110 R116	T35-I112 HydrophobicContact CG2-CD1 3.52Å; T35-I112 HydrophobicContact CG2-CG1 4.31Å; L39-I112 HydrophobicContact CD1-CD1 3.63Å; L39-I112 HydrophobicContact CD2-CD1 3.89Å; L39-I112 HydrophobicContact CG-CD1 4.01Å; F108-I112 HydrophobicContact CD1-CG1 4.03Å; F108-I112 HydrophobicContact CE1-CD1 4.18Å; F108-I112 HydrophobicContact CE1-CG1 3.71Å; F108-I112 HydrophobicContact CE2-CD1 4.49Å; F108-I112 HydrophobicContact CZ-CD1 3.99Å; F108-I112 HydrophobicContact CZ-CG1 4.02Å; F108-I112 VanDerWaalsContact O-CG1 3.29Å; F108-I112 WeakPolarHBondContact O-CG1 3.31Å; F108-I112 PolarHBondContact O-N 3.33Å; A109-I112 PolarHBondContact O-N 3.35Å; I110-I112 PolarHBondContact O-N 2.78Å; I112-R116 VanDerWaalsContact O-CB 3.25Å; I112-R116 WeakPolarHBondContact O-CB 3.34Å; I112-R116 PolarHBondContact O-N 3.33Å
113	S	86.6	Confident	83.4	Confident	53 Å²	53	54 Å²	54	37%	0.371	26%	0.257	S	S	.	.	H	α-helix	trans	-64.6	-42.8	178.6	-166.3	0	0	0	0	111.8	A109 I110 L111 R116 R117	A109-S113 WeakPolarHBondContact O-CB 3.3Å; A109-S113 PolarHBondContact O-N 3.14Å; I110-S113 PolarHBondContact O-N 3.5Å; L111-S113 VanDerWaalsContact C-N 3.31Å; L111-S113 PolarHBondContact O-N 3.3Å; S113-R116 PolarHBondContact O-N 3.18Å; S113-R116 PolarHBondContact OG-NH2 3.45Å; S113-R117 WeakPolarHBondContact O-CB 3.34Å; S113-R117 PolarHBondContact O-N 3.3Å
114	D	85.7	Confident	83.5	Confident	35 Å²	35	55.8 Å²	55.8	19%	0.187	27%	0.273	C	S	.	.	H	α-helix	trans	-64.3	-49.2	176.6	-165.6	63.3	0	0	0	111.2	I110 L111 R116 R117 N118 T166	I110-D114 PolarHBondContact O-N 2.82Å; L111-D114 PolarHBondContact O-N 3.13Å; D114-R116 VanDerWaalsContact C-N 3.3Å; D114-R116 PolarHBondContact O-N 3.38Å; D114-R117 WeakPolarHBondContact O-CB 3.44Å; D114-R117 PolarHBondContact O-N 3.32Å; D114-R117 VanDerWaalsContact O-N 3.07Å; D114-N118 PolarHBondContact O-N 2.95Å; D114-N118 PolarHBondContact O-ND2 3.25Å; D114-N118 PolarHBondContact OD2-ND2 3.48Å; D114-T166 PolarHBondContact OD2-OG1 3.43Å
115	I	83.5	Confident	83.7	Confident	6 Å²	6	57.3 Å²	57.3	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-56.6	-45.2	176.7	-69.9	176.2	0	0	0	111	L39 L111 R117 N118 L119 F164	L39-I115 HydrophobicContact CD1-CD1 4.34Å; L39-I115 HydrophobicContact CD2-CB 4.44Å; L39-I115 HydrophobicContact CD2-CD1 3.57Å; L39-I115 HydrophobicContact CD2-CG2 3.85Å; L111-I115 HydrophobicContact CD1-CD1 3.7Å; L111-I115 HydrophobicContact CD1-CG1 4.17Å; L111-I115 HydrophobicContact CG-CD1 3.98Å; L111-I115 WeakPolarHBondContact O-CG1 3.37Å; L111-I115 PolarHBondContact O-N 3.5Å; I115-R117 PolarHBondContact O-N 3.21Å; I115-N118 PolarHBondContact O-N 2.67Å; I115-L119 WeakPolarHBondContact O-CB 3.47Å; I115-L119 PolarHBondContact O-N 3.33Å; I115-F164 HydrophobicContact CD1-CE1 4.42Å; I115-F164 HydrophobicContact CG2-CE1 4.45Å; I115-F164 HydrophobicContact CG2-CE2 3.74Å; I115-F164 HydrophobicContact CG2-CZ 3.65Å
116	R	87	Confident	83.8	Confident	128 Å²	128	61.2 Å²	61.2	48%	0.483	29%	0.29	S	S	.	.	H	α-helix	trans	-61.5	-43.4	177.1	179.4	-176.2	62.8	-167.6	-4.6	111.7	I112 S113 D114 L119 R120	I112-R116 VanDerWaalsContact O-CB 3.25Å; I112-R116 WeakPolarHBondContact O-CB 3.34Å; I112-R116 PolarHBondContact O-N 3.33Å; S113-R116 PolarHBondContact O-N 3.18Å; S113-R116 PolarHBondContact OG-NH2 3.45Å; D114-R116 VanDerWaalsContact C-N 3.3Å; D114-R116 PolarHBondContact O-N 3.38Å; R116-L119 PolarHBondContact O-N 3.37Å; R116-R120 WeakPolarHBondContact O-CG 3.49Å; R116-R120 PolarHBondContact O-N 3.11Å; R116-R120 VanDerWaalsContact O-N 3.12Å
117	R	86.2	Confident	83.9	Confident	108 Å²	108	59.2 Å²	59.2	41%	0.408	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-48.9	176.4	-175.1	179.6	-165.2	-178.7	9.3	110.5	S113 D114 I115 L119 R120 L121 E270	S113-R117 WeakPolarHBondContact O-CB 3.34Å; S113-R117 PolarHBondContact O-N 3.3Å; D114-R117 WeakPolarHBondContact O-CB 3.44Å; D114-R117 PolarHBondContact O-N 3.32Å; D114-R117 VanDerWaalsContact O-N 3.07Å; I115-R117 PolarHBondContact O-N 3.21Å; R117-L119 PolarHBondContact O-N 3.25Å; R117-R120 WeakPolarHBondContact O-CB 3.05Å; R117-R120 PolarHBondContact O-N 3.24Å; R117-L121 HydrophobicContact CG-CD1 4.38Å; R117-L121 WeakPolarHBondContact O-CG 3.18Å; R117-L121 PolarHBondContact O-N 2.8Å; R117-E270 IonicContact CZ-OE2 2.88Å; R117-E270 IonicContact NE-OE2 3.14Å; R117-E270 IonicContact NH2-OE2 3.51Å; R117-E270 PolarHBondContact NH2-OE2 3.21Å
118	N	83.8	Confident	83.8	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.043	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-40	179.7	-66.5	-44.1	0	0	0	112.2	D114 I115 R120 L121 R122 T166	D114-N118 PolarHBondContact O-N 2.95Å; D114-N118 PolarHBondContact O-ND2 3.25Å; D114-N118 PolarHBondContact OD2-ND2 3.48Å; I115-N118 PolarHBondContact O-N 2.67Å; N118-R120 VanDerWaalsContact C-N 3.32Å; N118-R120 PolarHBondContact O-N 2.89Å; N118-L121 PolarHBondContact O-N 2.78Å; N118-R122 WeakPolarHBondContact O-CB 3.15Å; N118-R122 VanDerWaalsContact O-CG 3.27Å; N118-R122 WeakPolarHBondContact O-CG 3.44Å; N118-R122 PolarHBondContact O-N 2.82Å; N118-T166 VanDerWaalsContact CG-CG2 3.47Å; N118-T166 WeakPolarHBondContact ND2-CG2 3.46Å; N118-T166 VanDerWaalsContact OD1-CG2 3.29Å; N118-T166 WeakPolarHBondContact OD1-CG2 3.5Å
119	L	84.8	Confident	83.5	Confident	44 Å²	44	60 Å²	60	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-60.4	-43	175.5	-175.7	66.2	0	0	0	111.6	L42 I115 R116 R117 R122 I123	L42-L119 HydrophobicContact CD1-CD2 4.14Å; L42-L119 HydrophobicContact CD2-CD1 4.36Å; L42-L119 HydrophobicContact CD2-CD2 3.92Å; I115-L119 WeakPolarHBondContact O-CB 3.47Å; I115-L119 PolarHBondContact O-N 3.33Å; R116-L119 PolarHBondContact O-N 3.37Å; R117-L119 PolarHBondContact O-N 3.25Å; L119-R122 PolarHBondContact O-N 3.05Å; L119-I123 HydrophobicContact CD1-CD1 4.48Å; L119-I123 HydrophobicContact CG-CD1 4.12Å; L119-I123 VanDerWaalsContact O-CG1 3.29Å; L119-I123 WeakPolarHBondContact O-CG1 3.19Å; L119-I123 PolarHBondContact O-N 3.45Å
120	R	86.7	Confident	83.3	Confident	142 Å²	142	61.3 Å²	61.3	54%	0.536	29%	0.287	S	S	.	.	H	α-helix	trans	-61	-45.1	174.7	-72.2	173.2	177.2	178.6	-2.7	111.5	R116 R117 N118 I123 A124	R116-R120 WeakPolarHBondContact O-CG 3.49Å; R116-R120 PolarHBondContact O-N 3.11Å; R116-R120 VanDerWaalsContact O-N 3.12Å; R117-R120 WeakPolarHBondContact O-CB 3.05Å; R117-R120 PolarHBondContact O-N 3.24Å; N118-R120 VanDerWaalsContact C-N 3.32Å; N118-R120 PolarHBondContact O-N 2.89Å; R120-I123 PolarHBondContact O-N 3Å; R120-A124 WeakPolarHBondContact O-CB 3.46Å; R120-A124 PolarHBondContact O-N 3.28Å
121	L	85.2	Confident	83	Confident	49 Å²	49	62.5 Å²	62.5	26%	0.257	29%	0.287	S	S	.	.	H	α-helix	trans	-62	-47.2	176.4	-66.1	172.3	0	0	0	110.7	R117 N118 I123 A124 F125 P162	R117-L121 HydrophobicContact CG-CD1 4.38Å; R117-L121 WeakPolarHBondContact O-CG 3.18Å; R117-L121 PolarHBondContact O-N 2.8Å; N118-L121 PolarHBondContact O-N 2.78Å; L121-I123 VanDerWaalsContact C-N 3.33Å; L121-I123 PolarHBondContact O-N 2.71Å; L121-A124 WeakPolarHBondContact O-CB 3.48Å; L121-A124 PolarHBondContact O-N 3.1Å; L121-A124 VanDerWaalsContact O-N 3.08Å; L121-F125 HydrophobicContact CB-CD2 4.46Å; L121-F125 VanDerWaalsContact O-CD2 3.24Å; L121-F125 WeakPolarHBondContact O-CD2 2.91Å; L121-F125 PolarHBondContact O-N 3.07Å; L121-P162 HydrophobicContact CB-CG 3.91Å
122	R	85.9	Confident	82.5	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.015	29%	0.291	C	S	.	.	H	α-helix	trans	-54.6	-46.6	176.4	-72.9	-174.7	163.5	-119.3	-10.3	112.2	C46 D50 N118 L119 F125 Y126 T161 P162	C46-R122 VanDerWaalsContact CB-NH1 3.27Å; C46-R122 PolarHBondContact O-NH1 2.85Å; C46-R122 VanDerWaalsContact O-NH1 3.14Å; D50-R122 IonicContact OD1-CZ 3.6Å; D50-R122 IonicContact OD1-NH1 3.94Å; D50-R122 PolarHBondContact OD1-NH1 3.35Å; D50-R122 IonicContact OD1-NH2 2.8Å; D50-R122 PolarHBondContact OD1-NH2 2.96Å; D50-R122 VanDerWaalsContact OD1-NH2 3.09Å; D50-R122 IonicContact OD2-CZ 3.17Å; D50-R122 IonicContact OD2-NH1 2.78Å; D50-R122 PolarHBondContact OD2-NH1 3.07Å; D50-R122 IonicContact OD2-NH2 3.82Å; D50-R122 PolarHBondContact OD2-NH2 3.48Å; N118-R122 WeakPolarHBondContact O-CB 3.15Å; N118-R122 VanDerWaalsContact O-CG 3.27Å; N118-R122 WeakPolarHBondContact O-CG 3.44Å; N118-R122 PolarHBondContact O-N 2.82Å; L119-R122 PolarHBondContact O-N 3.05Å; R122-F125 PolarHBondContact O-N 2.88Å; R122-Y126 VanDerWaalsContact O-CB 3.31Å; R122-Y126 WeakPolarHBondContact O-CB 3.43Å; R122-Y126 PolarHBondContact O-N 3.22Å; R122-T161 HydrophobicContact CB-CG2 4.06Å; R122-T161 HydrophobicContact CG-CG2 3.62Å; R122-P162 PolarHBondContact NE-O 2.93Å; R122-P162 PolarHBondContact NH2-O 3.31Å
123	I	82.9	Confident	82	Confident	105 Å²	105	63.5 Å²	63.5	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-62.1	-44	176.5	-67.3	164.9	0	0	0	110.8	L119 R120 L121 Y126 H127	L119-I123 HydrophobicContact CD1-CD1 4.48Å; L119-I123 HydrophobicContact CG-CD1 4.12Å; L119-I123 VanDerWaalsContact O-CG1 3.29Å; L119-I123 WeakPolarHBondContact O-CG1 3.19Å; L119-I123 PolarHBondContact O-N 3.45Å; R120-I123 PolarHBondContact O-N 3Å; L121-I123 VanDerWaalsContact C-N 3.33Å; L121-I123 PolarHBondContact O-N 2.71Å; I123-Y126 PolarHBondContact O-N 2.94Å; I123-H127 WeakPolarHBondContact O-CB 3.46Å; I123-H127 PolarHBondContact O-N 2.88Å
124	A	82	Confident	81.4	Confident	43 Å²	43	65.1 Å²	65.1	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-61.6	-47.8	177.1	0	0	0	0	0	111.7	R120 L121 Y126 H127 I128	R120-A124 WeakPolarHBondContact O-CB 3.46Å; R120-A124 PolarHBondContact O-N 3.28Å; L121-A124 WeakPolarHBondContact O-CB 3.48Å; L121-A124 PolarHBondContact O-N 3.1Å; L121-A124 VanDerWaalsContact O-N 3.08Å; A124-Y126 VanDerWaalsContact C-N 3.34Å; A124-Y126 PolarHBondContact O-N 3.26Å; A124-H127 WeakPolarHBondContact O-CB 3.49Å; A124-H127 PolarHBondContact O-N 2.81Å; A124-I128 WeakPolarHBondContact O-CD1 3.38Å; A124-I128 VanDerWaalsContact O-CG1 3.23Å; A124-I128 WeakPolarHBondContact O-CG1 3.4Å; A124-I128 PolarHBondContact O-N 2.99Å
125	F	82.9	Confident	80.7	Confident	40 Å²	40	65 Å²	65	18%	0.175	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-41.2	176	-87.8	-82.3	0	0	0	112	L121 R122 I128 K129 P159 P162	L121-F125 HydrophobicContact CB-CD2 4.46Å; L121-F125 VanDerWaalsContact O-CD2 3.24Å; L121-F125 WeakPolarHBondContact O-CD2 2.91Å; L121-F125 PolarHBondContact O-N 3.07Å; R122-F125 PolarHBondContact O-N 2.88Å; F125-I128 PolarHBondContact O-N 2.67Å; F125-K129 WeakPolarHBondContact O-CB 3.15Å; F125-K129 WeakPolarHBondContact O-CG 3.41Å; F125-K129 PolarHBondContact O-N 2.95Å; F125-P159 HydrophobicContact CE1-CB 3.69Å; F125-P159 HydrophobicContact CE1-CG 3.78Å; F125-P159 HydrophobicContact CZ-CB 4.2Å; F125-P159 HydrophobicContact CZ-CG 4.31Å; F125-P162 HydrophobicContact CD2-CG 3.82Å; F125-P162 HydrophobicContact CE2-CG 3.86Å
126	Y	80.5	Confident	80.1	Confident	112 Å²	112	71.3 Å²	71.3	44%	0.439	33%	0.332	S	S	.	.	H	α-helix	trans	-61.7	-45.1	174.9	-177.9	-102.5	0	0	0	111.7	R122 I123 A124 I128 K129 Q130	R122-Y126 VanDerWaalsContact O-CB 3.31Å; R122-Y126 WeakPolarHBondContact O-CB 3.43Å; R122-Y126 PolarHBondContact O-N 3.22Å; I123-Y126 PolarHBondContact O-N 2.94Å; A124-Y126 VanDerWaalsContact C-N 3.34Å; A124-Y126 PolarHBondContact O-N 3.26Å; Y126-I128 PolarHBondContact O-N 2.88Å; Y126-K129 WeakPolarHBondContact O-CB 3.09Å; Y126-K129 PolarHBondContact O-N 3.14Å; Y126-Q130 HydrophobicContact CD1-CG 4.27Å; Y126-Q130 HydrophobicContact CE1-CG 3.93Å; Y126-Q130 HydrophobicContact CE2-CG 4.46Å; Y126-Q130 WeakPolarHBondContact O-CG 3.31Å; Y126-Q130 PolarHBondContact O-N 3.42Å; Y126-Q130 PolarHBondContact OH-NE2 3.26Å
127	H	81	Confident	79.4	Confident	121 Å²	121	71.5 Å²	71.5	56%	0.56	34%	0.341	S	S	*	.	H	α-helix	trans	-62.1	-42.1	176.1	-174.7	-95.2	0	0	0	112	I123 A124 Q130 R131	I123-H127 WeakPolarHBondContact O-CB 3.46Å; I123-H127 PolarHBondContact O-N 2.88Å; A124-H127 WeakPolarHBondContact O-CB 3.49Å; A124-H127 PolarHBondContact O-N 2.81Å; H127-Q130 PolarHBondContact O-N 3.31Å; H127-R131 WeakPolarHBondContact O-CB 3.47Å; H127-R131 PolarHBondContact O-N 3.47Å
128	I	79	Confident	78.5	Confident	24 Å²	24	73.8 Å²	73.8	12%	0.123	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-46.5	174.3	-68.3	158.1	0	0	0	110.5	A124 F125 Y126 Q130 R131 K132 A152 L153 L158	A124-I128 WeakPolarHBondContact O-CD1 3.38Å; A124-I128 VanDerWaalsContact O-CG1 3.23Å; A124-I128 WeakPolarHBondContact O-CG1 3.4Å; A124-I128 PolarHBondContact O-N 2.99Å; F125-I128 PolarHBondContact O-N 2.67Å; Y126-I128 PolarHBondContact O-N 2.88Å; I128-Q130 PolarHBondContact O-N 3.3Å; I128-R131 PolarHBondContact O-N 2.89Å; I128-K132 WeakPolarHBondContact O-CB 3.46Å; I128-K132 PolarHBondContact O-N 3.07Å; I128-A152 HydrophobicContact CD1-CB 3.59Å; I128-A152 HydrophobicContact CG1-CB 4.26Å; I128-A152 HydrophobicContact CG2-CB 3.83Å; I128-L153 HydrophobicContact CB-CD2 4.29Å; I128-L153 HydrophobicContact CG2-CD2 3.57Å; I128-L153 HydrophobicContact CG2-CG 4.01Å; I128-L153 WeakPolarHBondContact O-CD2 3.38Å; I128-L158 HydrophobicContact CG2-CD1 3.65Å; I128-L158 HydrophobicContact CG2-CD2 3.98Å
129	K	77.7	Confident	77.6	Confident	52 Å²	52	78 Å²	78	23%	0.226	38%	0.379	C	S	.	.	H	α-helix	trans	-58.1	-48.1	175.7	-76.1	178.6	-173.1	-178.3	0	112	E53 F125 Y126 K132 A133 L158 T161	E53-K129 IonicContact OE1-NZ 3.44Å; E53-K129 PolarHBondContact OE1-NZ 2.85Å; E53-K129 IonicContact OE2-NZ 3.7Å; E53-K129 PolarHBondContact OE2-NZ 3.42Å; F125-K129 WeakPolarHBondContact O-CB 3.15Å; F125-K129 WeakPolarHBondContact O-CG 3.41Å; F125-K129 PolarHBondContact O-N 2.95Å; Y126-K129 WeakPolarHBondContact O-CB 3.09Å; Y126-K129 PolarHBondContact O-N 3.14Å; K129-K132 PolarHBondContact O-N 3.13Å; K129-A133 WeakPolarHBondContact O-CB 3.5Å; K129-A133 PolarHBondContact O-N 2.97Å; K129-L158 HydrophobicContact CB-CD2 4.23Å; K129-L158 HydrophobicContact CD-CD2 4.1Å; K129-L158 HydrophobicContact CG-CD2 3.14Å; K129-T161 PolarHBondContact NZ-OG1 2.67Å
130	Q	77.7	Confident	76.2	Confident	85 Å²	85	85.7 Å²	85.7	40%	0.397	41%	0.411	S	S	.	.	H	α-helix	trans	-61	-45.6	178.1	-76.1	-168.4	-25.7	0	0	111.3	Y126 H127 I128 K132 A133 I134	Y126-Q130 HydrophobicContact CD1-CG 4.27Å; Y126-Q130 HydrophobicContact CE1-CG 3.93Å; Y126-Q130 HydrophobicContact CE2-CG 4.46Å; Y126-Q130 WeakPolarHBondContact O-CG 3.31Å; Y126-Q130 PolarHBondContact O-N 3.42Å; Y126-Q130 PolarHBondContact OH-NE2 3.26Å; H127-Q130 PolarHBondContact O-N 3.31Å; I128-Q130 PolarHBondContact O-N 3.3Å; Q130-K132 PolarHBondContact O-N 3.01Å; Q130-A133 PolarHBondContact O-N 3.15Å; Q130-I134 VanDerWaalsContact O-CG1 3.3Å; Q130-I134 WeakPolarHBondContact O-CG1 3.29Å; Q130-I134 PolarHBondContact O-N 3.4Å
131	R	75.4	Confident	74.7	Confident	104 Å²	104	83.1 Å²	83.1	39%	0.392	41%	0.414	S	S	.	.	H	α-helix	trans	-63.2	-44.3	179.9	-176	62.1	-172.4	-154.4	-1	111.6	H127 I128 A133 I134 D135 L153	H127-R131 WeakPolarHBondContact O-CB 3.47Å; H127-R131 PolarHBondContact O-N 3.47Å; I128-R131 PolarHBondContact O-N 2.89Å; R131-A133 VanDerWaalsContact C-N 3.32Å; R131-A133 PolarHBondContact O-N 3.4Å; R131-I134 PolarHBondContact O-N 3.4Å; R131-I134 VanDerWaalsContact O-N 3.17Å; R131-D135 IonicContact CZ-OD1 3.59Å; R131-D135 IonicContact NE-OD1 2.8Å; R131-D135 PolarHBondContact NE-OD1 3.49Å; R131-D135 IonicContact NE-OD2 3.71Å; R131-D135 IonicContact NH2-OD1 3.32Å; R131-D135 VanDerWaalsContact O-CG 3.27Å; R131-D135 PolarHBondContact O-N 3.04Å; R131-L153 HydrophobicContact CB-CD1 4.28Å; R131-L153 HydrophobicContact CB-CD2 4.04Å; R131-L153 HydrophobicContact CG-CD1 3.76Å; R131-L153 HydrophobicContact CG-CD2 4.27Å
132	K	73.9	Confident	73.1	Confident	25 Å²	25	84.1 Å²	84.1	11%	0.109	42%	0.423	C	S	.	.	H	α-helix	trans	-59.9	-40.3	174.5	-168.5	168.4	-177	135.7	0	112.7	I128 K129 Q130 D135 M136 L153 L155 N156	I128-K132 WeakPolarHBondContact O-CB 3.46Å; I128-K132 PolarHBondContact O-N 3.07Å; K129-K132 PolarHBondContact O-N 3.13Å; Q130-K132 PolarHBondContact O-N 3.01Å; K132-D135 PolarHBondContact O-N 2.93Å; K132-M136 WeakPolarHBondContact O-CG 3.31Å; K132-M136 PolarHBondContact O-N 3.3Å; K132-L153 HydrophobicContact CB-CD2 3.76Å; K132-L153 PolarHBondContact NZ-O 3.25Å; K132-L155 PolarHBondContact NZ-O 3.2Å; K132-N156 WeakPolarHBondContact CE-OD1 3.4Å; K132-N156 PolarHBondContact NZ-ND2 3.12Å; K132-N156 PolarHBondContact NZ-OD1 3.19Å
133	A	74.3	Confident	71.4	Confident	45 Å²	45	87.6 Å²	87.6	37%	0.372	46%	0.46	S	S	.	.	H	α-helix	trans	-65.4	-39	175.8	0	0	0	0	0	112.2	K129 Q130 R131 L137	K129-A133 WeakPolarHBondContact O-CB 3.5Å; K129-A133 PolarHBondContact O-N 2.97Å; Q130-A133 PolarHBondContact O-N 3.15Å; R131-A133 VanDerWaalsContact C-N 3.32Å; R131-A133 PolarHBondContact O-N 3.4Å; A133-L137 WeakPolarHBondContact O-CG 3.37Å; A133-L137 PolarHBondContact O-N 3.48Å; A133-L137 VanDerWaalsContact O-N 3.16Å
134	I	74	Confident	69.6	Low	87 Å²	87	88.6 Å²	88.6	45%	0.446	47%	0.47	S	S	.	.	H	α-helix	trans	-66.7	-45.9	175.1	-67.2	164.4	0	0	0	110.8	Q130 R131 M136 L137 Y138	Q130-I134 VanDerWaalsContact O-CG1 3.3Å; Q130-I134 WeakPolarHBondContact O-CG1 3.29Å; Q130-I134 PolarHBondContact O-N 3.4Å; R131-I134 PolarHBondContact O-N 3.4Å; R131-I134 VanDerWaalsContact O-N 3.17Å; I134-M136 VanDerWaalsContact C-N 3.26Å; I134-M136 PolarHBondContact O-N 2.97Å; I134-L137 PolarHBondContact O-N 3.46Å; I134-L137 VanDerWaalsContact O-N 3.07Å; I134-Y138 PolarHBondContact O-N 2.94Å
135	D	70.7	Confident	67.9	Low	32 Å²	32	90.9 Å²	90.9	17%	0.171	48%	0.48	C	S	.	.	H	α-helix	trans	-63.3	-33.7	179.5	-67.1	-22.8	0	0	0	111.2	R131 K132 Y138 P139	R131-D135 IonicContact CZ-OD1 3.59Å; R131-D135 IonicContact NE-OD1 2.8Å; R131-D135 PolarHBondContact NE-OD1 3.49Å; R131-D135 IonicContact NE-OD2 3.71Å; R131-D135 IonicContact NH2-OD1 3.32Å; R131-D135 VanDerWaalsContact O-CG 3.27Å; R131-D135 PolarHBondContact O-N 3.04Å; K132-D135 PolarHBondContact O-N 2.93Å; D135-Y138 CarbonylContact O-C 3.57Å; D135-P139 WeakPolarHBondContact O-CA 3.31Å
136	M	69.7	Low	66.2	Low	140 Å²	140	94.2 Å²	94.2	69%	0.69	51%	0.508	S	S	*	.	H	α-helix	trans	-69.2	-33.7	171.7	-76.3	-163.9	-67.8	0	0	113.8	K132 I134	K132-M136 WeakPolarHBondContact O-CG 3.31Å; K132-M136 PolarHBondContact O-N 3.3Å; I134-M136 VanDerWaalsContact C-N 3.26Å; I134-M136 PolarHBondContact O-N 2.97Å
137	L	72.8	Confident	64.8	Low	131 Å²	131	96 Å²	96	69%	0.686	53%	0.525	S	S	*	.	H	α-helix	trans	-77.2	-32.5	178.3	-74.2	169.3	0	0	0	112.5	A133 I134 P139	A133-L137 WeakPolarHBondContact O-CG 3.37Å; A133-L137 PolarHBondContact O-N 3.48Å; A133-L137 VanDerWaalsContact O-N 3.16Å; I134-L137 PolarHBondContact O-N 3.46Å; I134-L137 VanDerWaalsContact O-N 3.07Å; L137-P139 VanDerWaalsContact C-CD 3.45Å; L137-P139 WeakPolarHBondContact O-CD 3.44Å
138	Y	67.6	Low	63.5	Low	156 Å²	156	98.2 Å²	98.2	61%	0.612	54%	0.536	S	S	*	.			trans	-129	65.2	-176.4	-62.2	-83.1	0	0	0	111.8	I134 D135 K140 S141	I134-Y138 PolarHBondContact O-N 2.94Å; D135-Y138 CarbonylContact O-C 3.57Å; Y138-K140 PolarHBondContact O-N 3.32Å; Y138-S141 WeakPolarHBondContact CB-OG 3.4Å; Y138-S141 PolarHBondContact O-OG 2.88Å
139	P	64	Low	62.4	Low	96 Å²	96	100.6 Å²	100.6	62%	0.623	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-13	-173.9	26	-35	0	0	0	114	D135 L137	D135-P139 WeakPolarHBondContact O-CA 3.31Å; L137-P139 VanDerWaalsContact C-CD 3.45Å; L137-P139 WeakPolarHBondContact O-CD 3.44Å
140	K	56.5	Low	61.4	Low	207 Å²	207	101.6 Å²	101.6	90%	0.9	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	3.8	-171.3	-78.1	-178.6	175.9	176.8	0	115.4	Y138	Y138-K140 PolarHBondContact O-N 3.32Å
141	S	54.1	Low	60.6	Low	87 Å²	87	99.4 Å²	99.4	61%	0.608	55%	0.551	S	S	*	*	S	Bend	trans	-114.3	-2.1	-175.8	34.5	0	0	0	0	115.3	Y138 G143	Y138-S141 WeakPolarHBondContact CB-OG 3.4Å; Y138-S141 PolarHBondContact O-OG 2.88Å; S141-G143 VanDerWaalsContact C-N 3.33Å; S141-G143 PolarHBondContact O-N 2.7Å
142	T	53	Low	59.6	Low	71 Å²	71	95.4 Å²	95.4	44%	0.436	54%	0.54	S	S	.	.			trans	-96.8	53.4	172.7	47.4	0	0	0	0	110.9	V144	T142-V144 PolarHBondContact O-N 2.97Å
143	G	49.8	Very low	58.9	Low	77 Å²	77	95 Å²	95	79%	0.794	54%	0.539	S	S	*	.			trans	-77.6	16.5	173.1	0	0	0	0	0	114.3	S141	S141-G143 VanDerWaalsContact C-N 3.33Å; S141-G143 PolarHBondContact O-N 2.7Å
144	V	45.5	Very low	58.1	Low	125 Å²	125	99.2 Å²	99.2	76%	0.758	55%	0.553	S	S	*	*	S	Bend	trans	-133.8	103.9	-173.2	-176.5	0	0	0	0	108.5	T142	T142-V144 PolarHBondContact O-N 2.97Å
145	V	45	Very low	57.6	Low	92 Å²	92	99 Å²	99	56%	0.558	55%	0.552	S	S	*	*			trans	72.6	83	166.2	-167.3	0	0	0	0	115.8	D147 Q148	V145-D147 HydrophobicContact CG1-CB 4.1Å; V145-D147 PolarHBondContact O-N 2.99Å; V145-Q148 HydrophobicContact CG1-CG 4.31Å
146	S	48.3	Very low	57.2	Low	109 Å²	109	103.7 Å²	103.7	76%	0.762	58%	0.577	S	S	*	*	G	3₁₀ helix	trans	-68.1	-7.3	165	-168.7	0	0	0	0	113.5	Q148	S146-Q148 PolarHBondContact O-N 3.12Å
147	D	50.7	Low	57	Low	151 Å²	151	102.7 Å²	102.7	81%	0.807	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-87.5	2.7	-171.9	-67.5	-20.2	0	0	0	114.7	V145	V145-D147 HydrophobicContact CG1-CB 4.1Å; V145-D147 PolarHBondContact O-N 2.99Å
148	Q	53.7	Low	56.8	Low	166 Å²	166	98 Å²	98	78%	0.776	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-131.3	12.3	179.5	-69.4	-172.1	3.8	0	0	114	V145 S146 P150	V145-Q148 HydrophobicContact CG1-CG 4.31Å; S146-Q148 PolarHBondContact O-N 3.12Å; Q148-P150 WeakPolarHBondContact O-CD 3.24Å
149	L	55.3	Low	56.9	Low	74 Å²	74	92.7 Å²	92.7	39%	0.387	54%	0.541	S	S	.	.			trans	-70	113.7	176.7	-155.4	74.7	0	0	0	108	L151 L153	L149-L151 PolarHBondContact O-N 3.3Å; L149-L153 HydrophobicContact CD1-CB 4.43Å; L149-L153 HydrophobicContact CD1-CD1 3.31Å; L149-L153 HydrophobicContact CD1-CG 4.44Å; L149-L153 HydrophobicContact CD2-CB 3.84Å; L149-L153 HydrophobicContact CD2-CD1 4.3Å; L149-L153 HydrophobicContact CG-CB 3.8Å; L149-L153 HydrophobicContact CG-CD1 3.53Å; L149-L153 HydrophobicContact CG-CG 4.23Å
150	P	58.3	Low	57.4	Low	73 Å²	73	93 Å²	93	47%	0.474	54%	0.543	S	S	.	.			trans	-55.7	132.5	179.5	-24.3	34.5	0	0	0	109	Q148 A152 L153	Q148-P150 WeakPolarHBondContact O-CD 3.24Å; P150-A152 PolarHBondContact O-N 2.74Å; P150-L153 WeakPolarHBondContact O-CB 3.47Å; P150-L153 PolarHBondContact O-N 3.29Å
151	L	60.2	Low	58.3	Low	39 Å²	39	83.9 Å²	83.9	20%	0.204	51%	0.505	C	S	.	.	G	3₁₀ helix	trans	-49.1	-28.3	-177.2	-106.1	91.5	0	0	0	114.2	L149 L153 M154 L155 E263	L149-L151 PolarHBondContact O-N 3.3Å; L151-L153 PolarHBondContact O-N 3.13Å; L151-L153 VanDerWaalsContact O-N 3.16Å; L151-M154 WeakPolarHBondContact O-CA 3.3Å; L151-M154 WeakPolarHBondContact O-CB 3.32Å; L151-M154 PolarHBondContact O-N 2.75Å; L151-L155 PolarHBondContact O-N 2.97Å; L151-E263 WeakPolarHBondContact CD1-OE1 3.43Å; L151-E263 WeakPolarHBondContact CD1-OE2 3.39Å; L151-E263 WeakPolarHBondContact CD2-OE2 3.07Å
152	A	55.2	Low	59.5	Low	21 Å²	21	81 Å²	81	17%	0.174	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-52.9	-33.2	173.2	0	0	0	0	0	112.7	I128 P150 M154 L155 L158	I128-A152 HydrophobicContact CD1-CB 3.59Å; I128-A152 HydrophobicContact CG1-CB 4.26Å; I128-A152 HydrophobicContact CG2-CB 3.83Å; P150-A152 PolarHBondContact O-N 2.74Å; A152-M154 VanDerWaalsContact C-N 3.3Å; A152-M154 PolarHBondContact O-N 3.16Å; A152-L155 PolarHBondContact O-N 2.98Å; A152-L158 HydrophobicContact CB-CD1 4.38Å; A152-L158 WeakPolarHBondContact O-CD1 3.39Å
153	L	57.4	Low	60.5	Low	15 Å²	15	79.8 Å²	79.8	8%	0.079	48%	0.482	C	S	.	.	G	3₁₀ helix	trans	-68.1	-27.9	173.5	-69.2	177.1	0	0	0	113	I128 R131 K132 L149 P150 L151	I128-L153 HydrophobicContact CB-CD2 4.29Å; I128-L153 HydrophobicContact CG2-CD2 3.57Å; I128-L153 HydrophobicContact CG2-CG 4.01Å; I128-L153 WeakPolarHBondContact O-CD2 3.38Å; R131-L153 HydrophobicContact CB-CD1 4.28Å; R131-L153 HydrophobicContact CB-CD2 4.04Å; R131-L153 HydrophobicContact CG-CD1 3.76Å; R131-L153 HydrophobicContact CG-CD2 4.27Å; K132-L153 HydrophobicContact CB-CD2 3.76Å; K132-L153 PolarHBondContact NZ-O 3.25Å; L149-L153 HydrophobicContact CD1-CB 4.43Å; L149-L153 HydrophobicContact CD1-CD1 3.31Å; L149-L153 HydrophobicContact CD1-CG 4.44Å; L149-L153 HydrophobicContact CD2-CB 3.84Å; L149-L153 HydrophobicContact CD2-CD1 4.3Å; L149-L153 HydrophobicContact CG-CB 3.8Å; L149-L153 HydrophobicContact CG-CD1 3.53Å; L149-L153 HydrophobicContact CG-CG 4.23Å; P150-L153 WeakPolarHBondContact O-CB 3.47Å; P150-L153 PolarHBondContact O-N 3.29Å; L151-L153 PolarHBondContact O-N 3.13Å; L151-L153 VanDerWaalsContact O-N 3.16Å
154	M	59.1	Low	61.7	Low	135 Å²	135	76.8 Å²	76.8	67%	0.665	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-27.3	177.5	-58.2	-162.4	73.3	0	0	113.1	L151 A152 N156	L151-M154 WeakPolarHBondContact O-CA 3.3Å; L151-M154 WeakPolarHBondContact O-CB 3.32Å; L151-M154 PolarHBondContact O-N 2.75Å; A152-M154 VanDerWaalsContact C-N 3.3Å; A152-M154 PolarHBondContact O-N 3.16Å; M154-N156 PolarHBondContact O-N 3.17Å
155	L	62.1	Low	63.1	Low	83 Å²	83	71.3 Å²	71.3	44%	0.435	41%	0.413	S	S	.	.			trans	-68.3	122.2	-179.4	-68.7	172.4	0	0	0	112.1	K132 L151 A152 P157 L158 P159	K132-L155 PolarHBondContact NZ-O 3.2Å; L151-L155 PolarHBondContact O-N 2.97Å; A152-L155 PolarHBondContact O-N 2.98Å; L155-P157 CarbonylContact O-C 3.49Å; L155-L158 PolarHBondContact O-N 3.36Å; L155-P159 HydrophobicContact CD1-CG 4.25Å
156	N	62.8	Low	64.4	Low	130 Å²	130	68 Å²	68	70%	0.695	39%	0.393	S	S	*	.	S	Bend	trans	-124.1	121.7	169.1	-80.4	-49.6	0	0	0	109.2	K132 M154	K132-N156 WeakPolarHBondContact CE-OD1 3.4Å; K132-N156 PolarHBondContact NZ-ND2 3.12Å; K132-N156 PolarHBondContact NZ-OD1 3.19Å; M154-N156 PolarHBondContact O-N 3.17Å
157	P	66	Low	65.4	Low	119 Å²	119	67 Å²	67	77%	0.773	38%	0.384	S	S	*	.	S	Bend	cis	-67.3	152.6	-8.2	30.6	-34.5	0	0	0	111.4	L155	L155-P157 CarbonylContact O-C 3.49Å
158	L	67.7	Low	66.3	Low	31 Å²	31	62 Å²	62	16%	0.162	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-64.2	143.5	170.9	-171.3	71.6	0	0	0	109.2	I128 K129 A152 L155	I128-L158 HydrophobicContact CG2-CD1 3.65Å; I128-L158 HydrophobicContact CG2-CD2 3.98Å; K129-L158 HydrophobicContact CB-CD2 4.23Å; K129-L158 HydrophobicContact CD-CD2 4.1Å; K129-L158 HydrophobicContact CG-CD2 3.14Å; A152-L158 HydrophobicContact CB-CD1 4.38Å; A152-L158 WeakPolarHBondContact O-CD1 3.39Å; L155-L158 PolarHBondContact O-N 3.36Å
159	P	70.3	Confident	67.3	Low	45 Å²	45	54.3 Å²	54.3	29%	0.292	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-55.8	150.5	177.5	-19.4	27.4	0	0	0	111.7	F125 L155	F125-P159 HydrophobicContact CE1-CB 3.69Å; F125-P159 HydrophobicContact CE1-CG 3.78Å; F125-P159 HydrophobicContact CZ-CB 4.2Å; F125-P159 HydrophobicContact CZ-CG 4.31Å; L155-P159 HydrophobicContact CD1-CG 4.25Å
160	P	73.7	Confident	68.2	Low	102 Å²	102	52.3 Å²	52.3	66%	0.662	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-59	147.5	172.7	26.6	-33.8	0	0	0	110.3
161	T	76.3	Confident	68.9	Low	16 Å²	16	53 Å²	53	10%	0.098	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-59.6	130.4	174.1	-67.4	0	0	0	0	108.8	E53 R122 K129	E53-T161 VanDerWaalsContact CD-OG1 3.26Å; E53-T161 PolarHBondContact OE1-OG1 2.81Å; E53-T161 WeakPolarHBondContact OE2-CB 3.32Å; E53-T161 PolarHBondContact OE2-OG1 2.67Å; E53-T161 VanDerWaalsContact OE2-OG1 3.04Å; R122-T161 HydrophobicContact CB-CG2 4.06Å; R122-T161 HydrophobicContact CG-CG2 3.62Å; K129-T161 PolarHBondContact NZ-OG1 2.67Å
162	P	78.9	Confident	69.4	Low	26 Å²	26	52.7 Å²	52.7	17%	0.169	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-54.4	145	-177.7	-29.1	36	0	0	0	112.4	L121 R122 F125	L121-P162 HydrophobicContact CB-CG 3.91Å; R122-P162 PolarHBondContact NE-O 2.93Å; R122-P162 PolarHBondContact NH2-O 3.31Å; F125-P162 HydrophobicContact CD2-CG 3.82Å; F125-P162 HydrophobicContact CE2-CG 3.86Å
163	A	75	Confident	70.3	Confident	47 Å²	47	52 Å²	52	39%	0.388	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-62.7	146.3	176.6	0	0	0	0	0	111.4	I165	A163-I165 VanDerWaalsContact CB-O 3.31Å; A163-I165 WeakPolarHBondContact CB-O 3.33Å
164	F	74.5	Confident	71	Confident	13 Å²	13	55 Å²	55	6%	0.057	33%	0.332	C	S	.	.	S	Bend	trans	-67.1	-41.5	176.5	-176.1	-106.1	0	0	0	111.2	L42 M43 C46 I115	L42-F164 HydrophobicContact CB-CE2 4.03Å; L42-F164 HydrophobicContact CB-CZ 3.99Å; M43-F164 HydrophobicContact CB-CD1 3.98Å; M43-F164 HydrophobicContact CB-CE1 3.51Å; M43-F164 HydrophobicContact CB-CZ 4.02Å; M43-F164 HydrophobicContact CG-CD1 3.79Å; M43-F164 HydrophobicContact CG-CE1 3.8Å; M43-F164 HydrophobicContact SD-CD1 4.48Å; M43-F164 HydrophobicContact SD-CE1 4.42Å; C46-F164 HydrophobicContact CB-CB 4.08Å; C46-F164 HydrophobicContact CB-CD2 3.76Å; C46-F164 HydrophobicContact CB-CE2 4.44Å; C46-F164 HydrophobicContact CB-CG 4.02Å; C46-F164 WeakPolarHBondContact SG-CD2 3.26Å; I115-F164 HydrophobicContact CD1-CE1 4.42Å; I115-F164 HydrophobicContact CG2-CE1 4.45Å; I115-F164 HydrophobicContact CG2-CE2 3.74Å; I115-F164 HydrophobicContact CG2-CZ 3.65Å
165	I	73.9	Confident	71.5	Confident	10 Å²	10	54.4 Å²	54.4	5%	0.051	33%	0.328	C	S	.	.	S	Bend	trans	-103.7	113.7	168.9	-61.8	176.5	0	0	0	106.8	A163 L169 L170 L190 M194	A163-I165 VanDerWaalsContact CB-O 3.31Å; A163-I165 WeakPolarHBondContact CB-O 3.33Å; I165-L169 HydrophobicContact CB-CD2 4.42Å; I165-L169 HydrophobicContact CG2-CD2 3.88Å; I165-L169 HydrophobicContact CG2-CG 4.42Å; I165-L170 HydrophobicContact CG2-CD2 3.97Å; I165-L170 HydrophobicContact CG2-CG 3.98Å; I165-L190 HydrophobicContact CD1-CD1 4.29Å; I165-M194 HydrophobicContact CB-CE 3.9Å; I165-M194 HydrophobicContact CB-SD 4.28Å; I165-M194 HydrophobicContact CD1-SD 4Å; I165-M194 HydrophobicContact CG2-CE 4.11Å; I165-M194 HydrophobicContact CG2-SD 4.15Å
166	T	73	Confident	71.8	Confident	22 Å²	22	50.9 Å²	50.9	14%	0.135	31%	0.31	C	S	.	.			trans	-76.8	155.3	180	58.6	0	0	0	0	111.7	D114 N118 G168 L169 L170	D114-T166 PolarHBondContact OD2-OG1 3.43Å; N118-T166 VanDerWaalsContact CG-CG2 3.47Å; N118-T166 WeakPolarHBondContact ND2-CG2 3.46Å; N118-T166 VanDerWaalsContact OD1-CG2 3.29Å; N118-T166 WeakPolarHBondContact OD1-CG2 3.5Å; T166-G168 PolarHBondContact O-N 3.19Å; T166-L169 WeakPolarHBondContact O-CB 3.41Å; T166-L169 PolarHBondContact O-N 2.86Å; T166-L169 VanDerWaalsContact O-N 3.12Å; T166-L169 VanDerWaalsContact OG1-CB 3.31Å; T166-L169 WeakPolarHBondContact OG1-CB 3.31Å; T166-L169 PolarHBondContact OG1-N 3.22Å; T166-L170 PolarHBondContact O-N 3.48Å
167	P	69.4	Low	72.1	Confident	90 Å²	90	48.7 Å²	48.7	58%	0.584	30%	0.296	S	S	*	.	H	α-helix	trans	-55.6	-35.6	165.6	-24.9	34.5	0	0	0	112.3	L169 L170 I171	P167-L169 VanDerWaalsContact C-N 3.32Å; P167-L169 PolarHBondContact O-N 3.21Å; P167-L170 WeakPolarHBondContact O-CB 3.5Å; P167-L170 PolarHBondContact O-N 2.81Å; P167-I171 VanDerWaalsContact O-CG1 3.25Å; P167-I171 WeakPolarHBondContact O-CG1 3.24Å; P167-I171 PolarHBondContact O-N 2.99Å
168	G	70.1	Confident	71.9	Confident	45 Å²	45	49.4 Å²	49.4	46%	0.464	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-40.3	175.5	0	0	0	0	0	112.4	T166 I171 A172	T166-G168 PolarHBondContact O-N 3.19Å; G168-I171 PolarHBondContact O-N 3.49Å; G168-A172 WeakPolarHBondContact O-CB 3.03Å; G168-A172 PolarHBondContact O-N 2.81Å
169	L	74.3	Confident	71.7	Confident	5 Å²	5	55.3 Å²	55.3	3%	0.026	32%	0.321	C	S	.	.	H	α-helix	trans	-66.1	-43.1	173	-179.2	62	0	0	0	111.9	L111 I165 T166 P167 I171 A172 L173	L111-L169 HydrophobicContact CB-CD1 4.11Å; L111-L169 HydrophobicContact CD1-CD1 3.48Å; L111-L169 VanDerWaalsContact CD1-CD1 3.48Å; L111-L169 HydrophobicContact CD1-CD2 3.23Å; L111-L169 HydrophobicContact CD1-CG 3.8Å; L111-L169 HydrophobicContact CG-CD1 4.42Å; I165-L169 HydrophobicContact CB-CD2 4.42Å; I165-L169 HydrophobicContact CG2-CD2 3.88Å; I165-L169 HydrophobicContact CG2-CG 4.42Å; T166-L169 WeakPolarHBondContact O-CB 3.41Å; T166-L169 PolarHBondContact O-N 2.86Å; T166-L169 VanDerWaalsContact O-N 3.12Å; T166-L169 VanDerWaalsContact OG1-CB 3.31Å; T166-L169 WeakPolarHBondContact OG1-CB 3.31Å; T166-L169 PolarHBondContact OG1-N 3.22Å; P167-L169 VanDerWaalsContact C-N 3.32Å; P167-L169 PolarHBondContact O-N 3.21Å; L169-I171 VanDerWaalsContact C-N 3.28Å; L169-I171 PolarHBondContact O-N 2.96Å; L169-A172 PolarHBondContact O-N 3.31Å; L169-A172 VanDerWaalsContact O-N 3.16Å; L169-L173 HydrophobicContact CD1-CG 4.38Å; L169-L173 HydrophobicContact CG-CD1 4.12Å; L169-L173 HydrophobicContact CG-CG 4.45Å; L169-L173 WeakPolarHBondContact O-CB 3.4Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3.39Å
170	L	74.1	Confident	71.7	Confident	31 Å²	31	55.1 Å²	55.1	16%	0.162	32%	0.316	C	S	.	.	H	α-helix	trans	-58.2	-42.5	173.5	-69	172.6	0	0	0	111.4	I165 T166 P167 L173 I174 L187 M194	I165-L170 HydrophobicContact CG2-CD2 3.97Å; I165-L170 HydrophobicContact CG2-CG 3.98Å; T166-L170 PolarHBondContact O-N 3.48Å; P167-L170 WeakPolarHBondContact O-CB 3.5Å; P167-L170 PolarHBondContact O-N 2.81Å; L170-L173 PolarHBondContact O-N 3.4Å; L170-I174 WeakPolarHBondContact O-CB 3.14Å; L170-I174 WeakPolarHBondContact O-CD1 3.31Å; L170-I174 WeakPolarHBondContact O-CG1 3.39Å; L170-I174 PolarHBondContact O-N 3.27Å; L170-L187 HydrophobicContact CD2-CD1 3.99Å; L170-M194 HydrophobicContact CD1-CE 4.49Å; L170-M194 HydrophobicContact CD2-SD 4.35Å
171	I	73.2	Confident	71.5	Confident	88 Å²	88	57.3 Å²	57.3	45%	0.451	32%	0.322	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.4	-67.3	163	0	0	0	110.7	P167 G168 L169 L173 I174 Q175	P167-I171 VanDerWaalsContact O-CG1 3.25Å; P167-I171 WeakPolarHBondContact O-CG1 3.24Å; P167-I171 PolarHBondContact O-N 2.99Å; G168-I171 PolarHBondContact O-N 3.49Å; L169-I171 VanDerWaalsContact C-N 3.28Å; L169-I171 PolarHBondContact O-N 2.96Å; I171-L173 VanDerWaalsContact C-N 3.29Å; I171-L173 PolarHBondContact O-N 3.09Å; I171-I174 WeakPolarHBondContact O-CB 3.3Å; I171-I174 PolarHBondContact O-N 2.69Å; I171-Q175 HydrophobicContact CG2-CG 4.39Å; I171-Q175 WeakPolarHBondContact O-CB 3.25Å; I171-Q175 VanDerWaalsContact O-CG 3.26Å; I171-Q175 WeakPolarHBondContact O-CG 2.88Å; I171-Q175 PolarHBondContact O-N 2.87Å
172	A	70.9	Confident	71.4	Confident	32 Å²	32	57.8 Å²	57.8	26%	0.264	33%	0.33	S	S	.	.	H	α-helix	trans	-62.3	-38.2	177.2	0	0	0	0	0	111.8	G168 L169 Q175 A176	G168-A172 WeakPolarHBondContact O-CB 3.03Å; G168-A172 PolarHBondContact O-N 2.81Å; L169-A172 PolarHBondContact O-N 3.31Å; L169-A172 VanDerWaalsContact O-N 3.16Å; A172-Q175 PolarHBondContact O-N 3.48Å; A172-A176 WeakPolarHBondContact O-CB 3.45Å; A172-A176 PolarHBondContact O-N 2.88Å
173	L	72.9	Confident	71.2	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-40.7	175.2	-65.9	168.8	0	0	0	111.7	L99 L103 L169 L170 I171 Q175 A176 H177 I183	L99-L173 HydrophobicContact CD1-CD2 4.13Å; L99-L173 HydrophobicContact CD2-CD1 3.5Å; L99-L173 HydrophobicContact CD2-CD2 3.84Å; L99-L173 HydrophobicContact CD2-CG 4.26Å; L99-L173 HydrophobicContact CG-CD2 4.25Å; L103-L173 HydrophobicContact CD1-CD2 4.33Å; L103-L173 HydrophobicContact CD2-CD2 3.63Å; L169-L173 HydrophobicContact CD1-CG 4.38Å; L169-L173 HydrophobicContact CG-CD1 4.12Å; L169-L173 HydrophobicContact CG-CG 4.45Å; L169-L173 WeakPolarHBondContact O-CB 3.4Å; L169-L173 WeakPolarHBondContact O-CG 3.37Å; L169-L173 PolarHBondContact O-N 3.39Å; L170-L173 PolarHBondContact O-N 3.4Å; I171-L173 VanDerWaalsContact C-N 3.29Å; I171-L173 PolarHBondContact O-N 3.09Å; L173-Q175 VanDerWaalsContact C-N 3.28Å; L173-Q175 PolarHBondContact O-N 3.35Å; L173-A176 PolarHBondContact O-N 2.87Å; L173-H177 PolarHBondContact O-N 3.28Å; L173-I183 WeakPolarHBondContact O-CG2 3.18Å
174	I	72.8	Confident	71.3	Confident	78 Å²	78	56.5 Å²	56.5	40%	0.4	32%	0.322	S	S	.	.	H	α-helix	trans	-60.7	-40.6	172.4	-70.5	161.5	0	0	0	110.5	L170 I171 H177 L187	L170-I174 WeakPolarHBondContact O-CB 3.14Å; L170-I174 WeakPolarHBondContact O-CD1 3.31Å; L170-I174 WeakPolarHBondContact O-CG1 3.39Å; L170-I174 PolarHBondContact O-N 3.27Å; I171-I174 WeakPolarHBondContact O-CB 3.3Å; I171-I174 PolarHBondContact O-N 2.69Å; I174-H177 WeakPolarHBondContact O-CB 3.47Å; I174-H177 PolarHBondContact O-N 3Å; I174-L187 HydrophobicContact CD1-CD2 4.14Å; I174-L187 HydrophobicContact CG1-CD2 3.34Å
175	Q	70.2	Confident	71.5	Confident	124 Å²	124	62 Å²	62	58%	0.579	35%	0.351	S	S	*	.	H	α-helix	trans	-69.2	-36.4	176.4	-72.8	174.7	-15.9	0	0	111.7	I171 A172 L173 H177 L178	I171-Q175 HydrophobicContact CG2-CG 4.39Å; I171-Q175 WeakPolarHBondContact O-CB 3.25Å; I171-Q175 VanDerWaalsContact O-CG 3.26Å; I171-Q175 WeakPolarHBondContact O-CG 2.88Å; I171-Q175 PolarHBondContact O-N 2.87Å; A172-Q175 PolarHBondContact O-N 3.48Å; L173-Q175 VanDerWaalsContact C-N 3.28Å; L173-Q175 PolarHBondContact O-N 3.35Å; Q175-H177 VanDerWaalsContact C-N 3.31Å; Q175-H177 PolarHBondContact O-N 2.93Å; Q175-L178 WeakPolarHBondContact O-CB 3.48Å; Q175-L178 PolarHBondContact O-N 3.33Å
176	A	67.9	Low	71.8	Confident	8 Å²	8	62 Å²	62	7%	0.066	35%	0.353	C	S	.	.	H	α-helix	trans	-67.1	-30.8	174.3	0	0	0	0	0	112.5	E107 A172 L173 L178 M179 E180 I183	E107-A176 HydrophobicContact CG-CB 3.88Å; A172-A176 WeakPolarHBondContact O-CB 3.45Å; A172-A176 PolarHBondContact O-N 2.88Å; L173-A176 PolarHBondContact O-N 2.87Å; A176-L178 PolarHBondContact O-N 2.95Å; A176-L178 VanDerWaalsContact O-N 3.14Å; A176-M179 PolarHBondContact O-N 3.3Å; A176-E180 PolarHBondContact O-N 2.9Å; A176-I183 HydrophobicContact CB-CD1 3.75Å
177	H	68.5	Low	72	Confident	85 Å²	85	62 Å²	62	39%	0.394	35%	0.352	S	S	.	.	H	α-helix	trans	-56	-29.2	173.8	142.6	55.4	0	0	0	112.6	L173 I174 Q175 M179 I183	L173-H177 PolarHBondContact O-N 3.28Å; I174-H177 WeakPolarHBondContact O-CB 3.47Å; I174-H177 PolarHBondContact O-N 3Å; Q175-H177 VanDerWaalsContact C-N 3.31Å; Q175-H177 PolarHBondContact O-N 2.93Å; H177-M179 PolarHBondContact O-N 3.48Å; H177-I183 HydrophobicContact CB-CB 4.05Å; H177-I183 HydrophobicContact CB-CG2 3.83Å
178	L	63.2	Low	72.4	Confident	133 Å²	133	59.7 Å²	59.7	70%	0.696	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.3	176	-63.8	175.1	0	0	0	113.3	Q175 A176	Q175-L178 WeakPolarHBondContact O-CB 3.48Å; Q175-L178 PolarHBondContact O-N 3.33Å; A176-L178 PolarHBondContact O-N 2.95Å; A176-L178 VanDerWaalsContact O-N 3.14Å
179	M	62.8	Low	73	Confident	155 Å²	155	60.4 Å²	60.4	76%	0.764	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-25.1	-174.4	-59.5	-90	67.3	0	0	113.7	A176 H177	A176-M179 PolarHBondContact O-N 3.3Å; H177-M179 PolarHBondContact O-N 3.48Å
180	E	69.5	Low	73.2	Confident	42 Å²	42	60.2 Å²	60.2	20%	0.196	34%	0.34	C	S	.	.	S	Bend	trans	-124.7	130.4	-172.1	-63.6	-68.4	167	0	0	112.7	A104 A176 I183	A104-E180 WeakPolarHBondContact CB-OE1 3.43Å; A176-E180 PolarHBondContact O-N 2.9Å; E180-I183 HydrophobicContact CB-CD1 3.57Å; E180-I183 HydrophobicContact CB-CG1 4Å; E180-I183 HydrophobicContact CG-CD1 4.21Å
181	D	69.5	Low	73.3	Confident	148 Å²	148	62.3 Å²	62.3	79%	0.791	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	138.4	178.4	-65.4	-38.3	0	0	0	111.6	I183	D181-I183 PolarHBondContact O-N 3.14Å
182	G	75	Confident	73.5	Confident	25 Å²	25	63 Å²	63	26%	0.258	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	-12.1	174	0	0	0	0	0	115.9	A184 D185 C186	G182-A184 VanDerWaalsContact C-N 3.31Å; G182-A184 PolarHBondContact O-N 3.38Å; G182-D185 PolarHBondContact O-N 3.12Å; G182-C186 PolarHBondContact O-N 3.34Å; G182-C186 PolarHBondContact O-SG 3.22Å
183	I	75.6	Confident	73.5	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-41.6	174.7	-65.1	-173	0	0	0	111.1	L99 C102 L103 L173 A176 H177 E180 D181 D185 C186 L187	L99-I183 HydrophobicContact CD1-CG1 4.47Å; L99-I183 HydrophobicContact CD1-CG2 3.87Å; C102-I183 HydrophobicContact CB-CG1 3.76Å; L103-I183 HydrophobicContact CD2-CD1 3.99Å; L173-I183 WeakPolarHBondContact O-CG2 3.18Å; A176-I183 HydrophobicContact CB-CD1 3.75Å; H177-I183 HydrophobicContact CB-CB 4.05Å; H177-I183 HydrophobicContact CB-CG2 3.83Å; E180-I183 HydrophobicContact CB-CD1 3.57Å; E180-I183 HydrophobicContact CB-CG1 4Å; E180-I183 HydrophobicContact CG-CD1 4.21Å; D181-I183 PolarHBondContact O-N 3.14Å; I183-D185 VanDerWaalsContact C-N 3.31Å; I183-D185 PolarHBondContact O-N 3.16Å; I183-C186 PolarHBondContact O-N 2.85Å; I183-C186 VanDerWaalsContact O-N 3.15Å; I183-L187 PolarHBondContact O-N 3.46Å
184	A	75.4	Confident	73.4	Confident	46 Å²	46	63.2 Å²	63.2	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-59.5	-41.2	179.4	0	0	0	0	0	112.5	G182 C186 L187	G182-A184 VanDerWaalsContact C-N 3.31Å; G182-A184 PolarHBondContact O-N 3.38Å; A184-C186 PolarHBondContact O-N 2.86Å; A184-L187 PolarHBondContact O-N 2.86Å
185	D	79.7	Confident	73.3	Confident	128 Å²	128	64 Å²	64	68%	0.684	35%	0.349	S	S	*	.	H	α-helix	trans	-68	-26.2	-179.8	-61.8	-33.5	0	0	0	112.1	G182 I183 P189	G182-D185 PolarHBondContact O-N 3.12Å; I183-D185 VanDerWaalsContact C-N 3.31Å; I183-D185 PolarHBondContact O-N 3.16Å; D185-P189 WeakPolarHBondContact O-CD 3.18Å; D185-P189 VanDerWaalsContact O-CG 3.26Å; D185-P189 WeakPolarHBondContact O-CG 3.41Å
186	C	79.9	Confident	73	Confident	12 Å²	12	59.9 Å²	59.9	8%	0.081	33%	0.333	C	S	.	.	H	α-helix	trans	-86.1	-32.5	178.1	-58.2	0	0	0	0	112.5	C98 L99 G182 I183 A184 P189 L190	C98-C186 HydrophobicContact CB-CB 4.41Å; C98-C186 WeakPolarHBondContact CB-SG 3.39Å; L99-C186 HydrophobicContact CB-CB 4.15Å; L99-C186 HydrophobicContact CD1-CB 4.32Å; G182-C186 PolarHBondContact O-N 3.34Å; G182-C186 PolarHBondContact O-SG 3.22Å; I183-C186 PolarHBondContact O-N 2.85Å; I183-C186 VanDerWaalsContact O-N 3.15Å; A184-C186 PolarHBondContact O-N 2.86Å; C186-P189 WeakPolarHBondContact O-CD 3.47Å; C186-L190 VanDerWaalsContact O-CB 3.26Å; C186-L190 WeakPolarHBondContact O-CB 3.49Å; C186-L190 PolarHBondContact O-N 3.28Å
187	L	77.8	Confident	72.5	Confident	21 Å²	21	59.9 Å²	59.9	11%	0.11	33%	0.332	C	S	.	.	H	α-helix	trans	-66.7	-43.8	-172.5	-176.2	67.5	0	0	0	112.6	L170 I174 I183 A184 L190 I191	L170-L187 HydrophobicContact CD2-CD1 3.99Å; I174-L187 HydrophobicContact CD1-CD2 4.14Å; I174-L187 HydrophobicContact CG1-CD2 3.34Å; I183-L187 PolarHBondContact O-N 3.46Å; A184-L187 PolarHBondContact O-N 2.86Å; L187-L190 WeakPolarHBondContact O-CB 3.32Å; L187-L190 PolarHBondContact O-N 3.41Å; L187-I191 HydrophobicContact CD1-CD1 4.06Å; L187-I191 HydrophobicContact CD1-CG1 4.24Å; L187-I191 HydrophobicContact CD2-CD1 4.35Å; L187-I191 HydrophobicContact CG-CD1 3.81Å; L187-I191 HydrophobicContact CG-CG1 4.36Å; L187-I191 VanDerWaalsContact O-CG1 3.32Å; L187-I191 WeakPolarHBondContact O-CG1 3.46Å; L187-I191 PolarHBondContact O-N 2.93Å
188	G	78.4	Confident	72.2	Confident	42 Å²	42	59.2 Å²	59.2	43%	0.433	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-54.8	177.4	0	0	0	0	0	112.3	L190 I191 H192	G188-L190 VanDerWaalsContact C-N 3.28Å; G188-L190 PolarHBondContact O-N 2.85Å; G188-I191 PolarHBondContact O-N 3.22Å; G188-H192 WeakPolarHBondContact O-CB 3.05Å; G188-H192 PolarHBondContact O-N 3Å
189	P	80.8	Confident	72	Confident	60 Å²	60	57.8 Å²	57.8	39%	0.39	32%	0.324	S	S	.	.	H	α-helix	trans	-57.8	-35.6	172.7	-27.9	36.7	0	0	0	113.8	P95 D185 C186 S193	P95-P189 HydrophobicContact CB-CB 3.96Å; P95-P189 HydrophobicContact CG-CB 3.69Å; D185-P189 WeakPolarHBondContact O-CD 3.18Å; D185-P189 VanDerWaalsContact O-CG 3.26Å; D185-P189 WeakPolarHBondContact O-CG 3.41Å; C186-P189 WeakPolarHBondContact O-CD 3.47Å; P189-S193 WeakPolarHBondContact O-CB 3.42Å; P189-S193 PolarHBondContact O-N 3.36Å; P189-S193 PolarHBondContact O-OG 3.35Å
190	L	78.4	Confident	71.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-65.9	-47.5	175.8	-178.4	66.2	0	0	0	111.4	P95 L96 L99 I165 C186 L187 G188 S193 M194	P95-L190 HydrophobicContact CB-CB 3.89Å; P95-L190 HydrophobicContact CB-CD1 4.33Å; L96-L190 HydrophobicContact CB-CD1 4.15Å; L99-L190 HydrophobicContact CD2-CD2 3.88Å; I165-L190 HydrophobicContact CD1-CD1 4.29Å; C186-L190 VanDerWaalsContact O-CB 3.26Å; C186-L190 WeakPolarHBondContact O-CB 3.49Å; C186-L190 PolarHBondContact O-N 3.28Å; L187-L190 WeakPolarHBondContact O-CB 3.32Å; L187-L190 PolarHBondContact O-N 3.41Å; G188-L190 VanDerWaalsContact C-N 3.28Å; G188-L190 PolarHBondContact O-N 2.85Å; L190-S193 WeakPolarHBondContact O-CB 3.37Å; L190-S193 PolarHBondContact O-N 3.31Å; L190-M194 HydrophobicContact CG-SD 4.34Å; L190-M194 WeakPolarHBondContact O-CB 3.42Å; L190-M194 VanDerWaalsContact O-CG 3.24Å; L190-M194 WeakPolarHBondContact O-CG 3.36Å; L190-M194 PolarHBondContact O-N 3.38Å
191	I	78.1	Confident	70.5	Confident	76 Å²	76	50.9 Å²	50.9	39%	0.39	29%	0.294	S	S	.	.	H	α-helix	trans	-64	-44	177.4	-67.5	169	0	0	0	110.6	L187 G188 S193 M194 E195	L187-I191 HydrophobicContact CD1-CD1 4.06Å; L187-I191 HydrophobicContact CD1-CG1 4.24Å; L187-I191 HydrophobicContact CD2-CD1 4.35Å; L187-I191 HydrophobicContact CG-CD1 3.81Å; L187-I191 HydrophobicContact CG-CG1 4.36Å; L187-I191 VanDerWaalsContact O-CG1 3.32Å; L187-I191 WeakPolarHBondContact O-CG1 3.46Å; L187-I191 PolarHBondContact O-N 2.93Å; G188-I191 PolarHBondContact O-N 3.22Å; I191-S193 VanDerWaalsContact C-N 3.33Å; I191-S193 PolarHBondContact O-N 2.84Å; I191-M194 CarbonylContact O-C 3.58Å; I191-M194 WeakPolarHBondContact O-CA 3.3Å; I191-M194 VanDerWaalsContact O-CB 3.31Å; I191-M194 WeakPolarHBondContact O-CB 2.94Å; I191-M194 PolarHBondContact O-N 2.84Å; I191-M194 VanDerWaalsContact O-N 3.09Å; I191-E195 PolarHBondContact O-N 2.84Å
192	H	77.4	Confident	69.2	Low	103 Å²	103	46.8 Å²	46.8	48%	0.477	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-43.3	178.5	-178.1	58	0	0	0	111.5	G188 M194 E195 V196	G188-H192 WeakPolarHBondContact O-CB 3.05Å; G188-H192 PolarHBondContact O-N 3Å; H192-M194 VanDerWaalsContact C-N 3.32Å; H192-M194 PolarHBondContact O-N 3.47Å; H192-E195 PolarHBondContact O-N 3.36Å; H192-V196 VanDerWaalsContact O-CG2 3.31Å; H192-V196 WeakPolarHBondContact O-CG2 3.26Å; H192-V196 PolarHBondContact O-N 3.24Å
193	S	70	Confident	67.8	Low	4 Å²	4	48.3 Å²	48.3	3%	0.028	29%	0.291	C	S	.	.	H	α-helix	trans	-53.9	-55.5	169.5	-65.8	0	0	0	0	108.5	W92 P189 L190 I191 E195 V196 L197	W92-S193 VanDerWaalsContact CD1-CB 3.42Å; W92-S193 WeakPolarHBondContact CZ2-O 3.28Å; W92-S193 PolarHBondContact NE1-O 3.28Å; P189-S193 WeakPolarHBondContact O-CB 3.42Å; P189-S193 PolarHBondContact O-N 3.36Å; P189-S193 PolarHBondContact O-OG 3.35Å; L190-S193 WeakPolarHBondContact O-CB 3.37Å; L190-S193 PolarHBondContact O-N 3.31Å; I191-S193 VanDerWaalsContact C-N 3.33Å; I191-S193 PolarHBondContact O-N 2.84Å; S193-E195 PolarHBondContact O-N 3.23Å; S193-E195 VanDerWaalsContact O-N 3.15Å; S193-V196 WeakPolarHBondContact O-CA 3.17Å; S193-V196 WeakPolarHBondContact O-CB 3.27Å; S193-V196 PolarHBondContact O-N 3.21Å; S193-L197 PolarHBondContact O-N 3.35Å
194	M	71.2	Confident	66.2	Low	37 Å²	37	51.3 Å²	51.3	18%	0.182	31%	0.309	C	S	.	.	H	α-helix	trans	-45.7	-47.3	178.2	-75.6	180	73.6	0	0	113.6	W92 I165 L170 L190 I191 H192 T198	W92-M194 HydrophobicContact CE3-CG 4.15Å; W92-M194 HydrophobicContact CH2-CB 4.05Å; W92-M194 HydrophobicContact CH2-CG 3.89Å; W92-M194 WeakPolarHBondContact CH2-O 3.39Å; W92-M194 VanDerWaalsContact CZ2-C 3.42Å; W92-M194 HydrophobicContact CZ2-CB 4.25Å; W92-M194 HydrophobicContact CZ2-CG 4.37Å; W92-M194 WeakPolarHBondContact CZ2-O 3.48Å; W92-M194 HydrophobicContact CZ3-CB 4.38Å; W92-M194 HydrophobicContact CZ3-CG 3.71Å; I165-M194 HydrophobicContact CB-CE 3.9Å; I165-M194 HydrophobicContact CB-SD 4.28Å; I165-M194 HydrophobicContact CD1-SD 4Å; I165-M194 HydrophobicContact CG2-CE 4.11Å; I165-M194 HydrophobicContact CG2-SD 4.15Å; L170-M194 HydrophobicContact CD1-CE 4.49Å; L170-M194 HydrophobicContact CD2-SD 4.35Å; L190-M194 HydrophobicContact CG-SD 4.34Å; L190-M194 WeakPolarHBondContact O-CB 3.42Å; L190-M194 VanDerWaalsContact O-CG 3.24Å; L190-M194 WeakPolarHBondContact O-CG 3.36Å; L190-M194 PolarHBondContact O-N 3.38Å; I191-M194 CarbonylContact O-C 3.58Å; I191-M194 WeakPolarHBondContact O-CA 3.3Å; I191-M194 VanDerWaalsContact O-CB 3.31Å; I191-M194 WeakPolarHBondContact O-CB 2.94Å; I191-M194 PolarHBondContact O-N 2.84Å; I191-M194 VanDerWaalsContact O-N 3.09Å; H192-M194 VanDerWaalsContact C-N 3.32Å; H192-M194 PolarHBondContact O-N 3.47Å; M194-T198 WeakPolarHBondContact O-CG2 3.39Å; M194-T198 PolarHBondContact O-N 3.21Å
195	E	70.5	Confident	64.7	Low	94 Å²	94	54 Å²	54	44%	0.439	31%	0.313	S	S	.	.	H	α-helix	trans	-63.9	-45.7	176.8	-172.1	177.6	-173.8	0	0	112.6	I191 H192 S193 L197 T198 Q199	I191-E195 PolarHBondContact O-N 2.84Å; H192-E195 PolarHBondContact O-N 3.36Å; S193-E195 PolarHBondContact O-N 3.23Å; S193-E195 VanDerWaalsContact O-N 3.15Å; E195-L197 PolarHBondContact O-N 3.16Å; E195-T198 WeakPolarHBondContact CA-OG1 3.49Å; E195-T198 WeakPolarHBondContact O-CA 3.43Å; E195-T198 PolarHBondContact O-N 3.44Å; E195-T198 PolarHBondContact O-OG1 3.38Å; E195-Q199 HydrophobicContact CG-CG 4.47Å; E195-Q199 VanDerWaalsContact CG-NE2 3.29Å; E195-Q199 WeakPolarHBondContact O-CG 3.39Å; E195-Q199 PolarHBondContact O-N 2.83Å; E195-Q199 PolarHBondContact OE1-NE2 3.32Å
196	V	63.2	Low	63	Low	38 Å²	38	54.7 Å²	54.7	23%	0.23	31%	0.312	C	S	.	.	H	α-helix	trans	-59.4	-43.8	-178	171.7	0	0	0	0	112.8	L88 H192 S193 T198 Q199 C200	L88-V196 HydrophobicContact CD2-CG1 4.21Å; H192-V196 VanDerWaalsContact O-CG2 3.31Å; H192-V196 WeakPolarHBondContact O-CG2 3.26Å; H192-V196 PolarHBondContact O-N 3.24Å; S193-V196 WeakPolarHBondContact O-CA 3.17Å; S193-V196 WeakPolarHBondContact O-CB 3.27Å; S193-V196 PolarHBondContact O-N 3.21Å; V196-T198 VanDerWaalsContact C-N 3.3Å; V196-T198 PolarHBondContact O-N 3.48Å; V196-Q199 PolarHBondContact O-N 3.41Å; V196-C200 PolarHBondContact O-N 2.85Å
197	L	57.9	Low	61.2	Low	8 Å²	8	64 Å²	64	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-70.8	-29.1	174.5	-60.1	169.4	0	0	0	111.8	C47 L88 W92 S193 E195 Q199 C200	C47-L197 HydrophobicContact CB-CD1 4.36Å; C47-L197 WeakPolarHBondContact SG-CD1 2.96Å; L88-L197 HydrophobicContact CB-CD2 3.41Å; L88-L197 VanDerWaalsContact CB-CD2 3.41Å; L88-L197 HydrophobicContact CD1-CD2 4.31Å; L88-L197 HydrophobicContact CG-CD2 4.43Å; W92-L197 HydrophobicContact CD2-CD1 3.24Å; W92-L197 HydrophobicContact CD2-CG 4.01Å; W92-L197 HydrophobicContact CE3-CD1 3.78Å; W92-L197 HydrophobicContact CG-CD1 3.65Å; W92-L197 HydrophobicContact CG-CG 4.4Å; W92-L197 HydrophobicContact CH2-CB 3.7Å; W92-L197 HydrophobicContact CH2-CD1 3.62Å; W92-L197 HydrophobicContact CH2-CG 3.97Å; W92-L197 HydrophobicContact CZ2-CB 3.09Å; W92-L197 HydrophobicContact CZ2-CD1 3.16Å; W92-L197 HydrophobicContact CZ2-CG 3.14Å; W92-L197 HydrophobicContact CZ3-CD1 3.95Å; W92-L197 VanDerWaalsContact NE1-CD1 3.26Å; S193-L197 PolarHBondContact O-N 3.35Å; E195-L197 PolarHBondContact O-N 3.16Å; L197-Q199 VanDerWaalsContact C-N 3.26Å; L197-Q199 PolarHBondContact O-N 2.93Å; L197-C200 PolarHBondContact O-N 3.37Å
198	T	62.6	Low	59.5	Low	72 Å²	72	66.7 Å²	66.7	44%	0.442	36%	0.359	S	S	.	.	H	α-helix	trans	-67.8	-28.9	178	66.1	0	0	0	0	113	K54 M194 E195 V196	K54-T198 PolarHBondContact NZ-O 3.41Å; M194-T198 WeakPolarHBondContact O-CG2 3.39Å; M194-T198 PolarHBondContact O-N 3.21Å; E195-T198 WeakPolarHBondContact CA-OG1 3.49Å; E195-T198 WeakPolarHBondContact O-CA 3.43Å; E195-T198 PolarHBondContact O-N 3.44Å; E195-T198 PolarHBondContact O-OG1 3.38Å; V196-T198 VanDerWaalsContact C-N 3.3Å; V196-T198 PolarHBondContact O-N 3.48Å
199	Q	58.8	Low	57.9	Low	103 Å²	103	67.4 Å²	67.4	48%	0.481	36%	0.361	S	S	.	.	H	α-helix	trans	-90.8	-14.7	180	-65.3	179.1	7.4	0	0	114.2	E195 V196 L197 P201 A202	E195-Q199 HydrophobicContact CG-CG 4.47Å; E195-Q199 VanDerWaalsContact CG-NE2 3.29Å; E195-Q199 WeakPolarHBondContact O-CG 3.39Å; E195-Q199 PolarHBondContact O-N 2.83Å; E195-Q199 PolarHBondContact OE1-NE2 3.32Å; V196-Q199 PolarHBondContact O-N 3.41Å; L197-Q199 VanDerWaalsContact C-N 3.26Å; L197-Q199 PolarHBondContact O-N 2.93Å; Q199-P201 VanDerWaalsContact C-N 3.31Å; Q199-P201 WeakPolarHBondContact O-CD 3.47Å; Q199-P201 VanDerWaalsContact O-N 3.12Å; Q199-A202 PolarHBondContact O-N 3.15Å
200	C	50.9	Low	56.3	Low	20 Å²	20	69.6 Å²	69.6	14%	0.135	37%	0.37	C	S	.	.	H	α-helix	trans	-54.6	-30	-174	-164.5	0	0	0	0	116.1	L88 V196 L197 A202 T204	L88-C200 HydrophobicContact CD1-CB 4.39Å; L88-C200 WeakPolarHBondContact CD1-SG 3.26Å; V196-C200 PolarHBondContact O-N 2.85Å; L197-C200 PolarHBondContact O-N 3.37Å; C200-A202 VanDerWaalsContact C-N 3.26Å; C200-A202 PolarHBondContact O-N 2.87Å; C200-T204 PolarHBondContact O-OG1 3.45Å
201	P	50	Low	54.8	Low	31 Å²	31	75.9 Å²	75.9	20%	0.201	40%	0.399	C	S	.	.	H	α-helix	trans	-67.1	-23.2	174.4	-19.3	31.7	0	0	0	114.2	K54 Q199	K54-P201 HydrophobicContact CB-CG 4.16Å; K54-P201 HydrophobicContact CD-CG 4.03Å; Q199-P201 VanDerWaalsContact C-N 3.31Å; Q199-P201 WeakPolarHBondContact O-CD 3.47Å; Q199-P201 VanDerWaalsContact O-N 3.12Å
202	A	42.4	Very low	53.3	Low	62 Å²	62	80.2 Å²	80.2	51%	0.512	42%	0.417	S	S	.	.	H	α-helix	trans	-89.9	-40.9	-174.1	0	0	0	0	0	113.3	Q199 C200 T204 K205	Q199-A202 PolarHBondContact O-N 3.15Å; C200-A202 VanDerWaalsContact C-N 3.26Å; C200-A202 PolarHBondContact O-N 2.87Å; A202-T204 VanDerWaalsContact C-N 3.31Å; A202-T204 PolarHBondContact O-N 2.84Å; A202-K205 PolarHBondContact O-N 3.44Å
203	A	44.5	Very low	51.6	Low	58 Å²	58	83.3 Å²	83.3	48%	0.479	43%	0.429	S	S	.	.	H	α-helix	trans	-69.4	-26.2	-174.7	0	0	0	0	0	113.8	K205 Q206 R207	A203-K205 VanDerWaalsContact C-N 3.33Å; A203-K205 PolarHBondContact O-N 2.82Å; A203-Q206 PolarHBondContact O-N 3.34Å; A203-R207 PolarHBondContact O-N 2.83Å
204	T	42.6	Very low	50.1	Low	62 Å²	62	90 Å²	90	38%	0.38	46%	0.458	S	S	.	.	H	α-helix	trans	-70.4	-28.9	-178.4	-53.6	0	0	0	0	112.4	C200 A202 L208	C200-T204 PolarHBondContact O-OG1 3.45Å; A202-T204 VanDerWaalsContact C-N 3.31Å; A202-T204 PolarHBondContact O-N 2.84Å; T204-L208 HydrophobicContact CG2-CD1 4.28Å; T204-L208 PolarHBondContact O-N 3.27Å
205	K	43.2	Very low	48.5	Very low	103 Å²	103	93.4 Å²	93.4	45%	0.448	48%	0.483	S	S	.	.	H	α-helix	trans	-75.5	-31.3	176.5	-70	-175.9	178.2	173.6	0	112.5	A202 A203 A209	A202-K205 PolarHBondContact O-N 3.44Å; A203-K205 VanDerWaalsContact C-N 3.33Å; A203-K205 PolarHBondContact O-N 2.82Å; K205-A209 WeakPolarHBondContact O-CB 3.37Å; K205-A209 PolarHBondContact O-N 3.43Å
206	Q	43.8	Very low	46.9	Very low	143 Å²	143	99.6 Å²	99.6	67%	0.668	50%	0.504	S	S	*	.	H	α-helix	trans	-76.1	-39.4	-179.4	-135.6	162.8	-7.4	0	0	111.7	A203 A209 D210	A203-Q206 PolarHBondContact O-N 3.34Å; Q206-A209 PolarHBondContact O-N 2.99Å; Q206-D210 PolarHBondContact O-N 3.15Å; Q206-D210 VanDerWaalsContact O-N 3.1Å
207	R	42.5	Very low	45.9	Very low	207 Å²	207	108.1 Å²	108.1	78%	0.781	53%	0.533	S	S	*	.	H	α-helix	trans	-68.2	-34.3	174.7	-83.9	-172.2	171.6	-175.3	-1	114.2	A203 E211	A203-R207 PolarHBondContact O-N 2.83Å; R207-E211 PolarHBondContact O-N 2.83Å; R207-E211 VanDerWaalsContact O-N 3.15Å
208	L	41.7	Very low	44.8	Very low	77 Å²	77	115.3 Å²	115.3	40%	0.403	57%	0.572	S	S	.	*	H	α-helix	trans	-72.8	-31	174.3	-92.5	152	0	0	0	112.7	K81 T204 H212	K81-L208 VanDerWaalsContact NZ-CD1 3.33Å; T204-L208 HydrophobicContact CG2-CD1 4.28Å; T204-L208 PolarHBondContact O-N 3.27Å; L208-H212 PolarHBondContact O-CD2 3.49Å
209	A	45.6	Very low	43.6	Very low	57 Å²	57	117.5 Å²	117.5	47%	0.471	59%	0.59	S	S	.	*	H	α-helix	trans	-72.5	-31.5	174.1	0	0	0	0	0	113	K205 Q206	K205-A209 WeakPolarHBondContact O-CB 3.37Å; K205-A209 PolarHBondContact O-N 3.43Å; Q206-A209 PolarHBondContact O-N 2.99Å
210	D	47.8	Very low	42.5	Very low	107 Å²	107	117 Å²	117	57%	0.572	60%	0.597	S	S	*	*	H	α-helix	trans	-81.4	-28	178.1	-78.3	-25.8	0	0	0	113.5	Q206 K213	Q206-D210 PolarHBondContact O-N 3.15Å; Q206-D210 VanDerWaalsContact O-N 3.1Å; D210-K213 PolarHBondContact O-N 3.37Å
211	E	46	Very low	41.9	Very low	132 Å²	132	121.4 Å²	121.4	62%	0.617	62%	0.624	S	S	*	*	H	α-helix	trans	-70.6	-29.6	172.8	-82	-98.3	120	0	0	112.7	R207 K213 K214	R207-E211 PolarHBondContact O-N 2.83Å; R207-E211 VanDerWaalsContact O-N 3.15Å; E211-K213 PolarHBondContact O-N 3.28Å; E211-K214 IonicContact OE1-NZ 2.78Å
212	H	45.9	Very low	41.2	Very low	166 Å²	166	127.1 Å²	127.1	77%	0.769	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	1.2	177.2	-88.7	-72.6	0	0	0	114.9	L208	L208-H212 PolarHBondContact O-CD2 3.49Å
213	K	41.6	Very low	40.8	Very low	169 Å²	169	135.6 Å²	135.6	74%	0.735	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	4.8	176.8	-79.3	-176	178.8	176.4	0	114.8	D210 E211 P215	D210-K213 PolarHBondContact O-N 3.37Å; E211-K213 PolarHBondContact O-N 3.28Å; K213-P215 WeakPolarHBondContact O-CD 3.14Å
214	K	38.7	Very low	40.3	Very low	143 Å²	143	137.9 Å²	137.9	62%	0.622	68%	0.682	S	S	*	*			trans	-82.6	120.1	173.3	-81.7	178.1	-178.3	165.5	0	110.9	E211 Y216	E211-K214 IonicContact OE1-NZ 2.78Å; K214-Y216 PolarHBondContact O-N 3.04Å
215	P	38.7	Very low	39.8	Very low	109 Å²	109	140 Å²	140	71%	0.708	70%	0.699	S	S	*	*			trans	-71.8	113	175.2	28.7	-30.3	0	0	0	109	K213 Y217	K213-P215 WeakPolarHBondContact O-CD 3.14Å; P215-Y217 PolarHBondContact O-N 2.89Å; P215-Y217 VanDerWaalsContact O-N 3.15Å
216	Y	37.1	Very low	39.4	Very low	224 Å²	224	144.3 Å²	144.3	88%	0.878	72%	0.721	S	S	*	*			trans	-67.5	107.9	169	-93.7	-91.8	0	0	0	109.2	K214 N218	K214-Y216 PolarHBondContact O-N 3.04Å; Y216-N218 PolarHBondContact O-N 3.17Å
217	Y	42.8	Very low	39	Very low	218 Å²	218	147 Å²	147	86%	0.855	73%	0.73	S	S	*	*			trans	-71.7	122.5	163.8	-93.3	-89.1	0	0	0	109.3	P215	P215-Y217 PolarHBondContact O-N 2.89Å; P215-Y217 VanDerWaalsContact O-N 3.15Å
218	N	33.9	Very low	38.6	Very low	159 Å²	159	146.3 Å²	146.3	85%	0.85	74%	0.736	S	S	*	*			trans	-58.3	137.3	177.2	-79.2	-33.6	0	0	0	112.5	Y216	Y216-N218 PolarHBondContact O-N 3.17Å
219	S	37.4	Very low	38.2	Very low	117 Å²	117	147.1 Å²	147.1	82%	0.818	75%	0.748	S	S	*	*			trans	-145.3	94.7	146.7	-140.5	0	0	0	0	110.3
220	S	34.7	Very low	37.4	Very low	92 Å²	92	151.9 Å²	151.9	64%	0.643	77%	0.765	S	S	*	*			trans	10.8	124.9	136.4	131.8	0	0	0	0	114.8
221	T	38.6	Very low	36.6	Very low	114 Å²	114	152.2 Å²	152.2	70%	0.699	77%	0.774	S	S	*	*				176.6	156.5	63.9	13.8	0	0	0	0	110.2
222	N	36	Very low	35.8	Very low	150 Å²	150	153.8 Å²	153.8	80%	0.802	79%	0.787	S	S	*	*			trans	95	79.1	157.5	-54.7	-22.6	0	0	0	120
223	R	33.6	Very low	35.1	Very low	240 Å²	240	151.2 Å²	151.2	91%	0.906	79%	0.788	S	S	*	*			trans	-23.4	177.2	135.1	-96.8	-165.7	175.1	174.6	0.5	117.5
224	P	35.1	Very low	34.5	Very low	107 Å²	107	152.7 Å²	152.7	70%	0.695	79%	0.794	S	S	*	*			cis	-143.6	176.7	-29.9	36.2	-17.6	0	0	0	114.8
225	S	31.5	Very low	34.4	Very low	106 Å²	106	153.7 Å²	153.7	74%	0.741	81%	0.805	S	S	*	*			trans	130.6	111.1	131.5	-164.8	0	0	0	0	114
226	E	34.8	Very low	34.2	Very low	194 Å²	194	153.8 Å²	153.8	91%	0.907	81%	0.808	S	S	*	*				-169.3	135.8	123.6	-105.7	173.1	-176.7	0	0	111.2
227	K	34.4	Very low	33.9	Very low	198 Å²	198	152.9 Å²	152.9	86%	0.861	81%	0.809	S	S	*	*			trans	-96.5	140.7	-177.7	-67.3	171.6	174.8	176.2	0	109.4
228	Q	34.9	Very low	33.6	Very low	193 Å²	193	147.4 Å²	147.4	90%	0.902	81%	0.808	S	S	*	*			trans	-178.4	118.5	144.3	-100.6	165.1	29.4	0	0	106.1
229	S	32.4	Very low	33.5	Very low	95 Å²	95	147.2 Å²	147.2	66%	0.664	81%	0.807	S	S	*	*			cis	111.5	110.3	37.7	165.7	0	0	0	0	109.8
230	L	30.2	Very low	33.5	Very low	157 Å²	157	148.7 Å²	148.7	82%	0.822	81%	0.806	S	S	*	*			trans	58.1	139.4	155.3	-74.5	94.4	0	0	0	117.8
231	C	31.4	Very low	33.8	Very low	114 Å²	114	149.3 Å²	149.3	77%	0.77	81%	0.81	S	S	*	*			cis	-162.7	135.4	37.5	-144.5	0	0	0	0	110.6
232	N	27.4	Very low	33.6	Very low	164 Å²	164	147 Å²	147	88%	0.877	81%	0.81	S	S	*	*			trans	-77.3	138	165.5	-75.8	-30.7	0	0	0	109.8
233	S	31.4	Very low	33.6	Very low	113 Å²	113	148 Å²	148	79%	0.79	81%	0.814	S	S	*	*			trans	-127.1	117.9	158.9	-165.8	0	0	0	0	109.4
234	K	30.4	Very low	34.1	Very low	199 Å²	199	142.7 Å²	142.7	87%	0.865	81%	0.808	S	S	*	*			trans	-76.8	135.1	170.3	-71.3	175.5	174.9	179.2	0	108.3
235	I	36.2	Very low	34	Very low	164 Å²	164	145.3 Å²	145.3	84%	0.841	82%	0.816	S	S	*	*			trans	-125.1	134.7	156.3	-63.2	178.9	0	0	0	108.6
236	S	33.3	Very low	34.6	Very low	111 Å²	111	144.9 Å²	144.9	78%	0.776	82%	0.819	S	S	*	*			trans	-77.8	149.1	-160	-29.5	0	0	0	0	113.4
237	K	31.2	Very low	34.7	Very low	206 Å²	206	142.3 Å²	142.3	90%	0.896	81%	0.811	S	S	*	*			trans	-74.9	145.1	159.6	-70.7	-174.8	173.3	-172.9	0	110.2
238	A	37	Very low	34.7	Very low	102 Å²	102	140 Å²	140	84%	0.843	81%	0.809	S	S	*	*			trans	-137.5	120.1	154.1	0	0	0	0	0	107.9
239	D	31.6	Very low	34.9	Very low	156 Å²	156	134.6 Å²	134.6	83%	0.834	80%	0.804	S	S	*	*			trans	-67	152	163.3	-65.5	-47.9	0	0	0	109.6
240	D	37.7	Very low	35	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	81%	0.811	S	S	*	*				178.8	145.3	112.6	-152.3	-9.7	0	0	0	111.4
241	S	40.7	Very low	35.9	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	81%	0.81	S	S	*	*			trans	1.2	153	160.7	55.1	0	0	0	0	121.4
242	G	33.8	Very low	36.4	Very low	67 Å²	67	140.4 Å²	140.4	69%	0.691	81%	0.808	S	S	*	*			cis	163.3	174.4	7.9	0	0	0	0	0	110.4
243	L	36.6	Very low	36.7	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	81%	0.808	S	S	*	*			trans	83.2	116.4	151.8	-87.8	143.8	0	0	0	121.7
244	V	43.3	Very low	37.5	Very low	130 Å²	130	142 Å²	142	79%	0.788	81%	0.806	S	S	*	*			trans	100.9	118.3	134.5	-137.8	0	0	0	0	121.3
245	N	33.1	Very low	37.8	Very low	161 Å²	161	140.5 Å²	140.5	86%	0.861	81%	0.806	S	S	*	*			trans	-77.5	149.9	166.5	-62.9	-38.5	0	0	0	112.9
246	A	44.2	Very low	38.1	Very low	97 Å²	97	141 Å²	141	80%	0.802	80%	0.804	S	S	*	*			trans	-156.6	106.8	148.4	0	0	0	0	0	106.6
247	D	37.5	Very low	38.4	Very low	140 Å²	140	144.5 Å²	144.5	75%	0.749	81%	0.808	S	S	*	*				81.3	105.6	79.6	-162.4	31.2	0	0	0	113.9
248	N	35.1	Very low	38.9	Very low	151 Å²	151	143.9 Å²	143.9	81%	0.807	81%	0.808	S	S	*	*			trans	34.1	133.7	147.6	-65.6	-33.9	0	0	0	123.2
249	G	38	Very low	39.4	Very low	79 Å²	79	145.5 Å²	145.5	81%	0.814	80%	0.803	S	S	*	*			trans	-161.6	98.5	156.9	0	0	0	0	0	111.2
250	D	35.8	Very low	40.1	Very low	150 Å²	150	142 Å²	142	80%	0.802	79%	0.787	S	S	*	*			trans	-62.3	164.7	171.4	-74.5	-42.5	0	0	0	113.7
251	K	49.1	Very low	40.7	Very low	182 Å²	182	139.2 Å²	139.2	79%	0.791	77%	0.772	S	S	*	*			trans	121.3	135.3	158.2	-68.7	171.6	178.2	-162.3	0	112.8
252	E	41.6	Very low	41.4	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	77%	0.766	S	S	*	*			cis	-163.6	145.2	7.9	-108.4	157.5	-153.2	0	0	106.5
253	D	33.4	Very low	42.7	Very low	166 Å²	166	140.9 Å²	140.9	89%	0.888	75%	0.748	S	S	*	*			trans	-71.8	127.9	175.7	-70.5	-49.3	0	0	0	111.5
254	I	48.7	Very low	43.8	Very low	145 Å²	145	139.3 Å²	139.3	74%	0.744	74%	0.736	S	S	*	*			trans	-124.8	118.5	167.2	-56.9	178.2	0	0	0	108.5	E256	I254-E256 HydrophobicContact CG2-CG 4.23Å
255	I	35.4	Very low	45.2	Very low	167 Å²	167	135.6 Å²	135.6	86%	0.856	71%	0.711	S	S	*	*			trans	-87.1	117.6	173	-61.4	166.7	0	0	0	106.6
256	E	43.3	Very low	46.9	Very low	175 Å²	175	132.5 Å²	132.5	82%	0.818	70%	0.695	S	S	*	*			trans	-111.3	129.9	170.8	-79.6	-173.9	168.3	0	0	111.1	I254	I254-E256 HydrophobicContact CG2-CG 4.23Å
257	E	40	Very low	48	Very low	183 Å²	183	131 Å²	131	86%	0.855	68%	0.676	S	S	*	*			trans	-60.9	136.4	179.4	-71.5	170.3	134.7	0	0	111.9	D259	E257-D259 PolarHBondContact O-N 3.14Å; E257-D259 VanDerWaalsContact O-N 3.12Å
258	Q	41.2	Very low	49	Very low	193 Å²	193	131.3 Å²	131.3	90%	0.902	68%	0.677	S	S	*	*			trans	-80.1	88.5	175.5	-71.8	-172.3	-1	0	0	110.7
259	D	47.7	Very low	50.5	Low	137 Å²	137	127.1 Å²	127.1	73%	0.733	67%	0.67	S	S	*	*			trans	-79	117.4	161.2	-84	-23.5	0	0	0	109.4	E257 I261	E257-D259 PolarHBondContact O-N 3.14Å; E257-D259 VanDerWaalsContact O-N 3.12Å; D259-I261 PolarHBondContact O-N 3.44Å
260	T	47	Very low	51.1	Low	82 Å²	82	127.8 Å²	127.8	50%	0.503	65%	0.652	S	S	.	*			trans	-67.7	97.9	175.5	-35	0	0	0	0	108.9	F262 V275 K276	T260-F262 HydrophobicContact CG2-CZ 4.42Å; T260-V275 HydrophobicContact CG2-CG1 3.6Å; T260-K276 VanDerWaalsContact CG2-O 3.31Å; T260-K276 WeakPolarHBondContact CG2-O 3.23Å
261	I	49.5	Very low	52.3	Low	90 Å²	90	127.5 Å²	127.5	46%	0.462	65%	0.645	S	S	.	*			trans	-84	124	179.9	-62.5	161.8	0	0	0	108.9	D259 K276	D259-I261 PolarHBondContact O-N 3.44Å; I261-K276 HydrophobicContact CB-CB 4.48Å; I261-K276 HydrophobicContact CB-CD 4Å; I261-K276 HydrophobicContact CB-CG 4.43Å; I261-K276 HydrophobicContact CG2-CD 4.31Å; I261-K276 WeakPolarHBondContact O-CB 3.34Å; I261-K276 WeakPolarHBondContact O-CG 3.24Å; I261-K276 PolarHBondContact O-N 3.37Å; I261-K276 VanDerWaalsContact O-N 3.13Å
262	F	55.8	Low	52.8	Low	137 Å²	137	122 Å²	122	60%	0.601	62%	0.621	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	135.8	171.9	-60.4	-87.4	0	0	0	109.8	T260 V273 I274 V275	T260-F262 HydrophobicContact CG2-CZ 4.42Å; F262-V273 HydrophobicContact CB-CG1 4.25Å; F262-V273 HydrophobicContact CD1-CG1 3.97Å; F262-I274 WeakPolarHBondContact CA-O 3.35Å; F262-V275 HydrophobicContact CD1-CB 4.46Å; F262-V275 HydrophobicContact CD1-CG1 4.39Å; F262-V275 HydrophobicContact CD1-CG2 3.92Å; F262-V275 HydrophobicContact CE1-CB 4.3Å; F262-V275 HydrophobicContact CE1-CG1 3.88Å; F262-V275 HydrophobicContact CE1-CG2 3.74Å; F262-V275 HydrophobicContact CZ-CG1 4.47Å
263	E	61.4	Low	53.7	Low	68 Å²	68	118.5 Å²	118.5	32%	0.318	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-133.1	129.7	173.5	-168.2	166.8	177.4	0	0	111.7	L151 V273 I274 K276	L151-E263 WeakPolarHBondContact CD1-OE1 3.43Å; L151-E263 WeakPolarHBondContact CD1-OE2 3.39Å; L151-E263 WeakPolarHBondContact CD2-OE2 3.07Å; E263-V273 WeakPolarHBondContact O-CA 3.18Å; E263-I274 PolarHBondContact N-O 3.06Å; E263-I274 PolarHBondContact O-N 3.31Å; E263-K276 IonicContact OE2-NZ 3.48Å
264	E	59.3	Low	54.9	Low	137 Å²	137	113.9 Å²	113.9	64%	0.64	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-95.1	121.6	179.6	-79.3	172.3	-171.7	0	0	110.6	F272 V273	E264-F272 CarbonylContact C-O 3.59Å; E264-F272 WeakPolarHBondContact CA-O 3.22Å; E264-V273 HydrophobicContact CG-CG2 3.75Å
265	I	72.1	Confident	55.6	Low	52 Å²	52	111.2 Å²	111.2	27%	0.267	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.5	125.2	176.7	-53.2	-177.5	0	0	0	109.2	V267 E271 F272 I274	I265-V267 HydrophobicContact CG2-CG2 4.02Å; I265-E271 CarbonylContact O-C 3.54Å; I265-E271 WeakPolarHBondContact O-CA 3.45Å; I265-F272 PolarHBondContact N-O 3.37Å; I265-F272 PolarHBondContact O-N 3.35Å; I265-I274 HydrophobicContact CD1-CD1 3.54Å; I265-I274 HydrophobicContact CD1-CG1 4.44Å; I265-I274 HydrophobicContact CG1-CD1 4.39Å
266	N	68.8	Low	56.4	Low	95 Å²	95	110.4 Å²	110.4	51%	0.508	57%	0.566	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.6	119.8	172.1	-168.9	-44.5	0	0	0	110.7	G269 E270 E271	N266-G269 VanDerWaalsContact OD1-CA 3.27Å; N266-G269 WeakPolarHBondContact OD1-CA 3.38Å; N266-G269 PolarHBondContact OD1-N 2.92Å; N266-E270 CarbonylContact C-O 3.57Å; N266-E270 WeakPolarHBondContact CA-O 3.44Å; N266-E271 HydrophobicContact CB-CG 4.41Å
267	V	68.2	Low	57	Low	67 Å²	67	107.2 Å²	107.2	41%	0.406	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.4	108.3	173.3	-175.7	0	0	0	0	109	I265 G269 E270 F272	I265-V267 HydrophobicContact CG2-CG2 4.02Å; V267-G269 PolarHBondContact O-N 3.42Å; V267-E270 PolarHBondContact N-O 3.46Å; V267-E270 PolarHBondContact O-N 3.35Å; V267-E270 VanDerWaalsContact O-N 3.11Å; V267-F272 HydrophobicContact CB-CD2 4.34Å; V267-F272 HydrophobicContact CB-CE2 3.99Å; V267-F272 HydrophobicContact CG2-CD2 4.23Å; V267-F272 HydrophobicContact CG2-CE2 4.3Å
268	N	58	Low	57.9	Low	145 Å²	145	103.2 Å²	103.2	78%	0.775	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	35.3	178.6	-64.5	-33.1	0	0	0	114.4
269	G	65.7	Low	58.9	Low	63 Å²	63	98.2 Å²	98.2	65%	0.649	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.1	-0.7	180	0	0	0	0	0	114.9	N266 V267	N266-G269 VanDerWaalsContact OD1-CA 3.27Å; N266-G269 WeakPolarHBondContact OD1-CA 3.38Å; N266-G269 PolarHBondContact OD1-N 2.92Å; V267-G269 PolarHBondContact O-N 3.42Å
270	E	51.9	Low	59.5	Low	94 Å²	94	95.9 Å²	95.9	44%	0.439	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	122.8	169.7	-69	-177.7	-171.5	0	0	109.6	R117 N266 V267 F272	R117-E270 IonicContact CZ-OE2 2.88Å; R117-E270 IonicContact NE-OE2 3.14Å; R117-E270 IonicContact NH2-OE2 3.51Å; R117-E270 PolarHBondContact NH2-OE2 3.21Å; N266-E270 CarbonylContact C-O 3.57Å; N266-E270 WeakPolarHBondContact CA-O 3.44Å; V267-E270 PolarHBondContact N-O 3.46Å; V267-E270 PolarHBondContact O-N 3.35Å; V267-E270 VanDerWaalsContact O-N 3.11Å; E270-F272 HydrophobicContact CB-CD2 4.43Å; E270-F272 HydrophobicContact CB-CE2 3.62Å; E270-F272 HydrophobicContact CB-CZ 4.05Å; E270-F272 WeakPolarHBondContact O-CD2 3.37Å; E270-F272 WeakPolarHBondContact O-CE2 3.23Å; E270-F272 WeakPolarHBondContact OE2-CZ 3.29Å
271	E	61.2	Low	60.3	Low	143 Å²	143	96.8 Å²	96.8	67%	0.668	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	131.5	172.9	-74.5	172.4	176.7	0	0	110.7	I265 N266	I265-E271 CarbonylContact O-C 3.54Å; I265-E271 WeakPolarHBondContact O-CA 3.45Å; N266-E271 HydrophobicContact CB-CG 4.41Å
272	F	58.6	Low	61	Low	66 Å²	66	97.3 Å²	97.3	29%	0.289	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	122.2	177.3	-65.4	-92.7	0	0	0	109	E264 I265 V267 E270	E264-F272 CarbonylContact C-O 3.59Å; E264-F272 WeakPolarHBondContact CA-O 3.22Å; I265-F272 PolarHBondContact N-O 3.37Å; I265-F272 PolarHBondContact O-N 3.35Å; V267-F272 HydrophobicContact CB-CD2 4.34Å; V267-F272 HydrophobicContact CB-CE2 3.99Å; V267-F272 HydrophobicContact CG2-CD2 4.23Å; V267-F272 HydrophobicContact CG2-CE2 4.3Å; E270-F272 HydrophobicContact CB-CD2 4.43Å; E270-F272 HydrophobicContact CB-CE2 3.62Å; E270-F272 HydrophobicContact CB-CZ 4.05Å; E270-F272 WeakPolarHBondContact O-CD2 3.37Å; E270-F272 WeakPolarHBondContact O-CE2 3.23Å; E270-F272 WeakPolarHBondContact OE2-CZ 3.29Å
273	V	59.7	Low	61.4	Low	83 Å²	83	94.4 Å²	94.4	50%	0.503	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.7	170.4	-176.8	0	0	0	0	108.2	F262 E263 E264	F262-V273 HydrophobicContact CB-CG1 4.25Å; F262-V273 HydrophobicContact CD1-CG1 3.97Å; E263-V273 WeakPolarHBondContact O-CA 3.18Å; E264-V273 HydrophobicContact CG-CG2 3.75Å
274	I	59.1	Low	61.4	Low	69 Å²	69	96.5 Å²	96.5	35%	0.354	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.2	170.5	-57.4	-178.2	0	0	0	107.9	F262 E263 I265	F262-I274 WeakPolarHBondContact CA-O 3.35Å; E263-I274 PolarHBondContact N-O 3.06Å; E263-I274 PolarHBondContact O-N 3.31Å; I265-I274 HydrophobicContact CD1-CD1 3.54Å; I265-I274 HydrophobicContact CD1-CG1 4.44Å; I265-I274 HydrophobicContact CG1-CD1 4.39Å
275	V	63.9	Low	61.6	Low	89 Å²	89	93.1 Å²	93.1	54%	0.539	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	118.3	170.6	-171	0	0	0	0	107.3	T260 F262	T260-V275 HydrophobicContact CG2-CG1 3.6Å; F262-V275 HydrophobicContact CD1-CB 4.46Å; F262-V275 HydrophobicContact CD1-CG1 4.39Å; F262-V275 HydrophobicContact CD1-CG2 3.92Å; F262-V275 HydrophobicContact CE1-CB 4.3Å; F262-V275 HydrophobicContact CE1-CG1 3.88Å; F262-V275 HydrophobicContact CE1-CG2 3.74Å; F262-V275 HydrophobicContact CZ-CG1 4.47Å
276	K	51.6	Low	60.6	Low	151 Å²	151	96.8 Å²	96.8	66%	0.657	53%	0.526	S	S	*	.			trans	-75.2	0	174.3	-71.1	-167.7	-163.9	160.4	0	112.2	T260 I261 E263	T260-K276 VanDerWaalsContact CG2-O 3.31Å; T260-K276 WeakPolarHBondContact CG2-O 3.23Å; I261-K276 HydrophobicContact CB-CB 4.48Å; I261-K276 HydrophobicContact CB-CD 4Å; I261-K276 HydrophobicContact CB-CG 4.43Å; I261-K276 HydrophobicContact CG2-CD 4.31Å; I261-K276 WeakPolarHBondContact O-CB 3.34Å; I261-K276 WeakPolarHBondContact O-CG 3.24Å; I261-K276 PolarHBondContact O-N 3.37Å; I261-K276 VanDerWaalsContact O-N 3.13Å; E263-K276 IonicContact OE2-NZ 3.48Å

Retrieved 276 of 276 residues in 185.2 ms (Link to these results)

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